0 B6R1.2 BrC1=CCCC1 MCULE-1008379150 [0,0,0,0,0,0|1,0,1]=2 1 B6R1.2 BrC1=COCC1 MCULE-8057569313 [0,0,0,0,0,0|2,0,1]=3 2 B6R1.2 BrC1CC=CC1 MCULE-8834603275 [0,0,0,0,0,0|1,0,3]=4 3 B6R1.2 BrC1CCCC1 MCULE-9383923023 [0,0,0,0,0,0|1,0,1]=2 4 B6R1.2 BrC1CCNC1 MCULE-4841543716 [0,0,0,0,0,0|2,0,1]=3 5 B6R1.2 BrC1CCNC1 MCULE-4954951045 [0,0,0,0,0,0|2,0,1]=3 6 B6R1.2 BrC1CCNC1 MCULE-7176123276 [0,0,0,0,0,0|2,0,1]=3 7 B6R1.2 BrC1CCOC1 MCULE-7037144528 [0,0,0,0,0,0|2,0,1]=3 8 B6R1.2 BrC1CCSC1 MCULE-6663716947 [0,0,0,0,0,0|2,0,1]=3 9 B6R1.2 Br[C@@H]1CCNC1 MCULE-1681494552 [0,0,0,0,0,0|2,0,1]=3 10 B6R1.2 Br[C@@H]1CCNC1 MCULE-1764777534 [0,0,0,0,0,0|2,0,1]=3 11 B6R1.2 Br[C@@H]1CCNC1 MCULE-2455801012 [0,0,0,0,0,0|2,0,1]=3 12 B6R1.2 Br[C@@H]1CCNC1 MCULE-8945784733 [0,0,0,0,0,0|2,0,1]=3 13 B6R1.2 Br[C@H]1CCNC1 MCULE-5014033994 [0,0,0,0,0,0|2,0,1]=3 14 B6R1.2 Br[C@H]1CCNC1 MCULE-5217617272 [0,0,0,0,0,0|2,0,1]=3 15 B6R1.2 Br[C@H]1CCNC1 MCULE-8899453530 [0,0,0,0,0,0|2,0,1]=3 16 B6R1.2 Br[C@H]1CCNC1 MCULE-9461718131 [0,0,0,0,0,0|2,0,1]=3 17 B6R1.2 Br[C@H]1CCOC1 MCULE-7554969036 [0,0,0,0,0,0|2,0,1]=3 18 B6R1.2 C1(CCNC1)C MCULE-2542646403 [0,0,0,0,0,0|2,0,1]=3 19 B6R1.2 C1(CCNC1)C MCULE-4538835016 [0,0,0,0,0,0|2,0,1]=3 20 B6R1.2 C1(CCNC1)F MCULE-2259566125 [0,0,0,0,0,0|2,0,1]=3 21 B6R1.2 C1(CCNC1)F MCULE-3325393466 [0,0,0,0,0,0|2,0,1]=3 22 B6R1.2 C1(CCNC1)O MCULE-2676539647 [0,0,0,0,0,0|1,0,2]=3 23 B6R1.2 C1(CCNC1)O MCULE-4228466615 [0,0,0,0,0,0|1,0,2]=3 24 B6R1.2 C1(CCOC1)I MCULE-4877322062 [0,0,0,0,0,0|2,0,1]=3 25 B6R1.2 C1(CCOC1)N MCULE-2221007915 [0,0,0,0,0,0|2,0,1]=3 26 B6R1.2 C1(CCOC1)N MCULE-3972931474 [0,0,0,0,0,0|2,0,1]=3 27 B6R1.2 C1(CCOC1)O MCULE-3631749536 [0,0,0,0,0,0|1,0,2]=3 28 B6R1.2 C=C1CCCC1 MCULE-4115373196 [0,0,0,0,0,0|1,0,0]=1 29 B6R1.2 C=C1CCNC1 MCULE-7982953073 [0,0,0,0,0,0|2,0,0]=2 30 B6R1.2 C=C1CCNC1 MCULE-8428731599 [0,0,0,0,0,0|2,0,0]=2 31 B6R1.2 C=C1CCSC1 MCULE-7042571473 [0,0,0,0,0,0|2,0,0]=2 32 B6R1.2 CC1=CC=CC1 MCULE-3765599626 [0,0,0,0,0,0|1,0,3]=4 33 B6R1.2 CC1=CCCC1 MCULE-8508688474 [0,0,0,0,0,0|1,0,1]=2 34 B6R1.2 CC1=CCCO1 MCULE-7276659214 [0,0,0,0,0,0|2,0,1]=3 35 B6R1.2 CC1=CCNC1 MCULE-5892113847 [0,0,0,0,0,0|2,0,1]=3 36 B6R1.2 CC1=CCNC1 MCULE-9225220351 [0,0,0,0,0,0|2,0,1]=3 37 B6R1.2 CC1=NCCC1 MCULE-5009170423 [0,0,0,0,0,0|2,0,0]=2 38 B6R1.2 CC1=NCCN1 MCULE-4787238872 [0,0,0,0,0,0|3,0,0]=3 39 B6R1.2 CC1=NCCO1 MCULE-8564633040 [0,0,0,0,0,0|3,0,0]=3 40 B6R1.2 CC1=NCCS1 MCULE-1701303405 [0,0,0,0,0,0|3,0,0]=3 41 B6R1.2 CC1=NNCC1 MCULE-1758510182 [0,0,0,0,0,0|3,0,0]=3 42 B6R1.2 CC1C=CCC1 MCULE-1638534048 [0,0,0,0,0,0|1,0,3]=4 43 B6R1.2 CC1CCCC1 MCULE-4702116068 [0,0,0,0,0,0|1,0,1]=2 44 B6R1.2 CC1CCCN1 MCULE-4853624560 [0,0,0,0,0,0|2,0,1]=3 45 B6R1.2 CC1CCCN1 MCULE-5939948024 [0,0,0,0,0,0|2,0,1]=3 46 B6R1.2 CC1CCCN1 MCULE-6020011445 [0,0,0,0,0,0|2,0,1]=3 47 B6R1.2 CC1CCCN1 MCULE-7855346849 [0,0,0,0,0,0|2,0,1]=3 48 B6R1.2 CC1CCCO1 MCULE-2526138687 [0,0,0,0,0,0|2,0,1]=3 49 B6R1.2 CC1CCCS1 MCULE-8372499972 [0,0,0,0,0,0|2,0,1]=3 50 B6R1.2 CC1CCNC1 MCULE-6494098173 [0,0,0,0,0,0|2,0,1]=3 51 B6R1.2 CC1CCNC1 MCULE-8260364514 [0,0,0,0,0,0|2,0,1]=3 52 B6R1.2 CC1CCOC1 MCULE-6424683416 [0,0,0,0,0,0|2,0,1]=3 53 B6R1.2 CC1CCSC1 MCULE-7445511318 [0,0,0,0,0,0|2,0,1]=3 54 B6R1.2 CC1CNOC1 MCULE-1071803164 [0,0,0,0,0,0|3,0,1]=4 55 B6R1.2 CC1CNOC1 MCULE-9455391174 [0,0,0,0,0,0|3,0,1]=4 56 B6R1.2 CC1COCO1 MCULE-9332316279 [0,0,0,0,0,0|3,0,1]=4 57 B6R1.2 CC1NCCS1 MCULE-8457840375 [0,0,0,0,0,0|3,0,1]=4 58 B6R1.2 CC1OCCO1 MCULE-2943809591 [0,0,0,0,0,0|3,0,1]=4 59 B6R1.2 CC1SCCS1 MCULE-5011453273 [0,0,0,0,0,0|3,0,1]=4 60 B6R1.2 CN1CC=CC1 MCULE-2586884916 [0,0,0,0,0,0|2,0,2]=4 61 B6R1.2 CN1CCCC1 MCULE-5387702231 [0,0,0,0,0,0|2,0,0]=2 62 B6R1.2 CN1CCNC1 MCULE-8059197564 [0,0,0,0,0,0|3,0,0]=3 63 B6R1.2 CN1CCNC1 MCULE-9818601515 [0,0,0,0,0,0|3,0,0]=3 64 B6R1.2 CN1CCOC1 MCULE-5504672404 [0,0,0,0,0,0|3,0,0]=3 65 B6R1.2 C[C@@H]1CCCN1 MCULE-1038329474 [0,0,0,0,0,0|2,0,1]=3 66 B6R1.2 C[C@@H]1CCCN1 MCULE-1829999308 [0,0,0,0,0,0|2,0,1]=3 67 B6R1.2 C[C@@H]1CCCN1 MCULE-8644278041 [0,0,0,0,0,0|2,0,1]=3 68 B6R1.2 C[C@@H]1CCCN1 MCULE-9243990647 [0,0,0,0,0,0|2,0,1]=3 69 B6R1.2 C[C@@H]1CCNC1 MCULE-5345577321 [0,0,0,0,0,0|2,0,1]=3 70 B6R1.2 C[C@@H]1CCNC1 MCULE-5749945455 [0,0,0,0,0,0|2,0,1]=3 71 B6R1.2 C[C@@H]1CCNC1 MCULE-8967606188 [0,0,0,0,0,0|2,0,1]=3 72 B6R1.2 C[C@@H]1CCNC1 MCULE-8996756392 [0,0,0,0,0,0|2,0,1]=3 73 B6R1.2 C[C@H]1CCCN1 MCULE-2078024663 [0,0,0,0,0,0|2,0,1]=3 74 B6R1.2 C[C@H]1CCCN1 MCULE-3113877345 [0,0,0,0,0,0|2,0,1]=3 75 B6R1.2 C[C@H]1CCCN1 MCULE-3426869473 [0,0,0,0,0,0|2,0,1]=3 76 B6R1.2 C[C@H]1CCCN1 MCULE-5093266679 [0,0,0,0,0,0|2,0,1]=3 77 B6R1.2 C[C@H]1CCNC1 MCULE-1866792897 [0,0,0,0,0,0|2,0,1]=3 78 B6R1.2 C[C@H]1CCNC1 MCULE-3817248567 [0,0,0,0,0,0|2,0,1]=3 79 B6R1.2 C[C@H]1CCNC1 MCULE-7938243226 [0,0,0,0,0,0|2,0,1]=3 80 B6R1.2 C[C@H]1CCNC1 MCULE-8895875203 [0,0,0,0,0,0|2,0,1]=3 81 B6R1.2 C[S+]1CCCC1 MCULE-6294888335 [0,0,0,0,0,0|2,0,0]=2 82 B6R1.2 C[S+]1CCCC1 MCULE-8432227262 [0,0,0,0,0,0|2,0,0]=2 83 B6R1.2 ClC1=CCCC1 MCULE-7680993065 [0,0,0,0,0,0|1,0,1]=2 84 B6R1.2 ClC1=NCCN1 MCULE-2043711677 [0,0,0,0,0,0|3,0,0]=3 85 B6R1.2 ClC1=NCCN1 MCULE-2296476673 [0,0,0,0,0,0|3,0,0]=3 86 B6R1.2 ClC1CCCC1 MCULE-3285928655 [0,0,0,0,0,0|1,0,1]=2 87 B6R1.2 ClC1CCNC1 MCULE-5659561118 [0,0,0,0,0,0|2,0,1]=3 88 B6R1.2 ClC1CCNC1 MCULE-6180477494 [0,0,0,0,0,0|2,0,1]=3 89 B6R1.2 ClC1CCNC1 MCULE-6964859207 [0,0,0,0,0,0|2,0,1]=3 90 B6R1.2 ClC1CCNC1 MCULE-8389509440 [0,0,0,0,0,0|2,0,1]=3 91 B6R1.2 ClC1CCOC1 MCULE-6903762147 [0,0,0,0,0,0|2,0,1]=3 92 B6R1.2 ClP1OCCO1 MCULE-2550894251 [0,0,0,0,0,0|4,0,0]=4 93 B6R1.2 Cl[C@@H]1CCNC1 MCULE-3218152098 [0,0,0,0,0,0|2,0,1]=3 94 B6R1.2 Cl[C@@H]1CCNC1 MCULE-6728755007 [0,0,0,0,0,0|2,0,1]=3 95 B6R1.2 Cl[C@@H]1CCNC1 MCULE-7223308304 [0,0,0,0,0,0|2,0,1]=3 96 B6R1.2 Cl[C@@H]1CCNC1 MCULE-9699335522 [0,0,0,0,0,0|2,0,1]=3 97 B6R1.2 Cl[C@H]1CCNC1 MCULE-1696981588 [0,0,0,0,0,0|2,0,1]=3 98 B6R1.2 Cl[C@H]1CCNC1 MCULE-4535592624 [0,0,0,0,0,0|2,0,1]=3 99 B6R1.2 Cl[C@H]1CCNC1 MCULE-4850151938 [0,0,0,0,0,0|2,0,1]=3 100 B6R1.2 Cl[C@H]1CCNC1 MCULE-8947782807 [0,0,0,0,0,0|2,0,1]=3 101 B6R1.2 FC1CCCC1 MCULE-1416016970 [0,0,0,0,0,0|1,0,1]=2 102 B6R1.2 FC1CCNC1 MCULE-3601135445 [0,0,0,0,0,0|2,0,1]=3 103 B6R1.2 FC1CCNC1 MCULE-8578750940 [0,0,0,0,0,0|2,0,1]=3 104 B6R1.2 FC1CNOC1 MCULE-4837734523 [0,0,0,0,0,0|3,0,1]=4 105 B6R1.2 FC1CNOC1 MCULE-6176254900 [0,0,0,0,0,0|3,0,1]=4 106 B6R1.2 F[C@@H]1CCNC1 MCULE-4408739710 [0,0,0,0,0,0|2,0,1]=3 107 B6R1.2 F[C@@H]1CCNC1 MCULE-5678498844 [0,0,0,0,0,0|2,0,1]=3 108 B6R1.2 F[C@@H]1CCNC1 MCULE-5679054116 [0,0,0,0,0,0|2,0,1]=3 109 B6R1.2 F[C@@H]1CCNC1 MCULE-7029204180 [0,0,0,0,0,0|2,0,1]=3 110 B6R1.2 F[C@H]1CCCN1 MCULE-8612757365 [0,0,0,0,0,0|2,0,1]=3 111 B6R1.2 F[C@H]1CCNC1 MCULE-2854402872 [0,0,0,0,0,0|2,0,1]=3 112 B6R1.2 F[C@H]1CCNC1 MCULE-4493640982 [0,0,0,0,0,0|2,0,1]=3 113 B6R1.2 F[C@H]1CCNC1 MCULE-7441383471 [0,0,0,0,0,0|2,0,1]=3 114 B6R1.2 F[C@H]1CCNC1 MCULE-7946601643 [0,0,0,0,0,0|2,0,1]=3 115 B6R1.2 IC1=CCCC1 MCULE-5953451970 [0,0,0,0,0,0|1,0,1]=2 116 B6R1.2 IC1=COCC1 MCULE-3076361502 [0,0,0,0,0,0|2,0,1]=3 117 B6R1.2 IC1CCCC1 MCULE-2705379744 [0,0,0,0,0,0|1,0,1]=2 118 B6R1.2 IC1CCNC1 MCULE-3058541551 [0,0,0,0,0,0|2,0,1]=3 119 B6R1.2 IC1CCNC1 MCULE-5326267139 [0,0,0,0,0,0|2,0,1]=3 120 B6R1.2 IC1CCOC1 MCULE-1379775972 [0,0,0,0,0,0|2,0,1]=3 121 B6R1.2 I[C@@H]1CCNC1 MCULE-3800433724 [0,0,0,0,0,0|2,0,1]=3 122 B6R1.2 I[C@@H]1CCNC1 MCULE-3857825133 [0,0,0,0,0,0|2,0,1]=3 123 B6R1.2 I[C@@H]1CCNC1 MCULE-7781267462 [0,0,0,0,0,0|2,0,1]=3 124 B6R1.2 I[C@@H]1CCNC1 MCULE-7979843810 [0,0,0,0,0,0|2,0,1]=3 125 B6R1.2 I[C@@H]1CCOC1 MCULE-2036157502 [0,0,0,0,0,0|2,0,1]=3 126 B6R1.2 I[C@@H]1CCOC1 MCULE-4800752659 [0,0,0,0,0,0|2,0,1]=3 127 B6R1.2 I[C@H]1CCNC1 MCULE-1218289403 [0,0,0,0,0,0|2,0,1]=3 128 B6R1.2 I[C@H]1CCNC1 MCULE-7469922084 [0,0,0,0,0,0|2,0,1]=3 129 B6R1.2 I[C@H]1CCOC1 MCULE-4242860607 [0,0,0,0,0,0|2,0,1]=3 130 B6R1.2 I[C@H]1CCOC1 MCULE-7095404975 [0,0,0,0,0,0|2,0,1]=3 131 B6R1.2 N=C1CCCS1 MCULE-4228855265 [0,0,0,0,0,0|2,0,0]=2 132 B6R1.2 N=C1CCCS1 MCULE-7496124035 [0,0,0,0,0,0|2,0,0]=2 133 B6R1.2 N=C1NCCN1 MCULE-4983030911 [0,0,0,0,0,0|3,0,0]=3 134 B6R1.2 NC1=CCNN1 MCULE-1539779543 [0,0,0,0,0,0|3,0,1]=4 135 B6R1.2 NC1=CCNN1 MCULE-3460056890 [0,0,0,0,0,0|3,0,1]=4 136 B6R1.2 NC1=CCNN1 MCULE-5423983278 [0,0,0,0,0,0|3,0,1]=4 137 B6R1.2 NC1=NCCC1 MCULE-6089369366 [0,0,0,0,0,0|2,0,0]=2 138 B6R1.2 NC1=NCCC1 MCULE-8979618464 [0,0,0,0,0,0|2,0,0]=2 139 B6R1.2 NC1=NCCN1 MCULE-1788173657 [0,0,0,0,0,0|3,0,0]=3 140 B6R1.2 NC1=NCCN1 MCULE-9804694628 [0,0,0,0,0,0|3,0,0]=3 141 B6R1.2 NC1=NCCO1 MCULE-1257431295 [0,0,0,0,0,0|3,0,0]=3 142 B6R1.2 NC1=NCCO1 MCULE-9912511107 [0,0,0,0,0,0|3,0,0]=3 143 B6R1.2 NC1=NCCS1 MCULE-3397143190 [0,0,0,0,0,0|3,0,0]=3 144 B6R1.2 NC1=NCCS1 MCULE-9466856269 [0,0,0,0,0,0|3,0,0]=3 145 B6R1.2 NC1=NCCS1 MCULE-9984008966 [0,0,0,0,0,0|3,0,0]=3 146 B6R1.2 NC1=NNCC1 MCULE-4665265929 [0,0,0,0,0,0|3,0,0]=3 147 B6R1.2 NC1=NOCC1 MCULE-4971355735 [0,0,0,0,0,0|3,0,0]=3 148 B6R1.2 NC1C=CCC1 MCULE-2537724380 [0,0,0,0,0,0|1,0,3]=4 149 B6R1.2 NC1C=CCC1 MCULE-5017993489 [0,0,0,0,0,0|1,0,3]=4 150 B6R1.2 NC1CC=CC1 MCULE-3815719332 [0,0,0,0,0,0|1,0,3]=4 151 B6R1.2 NC1CC=CC1 MCULE-9984030144 [0,0,0,0,0,0|1,0,3]=4 152 B6R1.2 NC1CCCC1 MCULE-2292038009 [0,0,0,0,0,0|1,0,1]=2 153 B6R1.2 NC1CCNC1 MCULE-2237528072 [0,0,0,0,0,0|2,0,1]=3 154 B6R1.2 NC1CCNC1 MCULE-5167920547 [0,0,0,0,0,0|2,0,1]=3 155 B6R1.2 NC1CCNC1 MCULE-5837785719 [0,0,0,0,0,0|2,0,1]=3 156 B6R1.2 NC1CCOC1 MCULE-1276945018 [0,0,0,0,0,0|2,0,1]=3 157 B6R1.2 NC1CCOC1 MCULE-8146259495 [0,0,0,0,0,0|2,0,1]=3 158 B6R1.2 NC1CCSC1 MCULE-8972229387 [0,0,0,0,0,0|2,0,1]=3 159 B6R1.2 NC1CCSC1 MCULE-9186640582 [0,0,0,0,0,0|2,0,1]=3 160 B6R1.2 NC1CSSC1 MCULE-4887591316 [0,0,0,0,0,0|3,0,1]=4 161 B6R1.2 NC1CSSC1 MCULE-5524609325 [0,0,0,0,0,0|3,0,1]=4 162 B6R1.2 NC1CSSC1 MCULE-9014844047 [0,0,0,0,0,0|3,0,1]=4 163 B6R1.2 NN1CCCC1 MCULE-1562593919 [0,0,0,0,0,0|2,0,0]=2 164 B6R1.2 NN1CCCC1 MCULE-2311855036 [0,0,0,0,0,0|2,0,0]=2 165 B6R1.2 NN1CCCC1 MCULE-5484008222 [0,0,0,0,0,0|2,0,0]=2 166 B6R1.2 N[C@@H]1CCNC1 MCULE-6043697974 [0,0,0,0,0,0|2,0,1]=3 167 B6R1.2 N[C@@H]1CCNC1 MCULE-8912264932 [0,0,0,0,0,0|2,0,1]=3 168 B6R1.2 N[C@@H]1CCNC1 MCULE-9183647019 [0,0,0,0,0,0|2,0,1]=3 169 B6R1.2 N[C@@H]1CCNC1 MCULE-9608760183 [0,0,0,0,0,0|2,0,1]=3 170 B6R1.2 N[C@@H]1CCOC1 MCULE-1100136080 [0,0,0,0,0,0|2,0,1]=3 171 B6R1.2 N[C@@H]1CCOC1 MCULE-4493278911 [0,0,0,0,0,0|2,0,1]=3 172 B6R1.2 N[C@@H]1CCOC1 MCULE-5574536510 [0,0,0,0,0,0|2,0,1]=3 173 B6R1.2 N[C@@H]1CCOC1 MCULE-7204677203 [0,0,0,0,0,0|2,0,1]=3 174 B6R1.2 N[C@H]1CCNC1 MCULE-3573455998 [0,0,0,0,0,0|2,0,1]=3 175 B6R1.2 N[C@H]1CCNC1 MCULE-3988158945 [0,0,0,0,0,0|2,0,1]=3 176 B6R1.2 N[C@H]1CCNC1 MCULE-4526890579 [0,0,0,0,0,0|2,0,1]=3 177 B6R1.2 N[C@H]1CCNC1 MCULE-8548728927 [0,0,0,0,0,0|2,0,1]=3 178 B6R1.2 N[C@H]1CCOC1 MCULE-2273771439 [0,0,0,0,0,0|2,0,1]=3 179 B6R1.2 N[C@H]1CCOC1 MCULE-3567904137 [0,0,0,0,0,0|2,0,1]=3 180 B6R1.2 N[C@H]1CCOC1 MCULE-5268616156 [0,0,0,0,0,0|2,0,1]=3 181 B6R1.2 N[C@H]1CCOC1 MCULE-7351975857 [0,0,0,0,0,0|2,0,1]=3 182 B6R1.2 O=C1C=CCC1 MCULE-1844779047 [0,0,0,0,0,0|0,0,2]=2 183 B6R1.2 O=C1C=CCN1 MCULE-4338701003 [0,0,0,0,0,0|1,0,2]=3 184 B6R1.2 O=C1C=CCO1 MCULE-4296503663 [0,0,0,0,0,0|1,0,2]=3 185 B6R1.2 O=C1C=CCS1 MCULE-5623095583 [0,0,0,0,0,0|1,0,2]=3 186 B6R1.2 O=C1C=CNN1 MCULE-8045056316 [0,0,0,0,0,0|2,0,2]=4 187 B6R1.2 O=C1C=CSC1 MCULE-6580304664 [0,0,0,0,0,0|1,0,2]=3 188 B6R1.2 O=C1C=CSN1 MCULE-6820517860 [0,0,0,0,0,0|2,0,2]=4 189 B6R1.2 O=C1CC=CC1 MCULE-7606670114 [0,0,0,0,0,0|0,0,2]=2 190 B6R1.2 O=C1CC=NN1 MCULE-1672455504 [0,0,0,0,0,0|2,0,1]=3 191 B6R1.2 O=C1CCCC1 MCULE-9455227735 [0,0,0,0,0,0|0,0,0]=0 192 B6R1.2 O=C1CCCN1 MCULE-3061780794 [0,0,0,0,0,0|1,0,0]=1 193 B6R1.2 O=C1CCCO1 MCULE-6795890265 [0,0,0,0,0,0|1,0,0]=1 194 B6R1.2 O=C1CCCS1 MCULE-5361654550 [0,0,0,0,0,0|1,0,0]=1 195 B6R1.2 O=C1CCNC1 MCULE-2947789259 [0,0,0,0,0,0|1,0,0]=1 196 B6R1.2 O=C1CCNC1 MCULE-7192595052 [0,0,0,0,0,0|1,0,0]=1 197 B6R1.2 O=C1CCNN1 MCULE-7030953666 [0,0,0,0,0,0|2,0,0]=2 198 B6R1.2 O=C1CCOC1 MCULE-2031733910 [0,0,0,0,0,0|1,0,0]=1 199 B6R1.2 O=C1CCON1 MCULE-6799359324 [0,0,0,0,0,0|2,0,0]=2 200 B6R1.2 O=C1CCSC1 MCULE-2059655624 [0,0,0,0,0,0|1,0,0]=1 201 B6R1.2 O=C1CC[NH2+]N1 MCULE-5327505055 [0,0,0,0,0,0|2,0,0]=2 202 B6R1.2 O=C1CNCN1 MCULE-2645891847 [0,0,0,0,0,0|2,0,0]=2 203 B6R1.2 O=C1CNCN1 MCULE-9269137129 [0,0,0,0,0,0|2,0,0]=2 204 B6R1.2 O=C1CSCN1 MCULE-3946660854 [0,0,0,0,0,0|2,0,0]=2 205 B6R1.2 O=C1N=CN=N1 MCULE-3721166402 [0,0,0,0,0,0|3,0,1]=4 206 B6R1.2 O=C1NC=CN1 MCULE-6249170076 [0,0,0,0,0,0|2,0,2]=4 207 B6R1.2 O=C1NC=CO1 MCULE-4371023805 [0,0,0,0,0,0|2,0,2]=4 208 B6R1.2 O=C1NC=CS1 MCULE-2039347995 [0,0,0,0,0,0|2,0,2]=4 209 B6R1.2 O=C1NC=NN1 MCULE-8685001700 [0,0,0,0,0,0|3,0,1]=4 210 B6R1.2 O=C1NCCN1 MCULE-9806791551 [0,0,0,0,0,0|2,0,0]=2 211 B6R1.2 O=C1NCCO1 MCULE-3934923008 [0,0,0,0,0,0|2,0,0]=2 212 B6R1.2 O=C1NCCS1 MCULE-6732478086 [0,0,0,0,0,0|2,0,0]=2 213 B6R1.2 O=C1NN=NN1 MCULE-2843823671 [0,0,0,0,0,0|4,0,0]=4 214 B6R1.2 O=C1OC=CO1 MCULE-1924277704 [0,0,0,0,0,0|2,0,2]=4 215 B6R1.2 O=C1OCCO1 MCULE-9493253045 [0,0,0,0,0,0|2,0,0]=2 216 B6R1.2 O=S1CCCC1 MCULE-2442126780 [0,0,0,0,0,0|1,0,0]=1 217 B6R1.2 O=S1OCCO1 MCULE-5773173321 [0,0,0,0,0,0|3,0,0]=3 218 B6R1.2 OC1C=CCC1 MCULE-3857764876 [0,0,0,0,0,0|0,0,4]=4 219 B6R1.2 OC1CC=CC1 MCULE-6176562196 [0,0,0,0,0,0|0,0,4]=4 220 B6R1.2 OC1CCCC1 MCULE-1758440264 [0,0,0,0,0,0|0,0,2]=2 221 B6R1.2 OC1CCCN1 MCULE-4787168972 [0,0,0,0,0,0|1,0,2]=3 222 B6R1.2 OC1CCCO1 MCULE-9632627344 [0,0,0,0,0,0|1,0,2]=3 223 B6R1.2 OC1CCNC1 MCULE-4307402606 [0,0,0,0,0,0|1,0,2]=3 224 B6R1.2 OC1CCNC1 MCULE-6745480350 [0,0,0,0,0,0|1,0,2]=3 225 B6R1.2 OC1CCOC1 MCULE-4469581028 [0,0,0,0,0,0|1,0,2]=3 226 B6R1.2 OC1CCSC1 MCULE-9796808599 [0,0,0,0,0,0|1,0,2]=3 227 B6R1.2 OC1CNOC1 MCULE-3414700581 [0,0,0,0,0,0|2,0,2]=4 228 B6R1.2 OC1CNOC1 MCULE-8163403090 [0,0,0,0,0,0|2,0,2]=4 229 B6R1.2 OC1CNOC1 MCULE-8644852072 [0,0,0,0,0,0|2,0,2]=4 230 B6R1.2 OC1C[NH2+]OC1 MCULE-7865131527 [0,0,0,0,0,0|2,0,2]=4 231 B6R1.2 O[C@@H]1CCNC1 MCULE-8116497337 [0,0,0,0,0,0|1,0,2]=3 232 B6R1.2 O[C@@H]1CCNC1 MCULE-8578068948 [0,0,0,0,0,0|1,0,2]=3 233 B6R1.2 O[C@@H]1CCNC1 MCULE-9094582248 [0,0,0,0,0,0|1,0,2]=3 234 B6R1.2 O[C@@H]1CCNC1 MCULE-9933593352 [0,0,0,0,0,0|1,0,2]=3 235 B6R1.2 O[C@@H]1CCOC1 MCULE-7739141732 [0,0,0,0,0,0|1,0,2]=3 236 B6R1.2 O[C@@H]1CCOC1 MCULE-8344812226 [0,0,0,0,0,0|1,0,2]=3 237 B6R1.2 O[C@@H]1CCOC1 MCULE-9098074990 [0,0,0,0,0,0|1,0,2]=3 238 B6R1.2 O[C@@H]1CCSC1 MCULE-3532754705 [0,0,0,0,0,0|1,0,2]=3 239 B6R1.2 O[C@@H]1CCSC1 MCULE-5800407146 [0,0,0,0,0,0|1,0,2]=3 240 B6R1.2 O[C@@H]1CNOC1 MCULE-1481945185 [0,0,0,0,0,0|2,0,2]=4 241 B6R1.2 O[C@@H]1CNOC1 MCULE-4156521353 [0,0,0,0,0,0|2,0,2]=4 242 B6R1.2 O[C@@H]1CNOC1 MCULE-5692816168 [0,0,0,0,0,0|2,0,2]=4 243 B6R1.2 O[C@@H]1CNOC1 MCULE-6838604903 [0,0,0,0,0,0|2,0,2]=4 244 B6R1.2 O[C@H]1CCNC1 MCULE-1100098088 [0,0,0,0,0,0|1,0,2]=3 245 B6R1.2 O[C@H]1CCNC1 MCULE-3493644065 [0,0,0,0,0,0|1,0,2]=3 246 B6R1.2 O[C@H]1CCNC1 MCULE-3778918259 [0,0,0,0,0,0|1,0,2]=3 247 B6R1.2 O[C@H]1CCNC1 MCULE-4680162054 [0,0,0,0,0,0|1,0,2]=3 248 B6R1.2 O[C@H]1CCOC1 MCULE-8518846297 [0,0,0,0,0,0|1,0,2]=3 249 B6R1.2 O[C@H]1CCOC1 MCULE-9544747995 [0,0,0,0,0,0|1,0,2]=3 250 B6R1.2 O[C@H]1CNOC1 MCULE-1746817114 [0,0,0,0,0,0|2,0,2]=4 251 B6R1.2 O[C@H]1CNOC1 MCULE-4469396812 [0,0,0,0,0,0|2,0,2]=4 252 B6R1.2 O[C@H]1CNOC1 MCULE-7167785164 [0,0,0,0,0,0|2,0,2]=4 253 B6R1.2 O[C@H]1CNOC1 MCULE-8409877332 [0,0,0,0,0,0|2,0,2]=4 254 B6R1.2 P1(=O)OCCO1 MCULE-3753821837 [0,0,0,0,0,0|3,0,0]=3 255 B6R1.2 S=C1CCCN1 MCULE-1089290822 [0,0,0,0,0,0|1,1,0]=2 256 B6R1.2 S=C1NCCN1 MCULE-3300710815 [0,0,0,0,0,0|2,1,0]=3 257 B6R1.2 S=C1SCCS1 MCULE-3003900032 [0,0,0,0,0,0|2,1,0]=3 258 B6R1.2 SC1=NCCO1 MCULE-6684545723 [0,0,0,0,0,0|2,1,0]=3 259 B6R1.2 SC1=NCCS1 MCULE-6840772268 [0,0,0,0,0,0|2,1,0]=3 260 B6R1.2 SC1CCCC1 MCULE-5932400506 [0,0,0,0,0,0|0,1,1]=2 261 B6R1.2 SC1CCOC1 MCULE-9247906418 [0,0,0,0,0,0|1,1,1]=3 262 B6R1.2 SC1CCSC1 MCULE-5955380477 [0,0,0,0,0,0|1,1,1]=3 263 B6R1.2 [NH3+]C1CC[NH2+]C1 MCULE-3374468196 [0,0,0,0,0,0|2,0,1]=3 264 B6R1.2 [TlH2]C1=CC=CC1 MCULE-7402896981 [0,0,0,0,0,0|1,0,3]=4 265 B5R1.1 B1CCOO1 MCULE-4859234466 [1,0,0,0,0,0|3,0,0]=4 266 B5R1.1 C1=CCC=C1 MCULE-1776679581 [1,0,0,0,0,0|0,0,3]=4 267 B5R1.1 C1=CCCC1 MCULE-8785635218 [1,0,0,0,0,0|0,0,1]=2 268 B5R1.1 C1=CCNC1 MCULE-4645888757 [1,0,0,0,0,0|1,0,1]=3 269 B5R1.1 C1=CCNC1 MCULE-7386427096 [1,0,0,0,0,0|1,0,1]=3 270 B5R1.1 C1=CCOC1 MCULE-1252378718 [1,0,0,0,0,0|1,0,1]=3 271 B5R1.1 C1=CCSC1 MCULE-7848219599 [1,0,0,0,0,0|1,0,1]=3 272 B5R1.1 C1=COCC1 MCULE-7714726225 [1,0,0,0,0,0|1,0,1]=3 273 B5R1.1 C1=NCCN1 MCULE-6281004177 [1,0,0,0,0,0|2,0,0]=3 274 B5R1.1 C1=NNCC1 MCULE-2270087414 [1,0,0,0,0,0|2,0,0]=3 275 B5R1.1 C1CCNC1 MCULE-2816679267 [1,0,0,0,0,0|1,0,0]=2 276 B5R1.1 C1CCNC1 MCULE-8439725600 [1,0,0,0,0,0|1,0,0]=2 277 B5R1.1 C1CCNC1 MCULE-8653165010 [1,0,0,0,0,0|1,0,0]=2 278 B5R1.1 C1CCNC1 MCULE-9053007443 [1,0,0,0,0,0|1,0,0]=2 279 B5R1.1 C1CCOC1 MCULE-3873245085 [1,0,0,0,0,0|1,0,0]=2 280 B5R1.1 C1CCSC1 MCULE-4519380555 [1,0,0,0,0,0|1,0,0]=2 281 B5R1.1 C1CNCN1 MCULE-6666768806 [1,0,0,0,0,0|2,0,0]=3 282 B5R1.1 C1CNNC1 MCULE-9192384720 [1,0,0,0,0,0|2,0,0]=3 283 B5R1.1 C1CNNC1 MCULE-9418244562 [1,0,0,0,0,0|2,0,0]=3 284 B5R1.1 C1CNOC1 MCULE-3922840312 [1,0,0,0,0,0|2,0,0]=3 285 B5R1.1 C1CNOC1 MCULE-6084499894 [1,0,0,0,0,0|2,0,0]=3 286 B5R1.1 C1COCN1 MCULE-4693733872 [1,0,0,0,0,0|2,0,0]=3 287 B5R1.1 C1COCO1 MCULE-3967810235 [1,0,0,0,0,0|2,0,0]=3 288 B5R1.1 C1CSCN1 MCULE-1445529876 [1,0,0,0,0,0|2,0,0]=3 289 B5R1.1 C1CSCN1 MCULE-8646299838 [1,0,0,0,0,0|2,0,0]=3 290 B5R1.1 C1CSCS1 MCULE-2954642463 [1,0,0,0,0,0|2,0,0]=3 291 B7R1.1 BrCC1=CCCC1 MCULE-9208619526 [0,1,0,0,0,0|1,0,1]=3 292 B7R1.1 BrCC1CCCC1 MCULE-2472505847 [0,1,0,0,0,0|1,0,1]=3 293 B7R1.1 BrCC1CCCN1 MCULE-2152950124 [0,1,0,0,0,0|2,0,1]=4 294 B7R1.1 BrCC1CCCN1 MCULE-6083580584 [0,1,0,0,0,0|2,0,1]=4 295 B7R1.1 BrCC1CCCN1 MCULE-8116807965 [0,1,0,0,0,0|2,0,1]=4 296 B7R1.1 BrCC1CCCO1 MCULE-6801721633 [0,1,0,0,0,0|2,0,1]=4 297 B7R1.1 BrCC1CCNC1 MCULE-3841325509 [0,1,0,0,0,0|2,0,1]=4 298 B7R1.1 BrCC1CCNC1 MCULE-4302321173 [0,1,0,0,0,0|2,0,1]=4 299 B7R1.1 BrCC1CCNC1 MCULE-7802125485 [0,1,0,0,0,0|2,0,1]=4 300 B7R1.1 BrCC1CCOC1 MCULE-5109533414 [0,1,0,0,0,0|2,0,1]=4 301 B7R1.1 BrC[C@@H]1CCCN1 MCULE-2609238545 [0,1,0,0,0,0|2,0,1]=4 302 B7R1.1 BrC[C@@H]1CCCN1 MCULE-4300877722 [0,1,0,0,0,0|2,0,1]=4 303 B7R1.1 BrC[C@@H]1CCCN1 MCULE-7501559292 [0,1,0,0,0,0|2,0,1]=4 304 B7R1.1 BrC[C@@H]1CCCN1 MCULE-9528927495 [0,1,0,0,0,0|2,0,1]=4 305 B7R1.1 BrC[C@H]1CCCO1 MCULE-3468061610 [0,1,0,0,0,0|2,0,1]=4 306 B7R1.1 BrC[C@H]1CCCO1 MCULE-9305844681 [0,1,0,0,0,0|2,0,1]=4 307 B7R1.1 BrC[C@H]1CCOC1 MCULE-3326059942 [0,1,0,0,0,0|2,0,1]=4 308 B7R1.1 C#CC1CCCC1 MCULE-2058689962 [0,1,0,0,0,0|1,0,1]=3 309 B7R1.1 C#CC1CCCN1 MCULE-2312235714 [0,1,0,0,0,0|2,0,1]=4 310 B7R1.1 C#CC1CCCN1 MCULE-2368649911 [0,1,0,0,0,0|2,0,1]=4 311 B7R1.1 C#CC1CCCO1 MCULE-5501627253 [0,1,0,0,0,0|2,0,1]=4 312 B7R1.1 C#CC1CCNC1 MCULE-5702093443 [0,1,0,0,0,0|2,0,1]=4 313 B7R1.1 C#CC1CCNC1 MCULE-8837025112 [0,1,0,0,0,0|2,0,1]=4 314 B7R1.1 C#CC1CCOC1 MCULE-6007232344 [0,1,0,0,0,0|2,0,1]=4 315 B7R1.1 C#C[C@@H]1CCCN1 MCULE-1635908608 [0,1,0,0,0,0|2,0,1]=4 316 B7R1.1 C#C[C@@H]1CCCN1 MCULE-4766446168 [0,1,0,0,0,0|2,0,1]=4 317 B7R1.1 C#C[C@@H]1CCCN1 MCULE-7265052825 [0,1,0,0,0,0|2,0,1]=4 318 B7R1.1 C#C[C@@H]1CCCN1 MCULE-8496158135 [0,1,0,0,0,0|2,0,1]=4 319 B7R1.1 C#C[C@H]1CCCN1 MCULE-1874586489 [0,1,0,0,0,0|2,0,1]=4 320 B7R1.1 C#C[C@H]1CCCN1 MCULE-8338634355 [0,1,0,0,0,0|2,0,1]=4 321 B7R1.1 C1(CCCN1)CF MCULE-2705678622 [0,1,0,0,0,0|2,0,1]=4 322 B7R1.1 C1(CCCN1)CF MCULE-3175080744 [0,1,0,0,0,0|2,0,1]=4 323 B7R1.1 C1(CCCN1)CN MCULE-3568349121 [0,1,0,0,0,0|2,0,1]=4 324 B7R1.1 C1(CCCN1)CN MCULE-9944820727 [0,1,0,0,0,0|2,0,1]=4 325 B7R1.1 C1(CCCN1)CO MCULE-7277085817 [0,1,0,0,0,0|1,0,2]=4 326 B7R1.1 C1(CCNC1)CC MCULE-1733412139 [0,1,0,0,0,0|2,0,1]=4 327 B7R1.1 C1(CCNC1)CC MCULE-9295480110 [0,1,0,0,0,0|2,0,1]=4 328 B7R1.1 C1(CCNC1)CO MCULE-7897000858 [0,1,0,0,0,0|1,0,2]=4 329 B7R1.1 C1(CCNC1)CO MCULE-9939548436 [0,1,0,0,0,0|1,0,2]=4 330 B7R1.1 C1(CCNC1)OC MCULE-4107032989 [0,1,0,0,0,0|1,0,2]=4 331 B7R1.1 C1(CCNC1)OC MCULE-7879953493 [0,1,0,0,0,0|1,0,2]=4 332 B7R1.1 C1(CCOC1)CN MCULE-1674920995 [0,1,0,0,0,0|2,0,1]=4 333 B7R1.1 C1(CCOC1)CN MCULE-9715233219 [0,1,0,0,0,0|2,0,1]=4 334 B7R1.1 C1(CCOC1)CO MCULE-2350780678 [0,1,0,0,0,0|1,0,2]=4 335 B7R1.1 C1(CCOC1)NC MCULE-8636753374 [0,1,0,0,0,0|2,0,1]=4 336 B7R1.1 C=CC1CCCC1 MCULE-6144532155 [0,1,0,0,0,0|1,0,1]=3 337 B7R1.1 C=CC1CCCN1 MCULE-5736974496 [0,1,0,0,0,0|2,0,1]=4 338 B7R1.1 C=CC1CCCN1 MCULE-7626074228 [0,1,0,0,0,0|2,0,1]=4 339 B7R1.1 C=CC1CCNC1 MCULE-7703785367 [0,1,0,0,0,0|2,0,1]=4 340 B7R1.1 CC=C1CCCC1 MCULE-9763131004 [0,1,0,0,0,0|1,0,0]=2 341 B7R1.1 CC=C1CCNC1 MCULE-9077980338 [0,1,0,0,0,0|2,0,0]=3 342 B7R1.1 CC=C1CCNC1 MCULE-9519724391 [0,1,0,0,0,0|2,0,0]=3 343 B7R1.1 CCC1=CCCC1 MCULE-5154730597 [0,1,0,0,0,0|1,0,1]=3 344 B7R1.1 CCC1=NCCN1 MCULE-4105881010 [0,1,0,0,0,0|3,0,0]=4 345 B7R1.1 CCC1=NCCO1 MCULE-3838550511 [0,1,0,0,0,0|3,0,0]=4 346 B7R1.1 CCC1CCCC1 MCULE-1974854934 [0,1,0,0,0,0|1,0,1]=3 347 B7R1.1 CCC1CCCN1 MCULE-1775351089 [0,1,0,0,0,0|2,0,1]=4 348 B7R1.1 CCC1CCCN1 MCULE-2065682250 [0,1,0,0,0,0|2,0,1]=4 349 B7R1.1 CCC1CCCN1 MCULE-8326168982 [0,1,0,0,0,0|2,0,1]=4 350 B7R1.1 CCC1CCCN1 MCULE-9831560442 [0,1,0,0,0,0|2,0,1]=4 351 B7R1.1 CCC1CCNC1 MCULE-1558031098 [0,1,0,0,0,0|2,0,1]=4 352 B7R1.1 CCC1CCNC1 MCULE-1877930466 [0,1,0,0,0,0|2,0,1]=4 353 B7R1.1 CCN1CCCC1 MCULE-3590039255 [0,1,0,0,0,0|2,0,0]=3 354 B7R1.1 CC[C@@H]1CCCN1 MCULE-1829706908 [0,1,0,0,0,0|2,0,1]=4 355 B7R1.1 CC[C@@H]1CCCN1 MCULE-6310895621 [0,1,0,0,0,0|2,0,1]=4 356 B7R1.1 CC[C@@H]1CCCN1 MCULE-6770634475 [0,1,0,0,0,0|2,0,1]=4 357 B7R1.1 CC[C@@H]1CCCN1 MCULE-9259891597 [0,1,0,0,0,0|2,0,1]=4 358 B7R1.1 CC[C@@H]1CCNC1 MCULE-1468303255 [0,1,0,0,0,0|2,0,1]=4 359 B7R1.1 CC[C@@H]1CCNC1 MCULE-2434021547 [0,1,0,0,0,0|2,0,1]=4 360 B7R1.1 CC[C@@H]1CCNC1 MCULE-4288710106 [0,1,0,0,0,0|2,0,1]=4 361 B7R1.1 CC[C@@H]1CCNC1 MCULE-5295271815 [0,1,0,0,0,0|2,0,1]=4 362 B7R1.1 CC[C@H]1CCCN1 MCULE-2347458277 [0,1,0,0,0,0|2,0,1]=4 363 B7R1.1 CC[C@H]1CCCN1 MCULE-3796565634 [0,1,0,0,0,0|2,0,1]=4 364 B7R1.1 CC[C@H]1CCCN1 MCULE-6193768639 [0,1,0,0,0,0|2,0,1]=4 365 B7R1.1 CC[C@H]1CCCN1 MCULE-9679619003 [0,1,0,0,0,0|2,0,1]=4 366 B7R1.1 CC[C@H]1CCNC1 MCULE-5122116015 [0,1,0,0,0,0|2,0,1]=4 367 B7R1.1 CC[C@H]1CCNC1 MCULE-5302237772 [0,1,0,0,0,0|2,0,1]=4 368 B7R1.1 CC[C@H]1CCNC1 MCULE-9447387540 [0,1,0,0,0,0|2,0,1]=4 369 B7R1.1 CC[C@H]1CCNC1 MCULE-9743799071 [0,1,0,0,0,0|2,0,1]=4 370 B7R1.1 CNC1=NCCN1 MCULE-8411755728 [0,1,0,0,0,0|3,0,0]=4 371 B7R1.1 CNC1=NCCN1 MCULE-9337116685 [0,1,0,0,0,0|3,0,0]=4 372 B7R1.1 CNC1CCCC1 MCULE-1391832163 [0,1,0,0,0,0|1,0,1]=3 373 B7R1.1 CNC1CCCC1 MCULE-8242451793 [0,1,0,0,0,0|1,0,1]=3 374 B7R1.1 CNC1CCNC1 MCULE-5544853841 [0,1,0,0,0,0|2,0,1]=4 375 B7R1.1 CNC1CCNC1 MCULE-9402107922 [0,1,0,0,0,0|2,0,1]=4 376 B7R1.1 CNC1CCOC1 MCULE-5628928593 [0,1,0,0,0,0|2,0,1]=4 377 B7R1.1 CNC1CCOC1 MCULE-7465078745 [0,1,0,0,0,0|2,0,1]=4 378 B7R1.1 CNC1CCOC1 MCULE-8928979869 [0,1,0,0,0,0|2,0,1]=4 379 B7R1.1 CNC1CCSC1 MCULE-1603222229 [0,1,0,0,0,0|2,0,1]=4 380 B7R1.1 CNC1CCSC1 MCULE-5376977039 [0,1,0,0,0,0|2,0,1]=4 381 B7R1.1 CNC1CCSC1 MCULE-9789640029 [0,1,0,0,0,0|2,0,1]=4 382 B7R1.1 CN[C@@H]1CCNC1 MCULE-1090651309 [0,1,0,0,0,0|2,0,1]=4 383 B7R1.1 CN[C@@H]1CCNC1 MCULE-6088625234 [0,1,0,0,0,0|2,0,1]=4 384 B7R1.1 CN[C@@H]1CCNC1 MCULE-8530771803 [0,1,0,0,0,0|2,0,1]=4 385 B7R1.1 CN[C@@H]1CCNC1 MCULE-9769572717 [0,1,0,0,0,0|2,0,1]=4 386 B7R1.1 CN[C@@H]1CCOC1 MCULE-2275496757 [0,1,0,0,0,0|2,0,1]=4 387 B7R1.1 CN[C@@H]1CCOC1 MCULE-4479731635 [0,1,0,0,0,0|2,0,1]=4 388 B7R1.1 CN[C@@H]1CCOC1 MCULE-4936509842 [0,1,0,0,0,0|2,0,1]=4 389 B7R1.1 CN[C@@H]1CCOC1 MCULE-7543653230 [0,1,0,0,0,0|2,0,1]=4 390 B7R1.1 CN[C@H]1CCNC1 MCULE-3142856248 [0,1,0,0,0,0|2,0,1]=4 391 B7R1.1 CN[C@H]1CCNC1 MCULE-7615640017 [0,1,0,0,0,0|2,0,1]=4 392 B7R1.1 CN[C@H]1CCNC1 MCULE-9192229718 [0,1,0,0,0,0|2,0,1]=4 393 B7R1.1 CN[C@H]1CCOC1 MCULE-3884907072 [0,1,0,0,0,0|2,0,1]=4 394 B7R1.1 CN[C@H]1CCOC1 MCULE-5671082057 [0,1,0,0,0,0|2,0,1]=4 395 B7R1.1 CN[C@H]1CCOC1 MCULE-7223789451 [0,1,0,0,0,0|2,0,1]=4 396 B7R1.1 CN[C@H]1CCOC1 MCULE-7903690510 [0,1,0,0,0,0|2,0,1]=4 397 B7R1.1 COC1=CCCC1 MCULE-6260649761 [0,1,0,0,0,0|0,0,2]=3 398 B7R1.1 COC1=CCCN1 MCULE-6283476666 [0,1,0,0,0,0|1,0,2]=4 399 B7R1.1 COC1=NCCC1 MCULE-2625712954 [0,1,0,0,0,0|1,0,1]=3 400 B7R1.1 COC1=NCCN1 MCULE-4640802770 [0,1,0,0,0,0|2,0,1]=4 401 B7R1.1 COC1CCCC1 MCULE-7539347010 [0,1,0,0,0,0|0,0,2]=3 402 B7R1.1 COC1CCCO1 MCULE-8363423240 [0,1,0,0,0,0|1,0,2]=4 403 B7R1.1 COC1CCNC1 MCULE-1194889067 [0,1,0,0,0,0|1,0,2]=4 404 B7R1.1 COC1CCNC1 MCULE-2551543855 [0,1,0,0,0,0|1,0,2]=4 405 B7R1.1 CO[C@@H]1CCNC1 MCULE-1457133388 [0,1,0,0,0,0|1,0,2]=4 406 B7R1.1 CO[C@@H]1CCNC1 MCULE-5592053485 [0,1,0,0,0,0|1,0,2]=4 407 B7R1.1 CO[C@@H]1CCNC1 MCULE-9586958523 [0,1,0,0,0,0|1,0,2]=4 408 B7R1.1 CO[C@@H]1CCNC1 MCULE-9627985971 [0,1,0,0,0,0|1,0,2]=4 409 B7R1.1 CO[C@H]1CCNC1 MCULE-4011037765 [0,1,0,0,0,0|1,0,2]=4 410 B7R1.1 CO[C@H]1CCNC1 MCULE-6371005292 [0,1,0,0,0,0|1,0,2]=4 411 B7R1.1 CO[C@H]1CCNC1 MCULE-6820243921 [0,1,0,0,0,0|1,0,2]=4 412 B7R1.1 CO[C@H]1CCNC1 MCULE-9345557765 [0,1,0,0,0,0|1,0,2]=4 413 B7R1.1 CSC1=NCCN1 MCULE-2508776031 [0,1,0,0,0,0|2,1,0]=4 414 B7R1.1 CSC1=NCCN1 MCULE-3552473411 [0,1,0,0,0,0|2,1,0]=4 415 B7R1.1 CSC1=NCCN1 MCULE-6313819915 [0,1,0,0,0,0|2,1,0]=4 416 B7R1.1 CSC1=NCCS1 MCULE-1809491558 [0,1,0,0,0,0|2,1,0]=4 417 B7R1.1 CSC1=NCCS1 MCULE-6651129000 [0,1,0,0,0,0|2,1,0]=4 418 B7R1.1 CSC1CCNC1 MCULE-8160363271 [0,1,0,0,0,0|1,1,1]=4 419 B7R1.1 CSC1CCNC1 MCULE-8993526132 [0,1,0,0,0,0|1,1,1]=4 420 B7R1.1 CS[C@@H]1CCNC1 MCULE-5068595479 [0,1,0,0,0,0|1,1,1]=4 421 B7R1.1 CS[C@@H]1CCNC1 MCULE-7615711516 [0,1,0,0,0,0|1,1,1]=4 422 B7R1.1 CS[C@@H]1CCNC1 MCULE-8265640185 [0,1,0,0,0,0|1,1,1]=4 423 B7R1.1 CS[C@@H]1CCNC1 MCULE-9548332479 [0,1,0,0,0,0|1,1,1]=4 424 B7R1.1 ClCC1=NCCN1 MCULE-1496461910 [0,1,0,0,0,0|3,0,0]=4 425 B7R1.1 ClCC1=NCCN1 MCULE-6501608310 [0,1,0,0,0,0|3,0,0]=4 426 B7R1.1 ClCC1=NCCO1 MCULE-8789331570 [0,1,0,0,0,0|3,0,0]=4 427 B7R1.1 ClCC1=NOCC1 MCULE-8714304275 [0,1,0,0,0,0|3,0,0]=4 428 B7R1.1 ClCC1CCCC1 MCULE-7652893931 [0,1,0,0,0,0|1,0,1]=3 429 B7R1.1 ClCC1CCCN1 MCULE-3656101962 [0,1,0,0,0,0|2,0,1]=4 430 B7R1.1 ClCC1CCCN1 MCULE-9792407426 [0,1,0,0,0,0|2,0,1]=4 431 B7R1.1 ClCC1CCCO1 MCULE-9816764842 [0,1,0,0,0,0|2,0,1]=4 432 B7R1.1 ClCC1CCNC1 MCULE-3647066500 [0,1,0,0,0,0|2,0,1]=4 433 B7R1.1 ClCC1CCNC1 MCULE-4046034551 [0,1,0,0,0,0|2,0,1]=4 434 B7R1.1 ClCC1CCOC1 MCULE-1203835826 [0,1,0,0,0,0|2,0,1]=4 435 B7R1.1 ClC[C@@H]1CCCN1 MCULE-1712418178 [0,1,0,0,0,0|2,0,1]=4 436 B7R1.1 ClC[C@@H]1CCCN1 MCULE-2092217865 [0,1,0,0,0,0|2,0,1]=4 437 B7R1.1 ClC[C@@H]1CCCN1 MCULE-4473753787 [0,1,0,0,0,0|2,0,1]=4 438 B7R1.1 ClC[C@@H]1CCCN1 MCULE-9545872560 [0,1,0,0,0,0|2,0,1]=4 439 B7R1.1 ClC[C@@H]1CCNC1 MCULE-3561633948 [0,1,0,0,0,0|2,0,1]=4 440 B7R1.1 ClC[C@@H]1CCNC1 MCULE-9146547190 [0,1,0,0,0,0|2,0,1]=4 441 B7R1.1 ClC[C@H]1CCCN1 MCULE-1186865731 [0,1,0,0,0,0|2,0,1]=4 442 B7R1.1 ClC[C@H]1CCCN1 MCULE-3107383611 [0,1,0,0,0,0|2,0,1]=4 443 B7R1.1 ClC[C@H]1CCNC1 MCULE-1113644310 [0,1,0,0,0,0|2,0,1]=4 444 B7R1.1 ClC[C@H]1CCNC1 MCULE-4950070763 [0,1,0,0,0,0|2,0,1]=4 445 B7R1.1 FCC1CCCN1 MCULE-3216030316 [0,1,0,0,0,0|2,0,1]=4 446 B7R1.1 FCC1CCCN1 MCULE-4540803550 [0,1,0,0,0,0|2,0,1]=4 447 B7R1.1 FCC1CCNC1 MCULE-1978414491 [0,1,0,0,0,0|2,0,1]=4 448 B7R1.1 FCC1CCNC1 MCULE-5950087621 [0,1,0,0,0,0|2,0,1]=4 449 B7R1.1 FCC1CCNC1 MCULE-7750703127 [0,1,0,0,0,0|2,0,1]=4 450 B7R1.1 FCC1CCNC1 MCULE-8603606998 [0,1,0,0,0,0|2,0,1]=4 451 B7R1.1 FC[C@@H]1CCCN1 MCULE-2463314208 [0,1,0,0,0,0|2,0,1]=4 452 B7R1.1 FC[C@@H]1CCCN1 MCULE-3740139569 [0,1,0,0,0,0|2,0,1]=4 453 B7R1.1 FC[C@@H]1CCCN1 MCULE-6899304468 [0,1,0,0,0,0|2,0,1]=4 454 B7R1.1 FC[C@@H]1CCCN1 MCULE-9916936373 [0,1,0,0,0,0|2,0,1]=4 455 B7R1.1 FC[C@@H]1CCNC1 MCULE-2159002313 [0,1,0,0,0,0|2,0,1]=4 456 B7R1.1 FC[C@@H]1CCNC1 MCULE-4712597711 [0,1,0,0,0,0|2,0,1]=4 457 B7R1.1 FC[C@@H]1CCNC1 MCULE-6166975534 [0,1,0,0,0,0|2,0,1]=4 458 B7R1.1 FC[C@@H]1CCNC1 MCULE-7608233986 [0,1,0,0,0,0|2,0,1]=4 459 B7R1.1 FC[C@H]1CCCN1 MCULE-1380365453 [0,1,0,0,0,0|2,0,1]=4 460 B7R1.1 FC[C@H]1CCCN1 MCULE-1512160666 [0,1,0,0,0,0|2,0,1]=4 461 B7R1.1 FC[C@H]1CCCN1 MCULE-2904385734 [0,1,0,0,0,0|2,0,1]=4 462 B7R1.1 FC[C@H]1CCCN1 MCULE-9837641384 [0,1,0,0,0,0|2,0,1]=4 463 B7R1.1 FC[C@H]1CCNC1 MCULE-2828011524 [0,1,0,0,0,0|2,0,1]=4 464 B7R1.1 FC[C@H]1CCNC1 MCULE-4192540640 [0,1,0,0,0,0|2,0,1]=4 465 B7R1.1 FC[C@H]1CCNC1 MCULE-5280605995 [0,1,0,0,0,0|2,0,1]=4 466 B7R1.1 FC[C@H]1CCNC1 MCULE-8886310417 [0,1,0,0,0,0|2,0,1]=4 467 B7R1.1 ICC1CCCC1 MCULE-5940886897 [0,1,0,0,0,0|1,0,1]=3 468 B7R1.1 ICC1CCCN1 MCULE-3467617934 [0,1,0,0,0,0|2,0,1]=4 469 B7R1.1 ICC1CCCN1 MCULE-7784862806 [0,1,0,0,0,0|2,0,1]=4 470 B7R1.1 ICC1CCCO1 MCULE-3981288245 [0,1,0,0,0,0|2,0,1]=4 471 B7R1.1 ICC1CCNC1 MCULE-4259439945 [0,1,0,0,0,0|2,0,1]=4 472 B7R1.1 ICC1CCNC1 MCULE-6061564929 [0,1,0,0,0,0|2,0,1]=4 473 B7R1.1 ICC1CCOC1 MCULE-2014671156 [0,1,0,0,0,0|2,0,1]=4 474 B7R1.1 IC[C@@H]1CCCN1 MCULE-4843756038 [0,1,0,0,0,0|2,0,1]=4 475 B7R1.1 IC[C@@H]1CCCN1 MCULE-8213667136 [0,1,0,0,0,0|2,0,1]=4 476 B7R1.1 IC[C@H]1CCOC1 MCULE-5163407500 [0,1,0,0,0,0|2,0,1]=4 477 B7R1.1 N#CC1=CCCC1 MCULE-5654080085 [0,1,0,0,0,0|1,0,1]=3 478 B7R1.1 N#CC1=NOCC1 MCULE-6070275701 [0,1,0,0,0,0|3,0,0]=4 479 B7R1.1 N#CC1CCCC1 MCULE-1484517612 [0,1,0,0,0,0|1,0,1]=3 480 B7R1.1 N#CC1CCCN1 MCULE-1423410021 [0,1,0,0,0,0|2,0,1]=4 481 B7R1.1 N#CC1CCCN1 MCULE-2656253866 [0,1,0,0,0,0|2,0,1]=4 482 B7R1.1 N#CC1CCCN1 MCULE-4406196575 [0,1,0,0,0,0|2,0,1]=4 483 B7R1.1 N#CC1CCCN1 MCULE-7456938108 [0,1,0,0,0,0|2,0,1]=4 484 B7R1.1 N#CC1CCCN1 MCULE-7786777677 [0,1,0,0,0,0|2,0,1]=4 485 B7R1.1 N#CC1CCCN1 MCULE-9566371551 [0,1,0,0,0,0|2,0,1]=4 486 B7R1.1 N#CC1CCCO1 MCULE-6657753631 [0,1,0,0,0,0|2,0,1]=4 487 B7R1.1 N#CC1CCCS1 MCULE-6372148360 [0,1,0,0,0,0|2,0,1]=4 488 B7R1.1 N#CC1CCNC1 MCULE-2090722666 [0,1,0,0,0,0|2,0,1]=4 489 B7R1.1 N#CC1CCNC1 MCULE-3197404572 [0,1,0,0,0,0|2,0,1]=4 490 B7R1.1 N#CC1CCNC1 MCULE-4677394011 [0,1,0,0,0,0|2,0,1]=4 491 B7R1.1 N#CC1CCNC1 MCULE-7538071104 [0,1,0,0,0,0|2,0,1]=4 492 B7R1.1 N#CC1CCOC1 MCULE-5555423051 [0,1,0,0,0,0|2,0,1]=4 493 B7R1.1 N#CC1CCSC1 MCULE-6188837269 [0,1,0,0,0,0|2,0,1]=4 494 B7R1.1 N#CN1CCCC1 MCULE-2010942719 [0,1,0,0,0,0|2,0,0]=3 495 B7R1.1 N#C[C@@H]1CCCN1 MCULE-4099952481 [0,1,0,0,0,0|2,0,1]=4 496 B7R1.1 N#C[C@@H]1CCCN1 MCULE-4644423856 [0,1,0,0,0,0|2,0,1]=4 497 B7R1.1 N#C[C@@H]1CCCN1 MCULE-5675394665 [0,1,0,0,0,0|2,0,1]=4 498 B7R1.1 N#C[C@@H]1CCCN1 MCULE-5881469353 [0,1,0,0,0,0|2,0,1]=4 499 B7R1.1 N#C[C@@H]1CCCN1 MCULE-8875516240 [0,1,0,0,0,0|2,0,1]=4 500 B7R1.1 N#C[C@@H]1CCCN1 MCULE-9993553976 [0,1,0,0,0,0|2,0,1]=4 501 B7R1.1 N#C[C@@H]1CCNC1 MCULE-3834395129 [0,1,0,0,0,0|2,0,1]=4 502 B7R1.1 N#C[C@@H]1CCNC1 MCULE-5148825522 [0,1,0,0,0,0|2,0,1]=4 503 B7R1.1 N#C[C@@H]1CCNC1 MCULE-6307308537 [0,1,0,0,0,0|2,0,1]=4 504 B7R1.1 N#C[C@@H]1CCNC1 MCULE-6821015295 [0,1,0,0,0,0|2,0,1]=4 505 B7R1.1 N#C[C@@H]1CCOC1 MCULE-4697885787 [0,1,0,0,0,0|2,0,1]=4 506 B7R1.1 N#C[C@@H]1CCOC1 MCULE-7073460204 [0,1,0,0,0,0|2,0,1]=4 507 B7R1.1 N#C[C@H]1CCCN1 MCULE-4472756314 [0,1,0,0,0,0|2,0,1]=4 508 B7R1.1 N#C[C@H]1CCCN1 MCULE-6157392186 [0,1,0,0,0,0|2,0,1]=4 509 B7R1.1 N#C[C@H]1CCCN1 MCULE-6672062231 [0,1,0,0,0,0|2,0,1]=4 510 B7R1.1 N#C[C@H]1CCCN1 MCULE-7774660242 [0,1,0,0,0,0|2,0,1]=4 511 B7R1.1 N#C[C@H]1CCCN1 MCULE-7910694136 [0,1,0,0,0,0|2,0,1]=4 512 B7R1.1 N#C[C@H]1CCCN1 MCULE-8564583246 [0,1,0,0,0,0|2,0,1]=4 513 B7R1.1 N#C[C@H]1CCNC1 MCULE-2994856177 [0,1,0,0,0,0|2,0,1]=4 514 B7R1.1 N#C[C@H]1CCNC1 MCULE-4920099746 [0,1,0,0,0,0|2,0,1]=4 515 B7R1.1 N#C[C@H]1CCNC1 MCULE-6338524969 [0,1,0,0,0,0|2,0,1]=4 516 B7R1.1 N#C[C@H]1CCNC1 MCULE-8239077200 [0,1,0,0,0,0|2,0,1]=4 517 B7R1.1 N#C[C@H]1CCOC1 MCULE-6745266026 [0,1,0,0,0,0|2,0,1]=4 518 B7R1.1 N#C[C@H]1CCOC1 MCULE-6946151061 [0,1,0,0,0,0|2,0,1]=4 519 B7R1.1 NCC1CCCC1 MCULE-3629796849 [0,1,0,0,0,0|1,0,1]=3 520 B7R1.1 NCC1CCCC1 MCULE-8453900433 [0,1,0,0,0,0|1,0,1]=3 521 B7R1.1 NCC1CCCN1 MCULE-4764684364 [0,1,0,0,0,0|2,0,1]=4 522 B7R1.1 NCC1CCCN1 MCULE-8971980286 [0,1,0,0,0,0|2,0,1]=4 523 B7R1.1 NCC1CCCO1 MCULE-2797516262 [0,1,0,0,0,0|2,0,1]=4 524 B7R1.1 NCC1CCCO1 MCULE-5970677903 [0,1,0,0,0,0|2,0,1]=4 525 B7R1.1 NCC1CCCO1 MCULE-6166235034 [0,1,0,0,0,0|2,0,1]=4 526 B7R1.1 NCC1CCCS1 MCULE-5278325816 [0,1,0,0,0,0|2,0,1]=4 527 B7R1.1 NCC1CCNC1 MCULE-1458513231 [0,1,0,0,0,0|2,0,1]=4 528 B7R1.1 NCC1CCNC1 MCULE-3817893631 [0,1,0,0,0,0|2,0,1]=4 529 B7R1.1 NCC1CCOC1 MCULE-4208746127 [0,1,0,0,0,0|2,0,1]=4 530 B7R1.1 NCC1CCOC1 MCULE-6540410947 [0,1,0,0,0,0|2,0,1]=4 531 B7R1.1 NCC1CCSC1 MCULE-6868901477 [0,1,0,0,0,0|2,0,1]=4 532 B7R1.1 NC[C@@H]1CCCN1 MCULE-4726727563 [0,1,0,0,0,0|2,0,1]=4 533 B7R1.1 NC[C@@H]1CCCN1 MCULE-7513400460 [0,1,0,0,0,0|2,0,1]=4 534 B7R1.1 NC[C@@H]1CCCN1 MCULE-7622329174 [0,1,0,0,0,0|2,0,1]=4 535 B7R1.1 NC[C@@H]1CCCN1 MCULE-8573395464 [0,1,0,0,0,0|2,0,1]=4 536 B7R1.1 NC[C@@H]1CCCO1 MCULE-1103643839 [0,1,0,0,0,0|2,0,1]=4 537 B7R1.1 NC[C@@H]1CCCO1 MCULE-1402571993 [0,1,0,0,0,0|2,0,1]=4 538 B7R1.1 NC[C@@H]1CCCO1 MCULE-1448381041 [0,1,0,0,0,0|2,0,1]=4 539 B7R1.1 NC[C@@H]1CCCO1 MCULE-6664501749 [0,1,0,0,0,0|2,0,1]=4 540 B7R1.1 NC[C@@H]1CCOC1 MCULE-2941934022 [0,1,0,0,0,0|2,0,1]=4 541 B7R1.1 NC[C@@H]1CCOC1 MCULE-2981279377 [0,1,0,0,0,0|2,0,1]=4 542 B7R1.1 NC[C@@H]1CCOC1 MCULE-6671508282 [0,1,0,0,0,0|2,0,1]=4 543 B7R1.1 NC[C@@H]1CCOC1 MCULE-7170580817 [0,1,0,0,0,0|2,0,1]=4 544 B7R1.1 NC[C@H]1CCCN1 MCULE-2813912286 [0,1,0,0,0,0|2,0,1]=4 545 B7R1.1 NC[C@H]1CCCN1 MCULE-5505144820 [0,1,0,0,0,0|2,0,1]=4 546 B7R1.1 NC[C@H]1CCCN1 MCULE-7325312327 [0,1,0,0,0,0|2,0,1]=4 547 B7R1.1 NC[C@H]1CCCN1 MCULE-7708925831 [0,1,0,0,0,0|2,0,1]=4 548 B7R1.1 NC[C@H]1CCCO1 MCULE-1196018690 [0,1,0,0,0,0|2,0,1]=4 549 B7R1.1 NC[C@H]1CCCO1 MCULE-2037746017 [0,1,0,0,0,0|2,0,1]=4 550 B7R1.1 NC[C@H]1CCCO1 MCULE-3470426685 [0,1,0,0,0,0|2,0,1]=4 551 B7R1.1 NC[C@H]1CCCO1 MCULE-9918683284 [0,1,0,0,0,0|2,0,1]=4 552 B7R1.1 NC[C@H]1CCOC1 MCULE-1537228220 [0,1,0,0,0,0|2,0,1]=4 553 B7R1.1 NC[C@H]1CCOC1 MCULE-2673094483 [0,1,0,0,0,0|2,0,1]=4 554 B7R1.1 NC[C@H]1CCOC1 MCULE-4873739830 [0,1,0,0,0,0|2,0,1]=4 555 B7R1.1 NC[C@H]1CCOC1 MCULE-6059527282 [0,1,0,0,0,0|2,0,1]=4 556 B7R1.1 NNC1=NCCN1 MCULE-2311438625 [0,1,0,0,0,0|3,0,0]=4 557 B7R1.1 NNC1=NCCN1 MCULE-7559191980 [0,1,0,0,0,0|3,0,0]=4 558 B7R1.1 NNC1=NCCN1 MCULE-9981367264 [0,1,0,0,0,0|3,0,0]=4 559 B7R1.1 NNC1=NCCS1 MCULE-1838294249 [0,1,0,0,0,0|3,0,0]=4 560 B7R1.1 NNC1=NCCS1 MCULE-6956519805 [0,1,0,0,0,0|3,0,0]=4 561 B7R1.1 NNC1=NCCS1 MCULE-9752634474 [0,1,0,0,0,0|3,0,0]=4 562 B7R1.1 NNC1CCCC1 MCULE-1363058529 [0,1,0,0,0,0|1,0,1]=3 563 B7R1.1 NNC1CCCC1 MCULE-2803402819 [0,1,0,0,0,0|1,0,1]=3 564 B7R1.1 NNC1CCCC1 MCULE-5556380186 [0,1,0,0,0,0|1,0,1]=3 565 B7R1.1 NNC1CCNC1 MCULE-2142578337 [0,1,0,0,0,0|2,0,1]=4 566 B7R1.1 NNC1CCNC1 MCULE-9229134321 [0,1,0,0,0,0|2,0,1]=4 567 B7R1.1 NNC1CCOC1 MCULE-5497635104 [0,1,0,0,0,0|2,0,1]=4 568 B7R1.1 NNC1CCOC1 MCULE-9086625827 [0,1,0,0,0,0|2,0,1]=4 569 B7R1.1 NNC1CCOC1 MCULE-9696991785 [0,1,0,0,0,0|2,0,1]=4 570 B7R1.1 NNC1CCSC1 MCULE-2826177760 [0,1,0,0,0,0|2,0,1]=4 571 B7R1.1 NNC1CCSC1 MCULE-3433599716 [0,1,0,0,0,0|2,0,1]=4 572 B7R1.1 NN[C@@H]1CCOC1 MCULE-5277138269 [0,1,0,0,0,0|2,0,1]=4 573 B7R1.1 NN[C@@H]1CCOC1 MCULE-5921785384 [0,1,0,0,0,0|2,0,1]=4 574 B7R1.1 NN[C@@H]1CCOC1 MCULE-7398479477 [0,1,0,0,0,0|2,0,1]=4 575 B7R1.1 NN[C@@H]1CCOC1 MCULE-9971593238 [0,1,0,0,0,0|2,0,1]=4 576 B7R1.1 NN[C@H]1CCOC1 MCULE-2032105408 [0,1,0,0,0,0|2,0,1]=4 577 B7R1.1 NN[C@H]1CCOC1 MCULE-4857620237 [0,1,0,0,0,0|2,0,1]=4 578 B7R1.1 NN[C@H]1CCOC1 MCULE-5796183363 [0,1,0,0,0,0|2,0,1]=4 579 B7R1.1 NN[C@H]1CCOC1 MCULE-8921088992 [0,1,0,0,0,0|2,0,1]=4 580 B7R1.1 NOC1CCCC1 MCULE-1504814106 [0,1,0,0,0,0|0,0,2]=3 581 B7R1.1 NOC1CCCC1 MCULE-1973418119 [0,1,0,0,0,0|0,0,2]=3 582 B7R1.1 NOC1CCOC1 MCULE-1016688849 [0,1,0,0,0,0|1,0,2]=4 583 B7R1.1 O/N=C/1\CCCN1 MCULE-9494233692 [0,1,0,0,0,0|1,0,1]=3 584 B7R1.1 O=CC1=CCCC1 MCULE-2270030217 [0,1,0,0,0,0|0,0,1]=2 585 B7R1.1 O=CC1=CCCO1 MCULE-3464963164 [0,1,0,0,0,0|1,0,1]=3 586 B7R1.1 O=CC1=CCSC1 MCULE-9591036145 [0,1,0,0,0,0|1,0,1]=3 587 B7R1.1 O=CC1CC=CC1 MCULE-1563456893 [0,1,0,0,0,0|0,0,3]=4 588 B7R1.1 O=CC1CCCC1 MCULE-4938681495 [0,1,0,0,0,0|0,0,1]=2 589 B7R1.1 O=CC1CCCO1 MCULE-4587605451 [0,1,0,0,0,0|1,0,1]=3 590 B7R1.1 O=CC1CCNC1 MCULE-5188223111 [0,1,0,0,0,0|1,0,1]=3 591 B7R1.1 O=CC1CCOC1 MCULE-9515567606 [0,1,0,0,0,0|1,0,1]=3 592 B7R1.1 O=CC1CCSC1 MCULE-1282848613 [0,1,0,0,0,0|1,0,1]=3 593 B7R1.1 O=CN1CCCC1 MCULE-1922854302 [0,1,0,0,0,0|1,0,0]=2 594 B7R1.1 O=C[C@@H]1CCOC1 MCULE-5181257964 [0,1,0,0,0,0|1,0,1]=3 595 B7R1.1 O=C[C@H]1CCOC1 MCULE-4532427366 [0,1,0,0,0,0|1,0,1]=3 596 B7R1.1 O=NN1CCCC1 MCULE-8449068120 [0,1,0,0,0,0|1,0,0]=2 597 B7R1.1 OCC1=CCCC1 MCULE-8850570361 [0,1,0,0,0,0|0,0,2]=3 598 B7R1.1 OCC1=NCCO1 MCULE-9432593363 [0,1,0,0,0,0|2,0,1]=4 599 B7R1.1 OCC1CCCC1 MCULE-2985338933 [0,1,0,0,0,0|0,0,2]=3 600 B7R1.1 OCC1CCCN1 MCULE-1016922679 [0,1,0,0,0,0|1,0,2]=4 601 B7R1.1 OCC1CCCN1 MCULE-8224535891 [0,1,0,0,0,0|1,0,2]=4 602 B7R1.1 OCC1CCCO1 MCULE-5877114547 [0,1,0,0,0,0|1,0,2]=4 603 B7R1.1 OCC1CCCO1 MCULE-5884880244 [0,1,0,0,0,0|1,0,2]=4 604 B7R1.1 OCC1CCCS1 MCULE-6106081414 [0,1,0,0,0,0|1,0,2]=4 605 B7R1.1 OCC1CCNC1 MCULE-7883947611 [0,1,0,0,0,0|1,0,2]=4 606 B7R1.1 OCC1CCNC1 MCULE-9689521155 [0,1,0,0,0,0|1,0,2]=4 607 B7R1.1 OCC1CCOC1 MCULE-8926405046 [0,1,0,0,0,0|1,0,2]=4 608 B7R1.1 OCC1CCSC1 MCULE-2226132734 [0,1,0,0,0,0|1,0,2]=4 609 B7R1.1 OC[C@@H]1CCCN1 MCULE-1791547752 [0,1,0,0,0,0|1,0,2]=4 610 B7R1.1 OC[C@@H]1CCCN1 MCULE-6448856585 [0,1,0,0,0,0|1,0,2]=4 611 B7R1.1 OC[C@@H]1CCCN1 MCULE-7214801659 [0,1,0,0,0,0|1,0,2]=4 612 B7R1.1 OC[C@@H]1CCCN1 MCULE-7248451975 [0,1,0,0,0,0|1,0,2]=4 613 B7R1.1 OC[C@@H]1CCCO1 MCULE-1788377708 [0,1,0,0,0,0|1,0,2]=4 614 B7R1.1 OC[C@@H]1CCCO1 MCULE-3533553137 [0,1,0,0,0,0|1,0,2]=4 615 B7R1.1 OC[C@@H]1CCNC1 MCULE-3126404140 [0,1,0,0,0,0|1,0,2]=4 616 B7R1.1 OC[C@@H]1CCNC1 MCULE-4876549629 [0,1,0,0,0,0|1,0,2]=4 617 B7R1.1 OC[C@@H]1CCNC1 MCULE-7050415145 [0,1,0,0,0,0|1,0,2]=4 618 B7R1.1 OC[C@@H]1CCNC1 MCULE-8785146407 [0,1,0,0,0,0|1,0,2]=4 619 B7R1.1 OC[C@@H]1CCOC1 MCULE-2004616524 [0,1,0,0,0,0|1,0,2]=4 620 B7R1.1 OC[C@@H]1CCOC1 MCULE-3801423698 [0,1,0,0,0,0|1,0,2]=4 621 B7R1.1 OC[C@H]1CCCN1 MCULE-1266532697 [0,1,0,0,0,0|1,0,2]=4 622 B7R1.1 OC[C@H]1CCCN1 MCULE-1724166794 [0,1,0,0,0,0|1,0,2]=4 623 B7R1.1 OC[C@H]1CCCN1 MCULE-7513431964 [0,1,0,0,0,0|1,0,2]=4 624 B7R1.1 OC[C@H]1CCCN1 MCULE-8398083695 [0,1,0,0,0,0|1,0,2]=4 625 B7R1.1 OC[C@H]1CCCO1 MCULE-3501680239 [0,1,0,0,0,0|1,0,2]=4 626 B7R1.1 OC[C@H]1CCCO1 MCULE-4925106568 [0,1,0,0,0,0|1,0,2]=4 627 B7R1.1 OC[C@H]1CCNC1 MCULE-3909770597 [0,1,0,0,0,0|1,0,2]=4 628 B7R1.1 OC[C@H]1CCNC1 MCULE-5006682123 [0,1,0,0,0,0|1,0,2]=4 629 B7R1.1 OC[C@H]1CCNC1 MCULE-8265382423 [0,1,0,0,0,0|1,0,2]=4 630 B7R1.1 OC[C@H]1CCNC1 MCULE-8371969680 [0,1,0,0,0,0|1,0,2]=4 631 B7R1.1 OC[C@H]1CCOC1 MCULE-4226412289 [0,1,0,0,0,0|1,0,2]=4 632 B7R1.1 OC[C@H]1CCOC1 MCULE-9076004118 [0,1,0,0,0,0|1,0,2]=4 633 B7R1.1 ON=C1CCCC1 MCULE-9338449832 [0,1,0,0,0,0|0,0,1]=2 634 B7R1.1 ONC1CCCC1 MCULE-1143510043 [0,1,0,0,0,0|0,0,2]=3 635 B7R1.1 ONC1CCCC1 MCULE-7548854169 [0,1,0,0,0,0|0,0,2]=3 636 B7R1.1 SCC1CCCC1 MCULE-7973872166 [0,1,0,0,0,0|0,1,1]=3 637 B7R1.1 SCC1CCCO1 MCULE-5962232488 [0,1,0,0,0,0|1,1,1]=4 638 B7R1.1 SCC1CCOC1 MCULE-4504314486 [0,1,0,0,0,0|1,1,1]=4 639 B7R1.2 C1(CCN(C1)C)N MCULE-3665102712 [0,1,0,0,0,0|2,0,0]=3 640 B7R1.2 C1(CCN(C1)C)O MCULE-5142099784 [0,1,0,0,0,0|2,0,0]=3 641 B7R1.2 C1(CNC(=O)C1)N MCULE-6663942203 [0,1,0,0,0,0|1,0,0]=2 642 B7R1.2 C1(CNC(=O)C1)N MCULE-7862049809 [0,1,0,0,0,0|1,0,0]=2 643 B7R1.2 C1(CNC(=O)C1)O MCULE-5557473335 [0,1,0,0,0,0|1,0,0]=2 644 B7R1.2 C1(COC(=O)N1)C MCULE-2821940224 [0,1,0,0,0,0|2,0,0]=3 645 B7R1.2 C=C1CCC(=O)O1 MCULE-2485348963 [0,1,0,0,0,0|1,0,1]=3 646 B7R1.2 CC1=CC(=O)CC1 MCULE-5496838191 [0,1,0,0,0,0|0,0,2]=3 647 B7R1.2 CC1=CC(=O)CO1 MCULE-6570401610 [0,1,0,0,0,0|1,0,2]=4 648 B7R1.2 CC1=CC(=O)OC1 MCULE-6549202383 [0,1,0,0,0,0|1,0,2]=4 649 B7R1.2 CC1=CCC(=O)O1 MCULE-5954539189 [0,1,0,0,0,0|1,0,2]=4 650 B7R1.2 CC1=CCC(=O)O1 MCULE-7236091694 [0,1,0,0,0,0|1,0,2]=4 651 B7R1.2 CC1=CCC(=O)S1 MCULE-5812502919 [0,1,0,0,0,0|1,0,2]=4 652 B7R1.2 CC1=NC(CC1)C MCULE-9630685459 [0,1,0,0,0,0|2,0,0]=3 653 B7R1.2 CC1=NC(CO1)C MCULE-2489340707 [0,1,0,0,0,0|3,0,0]=4 654 B7R1.2 CC1=NC(CS1)C MCULE-8843957654 [0,1,0,0,0,0|3,0,0]=4 655 B7R1.2 CC1=NNC(=O)C1 MCULE-2406140611 [0,1,0,0,0,0|2,0,1]=4 656 B7R1.2 CC1=NOC(=O)C1 MCULE-2665741338 [0,1,0,0,0,0|2,0,1]=4 657 B7R1.2 CC1=NOC(=O)C1 MCULE-3084424307 [0,1,0,0,0,0|2,0,1]=4 658 B7R1.2 CC1C=CC(=O)O1 MCULE-7172637771 [0,1,0,0,0,0|1,0,2]=4 659 B7R1.2 CC1CC(=NO1)N MCULE-8353889650 [0,1,0,0,0,0|3,0,0]=4 660 B7R1.2 CC1CC(=O)CO1 MCULE-7022597277 [0,1,0,0,0,0|1,0,0]=2 661 B7R1.2 CC1CC(=O)CS1 MCULE-7518365363 [0,1,0,0,0,0|1,0,0]=2 662 B7R1.2 CC1CC(=O)NN1 MCULE-2056748401 [0,1,0,0,0,0|2,0,0]=3 663 B7R1.2 CC1CC(=O)NN1 MCULE-8107476665 [0,1,0,0,0,0|2,0,0]=3 664 B7R1.2 CC1CC(CN1)F MCULE-5211772527 [0,1,0,0,0,0|2,0,1]=4 665 B7R1.2 CC1CC(CN1)F MCULE-6845898511 [0,1,0,0,0,0|2,0,1]=4 666 B7R1.2 CC1CC(CN1)O MCULE-5630063862 [0,1,0,0,0,0|1,0,2]=4 667 B7R1.2 CC1CC(CN1)O MCULE-7427731937 [0,1,0,0,0,0|1,0,2]=4 668 B7R1.2 CC1CC(CO1)N MCULE-5031195609 [0,1,0,0,0,0|2,0,1]=4 669 B7R1.2 CC1CC(CO1)N MCULE-6627149239 [0,1,0,0,0,0|2,0,1]=4 670 B7R1.2 CC1CC(CO1)O MCULE-1304022283 [0,1,0,0,0,0|1,0,2]=4 671 B7R1.2 CC1CC(CS1)N MCULE-2886562999 [0,1,0,0,0,0|2,0,1]=4 672 B7R1.2 CC1CCC(=N1)N MCULE-3470792627 [0,1,0,0,0,0|2,0,0]=3 673 B7R1.2 CC1CCC(=N1)N MCULE-7952001291 [0,1,0,0,0,0|2,0,0]=3 674 B7R1.2 CC1CCC(=O)C1 MCULE-6716533429 [0,1,0,0,0,0|0,0,0]=1 675 B7R1.2 CC1CCC(=O)N1 MCULE-8928464449 [0,1,0,0,0,0|1,0,0]=2 676 B7R1.2 CC1CCC(=O)N1 MCULE-9236321365 [0,1,0,0,0,0|1,0,0]=2 677 B7R1.2 CC1CCC(=O)O1 MCULE-3014789527 [0,1,0,0,0,0|1,0,0]=2 678 B7R1.2 CC1CCC(C1)Br MCULE-3834311364 [0,1,0,0,0,0|1,0,1]=3 679 B7R1.2 CC1CCC(C1)Cl MCULE-7669391571 [0,1,0,0,0,0|1,0,1]=3 680 B7R1.2 CC1CCC(C1)N MCULE-3681457592 [0,1,0,0,0,0|1,0,1]=3 681 B7R1.2 CC1CCC(C1)N MCULE-8238390084 [0,1,0,0,0,0|1,0,1]=3 682 B7R1.2 CC1CCC(C1)O MCULE-7892602703 [0,1,0,0,0,0|0,0,2]=3 683 B7R1.2 CC1CCC(N1)C MCULE-8652550641 [0,1,0,0,0,0|2,0,1]=4 684 B7R1.2 CC1CCC(N1)C MCULE-9945795318 [0,1,0,0,0,0|2,0,1]=4 685 B7R1.2 CC1CCC(O1)C MCULE-6766843462 [0,1,0,0,0,0|2,0,1]=4 686 B7R1.2 CC1CC[C@H](N1)C MCULE-7537248866 [0,1,0,0,0,0|2,0,1]=4 687 B7R1.2 CC1CC[C@H](N1)C MCULE-8839413924 [0,1,0,0,0,0|2,0,1]=4 688 B7R1.2 CC1CN=C(O1)N MCULE-2936787754 [0,1,0,0,0,0|3,0,0]=4 689 B7R1.2 CC1CN=C(O1)N MCULE-5542499755 [0,1,0,0,0,0|3,0,0]=4 690 B7R1.2 CC1CN=C(S1)N MCULE-5641549444 [0,1,0,0,0,0|3,0,0]=4 691 B7R1.2 CC1CN=C(S1)N MCULE-9229369376 [0,1,0,0,0,0|3,0,0]=4 692 B7R1.2 CC1CNC(=O)C1 MCULE-7180589009 [0,1,0,0,0,0|1,0,0]=2 693 B7R1.2 CC1CNC(=O)N1 MCULE-3789430210 [0,1,0,0,0,0|2,0,0]=3 694 B7R1.2 CC1CNC(=O)O1 MCULE-1288358267 [0,1,0,0,0,0|2,0,0]=3 695 B7R1.2 CC1CNC(=S)N1 MCULE-5305006156 [0,1,0,0,0,0|2,1,0]=4 696 B7R1.2 CC1CNC(=S)S1 MCULE-1131079445 [0,1,0,0,0,0|2,1,0]=4 697 B7R1.2 CC1CNC(C1)C MCULE-3051496448 [0,1,0,0,0,0|2,0,1]=4 698 B7R1.2 CC1CNC(C1)C MCULE-9324057254 [0,1,0,0,0,0|2,0,1]=4 699 B7R1.2 CC1COC(=O)C1 MCULE-7226555218 [0,1,0,0,0,0|1,0,0]=2 700 B7R1.2 CC1COC(=O)N1 MCULE-5787960105 [0,1,0,0,0,0|2,0,0]=3 701 B7R1.2 CC1COC(=O)O1 MCULE-9055336051 [0,1,0,0,0,0|2,0,0]=3 702 B7R1.2 CC1COC(=S)N1 MCULE-4793665300 [0,1,0,0,0,0|2,1,0]=4 703 B7R1.2 CC1COS(=O)O1 MCULE-7795249539 [0,1,0,0,0,0|3,0,0]=4 704 B7R1.2 CC1CSC(=O)S1 MCULE-5074098161 [0,1,0,0,0,0|2,0,0]=3 705 B7R1.2 CC1CSC(=S)N1 MCULE-9334196132 [0,1,0,0,0,0|2,1,0]=4 706 B7R1.2 CC1NCC(=O)N1 MCULE-9790180398 [0,1,0,0,0,0|2,0,0]=3 707 B7R1.2 CN1CCC(=O)C1 MCULE-4017029823 [0,1,0,0,0,0|1,0,0]=2 708 B7R1.2 CN1CCC(=O)C1 MCULE-8684002131 [0,1,0,0,0,0|1,0,0]=2 709 B7R1.2 CN1CCC(C1)Br MCULE-3493698258 [0,1,0,0,0,0|2,0,0]=3 710 B7R1.2 CN1CCC(C1)Cl MCULE-4289154186 [0,1,0,0,0,0|2,0,0]=3 711 B7R1.2 CN1CCC(C1)I MCULE-7694112270 [0,1,0,0,0,0|2,0,0]=3 712 B7R1.2 CN1CCC(C1)N MCULE-1293214424 [0,1,0,0,0,0|2,0,0]=3 713 B7R1.2 CN1CCC(C1)N MCULE-1923071969 [0,1,0,0,0,0|2,0,0]=3 714 B7R1.2 CN1CCC(C1)N MCULE-8906644208 [0,1,0,0,0,0|2,0,0]=3 715 B7R1.2 CN1CCC(C1)O MCULE-7899934177 [0,1,0,0,0,0|2,0,0]=3 716 B7R1.2 CN1CC[C@@H](C1)Br MCULE-3557435415 [0,1,0,0,0,0|2,0,0]=3 717 B7R1.2 CN1CC[C@@H](C1)Cl MCULE-2590203116 [0,1,0,0,0,0|2,0,0]=3 718 B7R1.2 CN1CC[C@@H](C1)I MCULE-9659903055 [0,1,0,0,0,0|2,0,0]=3 719 B7R1.2 CN1CC[C@@H](C1)N MCULE-2789588017 [0,1,0,0,0,0|2,0,0]=3 720 B7R1.2 CN1CC[C@@H](C1)N MCULE-3064746432 [0,1,0,0,0,0|2,0,0]=3 721 B7R1.2 CN1CC[C@@H](C1)N MCULE-3417580502 [0,1,0,0,0,0|2,0,0]=3 722 B7R1.2 CN1CC[C@@H](C1)N MCULE-4507441839 [0,1,0,0,0,0|2,0,0]=3 723 B7R1.2 CN1CC[C@@H](C1)N MCULE-7304925156 [0,1,0,0,0,0|2,0,0]=3 724 B7R1.2 CN1CC[C@@H](C1)N MCULE-8752975101 [0,1,0,0,0,0|2,0,0]=3 725 B7R1.2 CN1CC[C@@H](C1)O MCULE-1236945758 [0,1,0,0,0,0|2,0,0]=3 726 B7R1.2 CN1CC[C@@H](C1)O MCULE-4275527304 [0,1,0,0,0,0|2,0,0]=3 727 B7R1.2 CN1CC[C@H](C1)Br MCULE-5126641770 [0,1,0,0,0,0|2,0,0]=3 728 B7R1.2 CN1CC[C@H](C1)Cl MCULE-6900681925 [0,1,0,0,0,0|2,0,0]=3 729 B7R1.2 CN1CC[C@H](C1)I MCULE-5536628497 [0,1,0,0,0,0|2,0,0]=3 730 B7R1.2 CN1CC[C@H](C1)N MCULE-1557911450 [0,1,0,0,0,0|2,0,0]=3 731 B7R1.2 CN1CC[C@H](C1)N MCULE-2070741351 [0,1,0,0,0,0|2,0,0]=3 732 B7R1.2 CN1CC[C@H](C1)N MCULE-4287469497 [0,1,0,0,0,0|2,0,0]=3 733 B7R1.2 CN1CC[C@H](C1)N MCULE-6191225667 [0,1,0,0,0,0|2,0,0]=3 734 B7R1.2 CN1CC[C@H](C1)N MCULE-7699833473 [0,1,0,0,0,0|2,0,0]=3 735 B7R1.2 CN1CC[C@H](C1)N MCULE-8419212613 [0,1,0,0,0,0|2,0,0]=3 736 B7R1.2 CN1CC[C@H](C1)O MCULE-6665002754 [0,1,0,0,0,0|2,0,0]=3 737 B7R1.2 CN1CC[C@H](C1)O MCULE-8080661086 [0,1,0,0,0,0|2,0,0]=3 738 B7R1.2 C[C@@H]1CC(=O)CN1 MCULE-1621276410 [0,1,0,0,0,0|1,0,0]=2 739 B7R1.2 C[C@@H]1CC(=O)CN1 MCULE-8721208019 [0,1,0,0,0,0|1,0,0]=2 740 B7R1.2 C[C@@H]1CCC(=O)N1 MCULE-2915942259 [0,1,0,0,0,0|1,0,0]=2 741 B7R1.2 C[C@@H]1CCC(=O)N1 MCULE-8123247569 [0,1,0,0,0,0|1,0,0]=2 742 B7R1.2 C[C@@H]1CCC(=O)O1 MCULE-5934008113 [0,1,0,0,0,0|1,0,0]=2 743 B7R1.2 C[C@@H]1CC[C@@H](C1)N MCULE-9471729241 [0,1,0,0,0,0|1,0,1]=3 744 B7R1.2 C[C@@H]1CC[C@H](C1)N MCULE-5368765184 [0,1,0,0,0,0|1,0,1]=3 745 B7R1.2 C[C@@H]1CC[C@H](N1)C MCULE-1673197449 [0,1,0,0,0,0|2,0,1]=4 746 B7R1.2 C[C@@H]1CC[C@H](N1)C MCULE-2729648845 [0,1,0,0,0,0|2,0,1]=4 747 B7R1.2 C[C@@H]1CC[C@H](N1)C MCULE-4960548681 [0,1,0,0,0,0|2,0,1]=4 748 B7R1.2 C[C@@H]1CC[C@H](N1)C MCULE-9686295802 [0,1,0,0,0,0|2,0,1]=4 749 B7R1.2 C[C@@H]1CNC(=O)C1 MCULE-2439559922 [0,1,0,0,0,0|1,0,0]=2 750 B7R1.2 C[C@@H]1CNC(=O)C1 MCULE-7246323100 [0,1,0,0,0,0|1,0,0]=2 751 B7R1.2 C[C@@H]1CNC(=O)O1 MCULE-8336717940 [0,1,0,0,0,0|2,0,0]=3 752 B7R1.2 C[C@@H]1CNC(=O)O1 MCULE-9661080313 [0,1,0,0,0,0|2,0,0]=3 753 B7R1.2 C[C@@H]1COC(=O)C1 MCULE-1121808555 [0,1,0,0,0,0|1,0,0]=2 754 B7R1.2 C[C@@H]1COC(=O)C1 MCULE-1627827491 [0,1,0,0,0,0|1,0,0]=2 755 B7R1.2 C[C@@H]1COC(=O)N1 MCULE-2439588002 [0,1,0,0,0,0|2,0,0]=3 756 B7R1.2 C[C@@H]1COC(=O)N1 MCULE-5329850427 [0,1,0,0,0,0|2,0,0]=3 757 B7R1.2 C[C@@H]1COC(=O)O1 MCULE-3187800510 [0,1,0,0,0,0|2,0,0]=3 758 B7R1.2 C[C@@H]1COC(=O)O1 MCULE-6719271655 [0,1,0,0,0,0|2,0,0]=3 759 B7R1.2 C[C@@H]1C[C@@H](CN1)F MCULE-1790804170 [0,1,0,0,0,0|2,0,1]=4 760 B7R1.2 C[C@@H]1C[C@@H](CN1)F MCULE-2224321786 [0,1,0,0,0,0|2,0,1]=4 761 B7R1.2 C[C@@H]1C[C@@H](CN1)F MCULE-6164070045 [0,1,0,0,0,0|2,0,1]=4 762 B7R1.2 C[C@@H]1C[C@@H](CN1)F MCULE-6870592338 [0,1,0,0,0,0|2,0,1]=4 763 B7R1.2 C[C@@H]1C[C@@H](CN1)O MCULE-1211015225 [0,1,0,0,0,0|1,0,2]=4 764 B7R1.2 C[C@@H]1C[C@@H](CN1)O MCULE-8025231795 [0,1,0,0,0,0|1,0,2]=4 765 B7R1.2 C[C@@H]1C[C@@H](CN1)O MCULE-8074184383 [0,1,0,0,0,0|1,0,2]=4 766 B7R1.2 C[C@@H]1C[C@@H](CN1)O MCULE-8403784233 [0,1,0,0,0,0|1,0,2]=4 767 B7R1.2 C[C@@H]1C[C@H](CN1)F MCULE-1165785658 [0,1,0,0,0,0|2,0,1]=4 768 B7R1.2 C[C@@H]1C[C@H](CN1)F MCULE-2237025386 [0,1,0,0,0,0|2,0,1]=4 769 B7R1.2 C[C@@H]1C[C@H](CN1)F MCULE-4695463101 [0,1,0,0,0,0|2,0,1]=4 770 B7R1.2 C[C@@H]1C[C@H](CN1)F MCULE-9859386988 [0,1,0,0,0,0|2,0,1]=4 771 B7R1.2 C[C@@H]1C[C@H](CN1)O MCULE-4359200896 [0,1,0,0,0,0|1,0,2]=4 772 B7R1.2 C[C@@H]1C[C@H](CN1)O MCULE-5029850022 [0,1,0,0,0,0|1,0,2]=4 773 B7R1.2 C[C@@H]1C[C@H](CN1)O MCULE-8880723450 [0,1,0,0,0,0|1,0,2]=4 774 B7R1.2 C[C@@H]1C[C@H](CN1)O MCULE-8966000465 [0,1,0,0,0,0|1,0,2]=4 775 B7R1.2 C[C@H]1CC(=O)CN1 MCULE-3272300487 [0,1,0,0,0,0|1,0,0]=2 776 B7R1.2 C[C@H]1CC(=O)CN1 MCULE-4583858198 [0,1,0,0,0,0|1,0,0]=2 777 B7R1.2 C[C@H]1CC(=O)CN1 MCULE-5135895304 [0,1,0,0,0,0|1,0,0]=2 778 B7R1.2 C[C@H]1CC(=O)CN1 MCULE-6058896534 [0,1,0,0,0,0|1,0,0]=2 779 B7R1.2 C[C@H]1CCC(=O)C1 MCULE-7319626625 [0,1,0,0,0,0|0,0,0]=1 780 B7R1.2 C[C@H]1CCC(=O)N1 MCULE-2618122031 [0,1,0,0,0,0|1,0,0]=2 781 B7R1.2 C[C@H]1CCC(=O)N1 MCULE-6630066118 [0,1,0,0,0,0|1,0,0]=2 782 B7R1.2 C[C@H]1CCC(=O)O1 MCULE-5274272771 [0,1,0,0,0,0|1,0,0]=2 783 B7R1.2 C[C@H]1CC[C@@H](C1)N MCULE-1080493056 [0,1,0,0,0,0|1,0,1]=3 784 B7R1.2 C[C@H]1CC[C@@H](N1)C MCULE-4583560293 [0,1,0,0,0,0|2,0,1]=4 785 B7R1.2 C[C@H]1CC[C@@H](N1)C MCULE-8297612622 [0,1,0,0,0,0|2,0,1]=4 786 B7R1.2 C[C@H]1CC[C@@H](N1)C MCULE-8699883146 [0,1,0,0,0,0|2,0,1]=4 787 B7R1.2 C[C@H]1CC[C@@H](N1)C MCULE-8917914682 [0,1,0,0,0,0|2,0,1]=4 788 B7R1.2 C[C@H]1CC[C@H](C1)C MCULE-8059507758 [0,1,0,0,0,0|1,0,1]=3 789 B7R1.2 C[C@H]1CC[C@H](C1)N MCULE-7070775136 [0,1,0,0,0,0|1,0,1]=3 790 B7R1.2 C[C@H]1CC[C@H](N1)C MCULE-1935235769 [0,1,0,0,0,0|2,0,1]=4 791 B7R1.2 C[C@H]1CC[C@H](N1)C MCULE-9833374653 [0,1,0,0,0,0|2,0,1]=4 792 B7R1.2 C[C@H]1CNC(=O)C1 MCULE-3395896178 [0,1,0,0,0,0|1,0,0]=2 793 B7R1.2 C[C@H]1CNC(=O)C1 MCULE-8492971593 [0,1,0,0,0,0|1,0,0]=2 794 B7R1.2 C[C@H]1COC(=O)C1 MCULE-6050720348 [0,1,0,0,0,0|1,0,0]=2 795 B7R1.2 C[C@H]1COC(=O)N1 MCULE-7240884474 [0,1,0,0,0,0|2,0,0]=3 796 B7R1.2 C[C@H]1COC(=O)N1 MCULE-7811823319 [0,1,0,0,0,0|2,0,0]=3 797 B7R1.2 C[C@H]1COC(=O)O1 MCULE-2416711374 [0,1,0,0,0,0|2,0,0]=3 798 B7R1.2 C[C@H]1COC(=O)O1 MCULE-4223856214 [0,1,0,0,0,0|2,0,0]=3 799 B7R1.2 C[C@H]1CSC(=S)N1 MCULE-6690407523 [0,1,0,0,0,0|2,1,0]=4 800 B7R1.2 C[C@H]1C[C@@H](CN1)F MCULE-1742492020 [0,1,0,0,0,0|2,0,1]=4 801 B7R1.2 C[C@H]1C[C@@H](CN1)F MCULE-4690497151 [0,1,0,0,0,0|2,0,1]=4 802 B7R1.2 C[C@H]1C[C@@H](CN1)F MCULE-7372620241 [0,1,0,0,0,0|2,0,1]=4 803 B7R1.2 C[C@H]1C[C@@H](CN1)F MCULE-8319027426 [0,1,0,0,0,0|2,0,1]=4 804 B7R1.2 C[C@H]1C[C@@H](CN1)O MCULE-1346257695 [0,1,0,0,0,0|1,0,2]=4 805 B7R1.2 C[C@H]1C[C@@H](CN1)O MCULE-3035291598 [0,1,0,0,0,0|1,0,2]=4 806 B7R1.2 C[C@H]1C[C@@H](CN1)O MCULE-8611352921 [0,1,0,0,0,0|1,0,2]=4 807 B7R1.2 C[C@H]1C[C@@H](CN1)O MCULE-9413190353 [0,1,0,0,0,0|1,0,2]=4 808 B7R1.2 C[C@H]1C[C@H](CN1)F MCULE-1099206732 [0,1,0,0,0,0|2,0,1]=4 809 B7R1.2 C[C@H]1C[C@H](CN1)F MCULE-8257992498 [0,1,0,0,0,0|2,0,1]=4 810 B7R1.2 C[C@H]1C[C@H](CN1)F MCULE-8335445065 [0,1,0,0,0,0|2,0,1]=4 811 B7R1.2 C[C@H]1C[C@H](CN1)F MCULE-9395416229 [0,1,0,0,0,0|2,0,1]=4 812 B7R1.2 C[C@H]1C[C@H](CN1)O MCULE-3188785695 [0,1,0,0,0,0|1,0,2]=4 813 B7R1.2 C[C@H]1C[C@H](CN1)O MCULE-4518572489 [0,1,0,0,0,0|1,0,2]=4 814 B7R1.2 C[C@H]1C[C@H](CN1)O MCULE-5322353871 [0,1,0,0,0,0|1,0,2]=4 815 B7R1.2 C[C@H]1C[C@H](CN1)O MCULE-9693826142 [0,1,0,0,0,0|1,0,2]=4 816 B7R1.2 N=C1CSC(=O)N1 MCULE-9647262906 [0,1,0,0,0,0|2,0,1]=4 817 B7R1.2 NC1=CC(=O)CC1 MCULE-9465243079 [0,1,0,0,0,0|0,0,2]=3 818 B7R1.2 NC1=CC(=O)CS1 MCULE-9118810823 [0,1,0,0,0,0|1,0,2]=4 819 B7R1.2 NC1=NC(=O)CO1 MCULE-5739646901 [0,1,0,0,0,0|2,0,1]=4 820 B7R1.2 NC1=NC(=O)CS1 MCULE-1329225872 [0,1,0,0,0,0|2,0,1]=4 821 B7R1.2 NC1=NC(=O)CS1 MCULE-6008399337 [0,1,0,0,0,0|2,0,1]=4 822 B7R1.2 NC1=NCC(=O)N1 MCULE-7816305365 [0,1,0,0,0,0|2,0,1]=4 823 B7R1.2 NC1=NCC(=O)N1 MCULE-9546104284 [0,1,0,0,0,0|2,0,1]=4 824 B7R1.2 NC1=NCC(=O)S1 MCULE-1885235061 [0,1,0,0,0,0|2,0,1]=4 825 B7R1.2 NC1=NNC(=O)C1 MCULE-1000997494 [0,1,0,0,0,0|2,0,1]=4 826 B7R1.2 NC1CCC(=O)C1 MCULE-5102535286 [0,1,0,0,0,0|0,0,0]=1 827 B7R1.2 NC1CCC(=O)C1 MCULE-7722818264 [0,1,0,0,0,0|0,0,0]=1 828 B7R1.2 NC1CCC(=O)N1 MCULE-1843033026 [0,1,0,0,0,0|1,0,0]=2 829 B7R1.2 NC1CCC(=O)N1 MCULE-7671057220 [0,1,0,0,0,0|1,0,0]=2 830 B7R1.2 NC1CCC(C1)F MCULE-1052463910 [0,1,0,0,0,0|1,0,1]=3 831 B7R1.2 NC1CCC(C1)F MCULE-1362820422 [0,1,0,0,0,0|1,0,1]=3 832 B7R1.2 NC1CCC(C1)N MCULE-7855552124 [0,1,0,0,0,0|1,0,1]=3 833 B7R1.2 NC1CCC(C1)N MCULE-9706705284 [0,1,0,0,0,0|1,0,1]=3 834 B7R1.2 NC1CCC(C1)O MCULE-5821071286 [0,1,0,0,0,0|0,0,2]=3 835 B7R1.2 NC1CCC(C1)O MCULE-9391783901 [0,1,0,0,0,0|0,0,2]=3 836 B7R1.2 NC1CCS(=O)C1 MCULE-7416029311 [0,1,0,0,0,0|1,0,0]=2 837 B7R1.2 NC1CCS(=O)C1 MCULE-8914660363 [0,1,0,0,0,0|1,0,0]=2 838 B7R1.2 NC1CNC(=O)C1 MCULE-1690074091 [0,1,0,0,0,0|1,0,0]=2 839 B7R1.2 NC1CNC(=O)C1 MCULE-2563813057 [0,1,0,0,0,0|1,0,0]=2 840 B7R1.2 NC1CNC(=O)C1 MCULE-5332234739 [0,1,0,0,0,0|1,0,0]=2 841 B7R1.2 NC1CNC(=O)C1 MCULE-9955937074 [0,1,0,0,0,0|1,0,0]=2 842 B7R1.2 NC1COC(=O)C1 MCULE-1027386953 [0,1,0,0,0,0|1,0,0]=2 843 B7R1.2 NC1COC(=O)C1 MCULE-1493825051 [0,1,0,0,0,0|1,0,0]=2 844 B7R1.2 NC1COC(=O)C1 MCULE-3118610284 [0,1,0,0,0,0|1,0,0]=2 845 B7R1.2 NC1COC(=O)C1 MCULE-8194840985 [0,1,0,0,0,0|1,0,0]=2 846 B7R1.2 NC1N=CC(=O)S1 MCULE-9874802810 [0,1,0,0,0,0|2,0,1]=4 847 B7R1.2 NC1NC(=O)CS1 MCULE-5789159592 [0,1,0,0,0,0|2,0,0]=3 848 B7R1.2 N[C@@H]1CC[C@@H](C1)F MCULE-1039943323 [0,1,0,0,0,0|1,0,1]=3 849 B7R1.2 N[C@@H]1CC[C@@H](C1)F MCULE-3861238775 [0,1,0,0,0,0|1,0,1]=3 850 B7R1.2 N[C@@H]1CC[C@@H](C1)F MCULE-4709681384 [0,1,0,0,0,0|1,0,1]=3 851 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-2973461190 [0,1,0,0,0,0|0,0,2]=3 852 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-5462229704 [0,1,0,0,0,0|0,0,2]=3 853 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-6746606174 [0,1,0,0,0,0|0,0,2]=3 854 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-7196403409 [0,1,0,0,0,0|0,0,2]=3 855 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-7511735313 [0,1,0,0,0,0|0,0,2]=3 856 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-9023897758 [0,1,0,0,0,0|0,0,2]=3 857 B7R1.2 N[C@@H]1CC[C@H](C1)F MCULE-1973308112 [0,1,0,0,0,0|1,0,1]=3 858 B7R1.2 N[C@@H]1CC[C@H](C1)F MCULE-2885294836 [0,1,0,0,0,0|1,0,1]=3 859 B7R1.2 N[C@@H]1CC[C@H](C1)F MCULE-3217124168 [0,1,0,0,0,0|1,0,1]=3 860 B7R1.2 N[C@@H]1CC[C@H](C1)F MCULE-3983968357 [0,1,0,0,0,0|1,0,1]=3 861 B7R1.2 N[C@@H]1CC[C@H](C1)N MCULE-2953432986 [0,1,0,0,0,0|1,0,1]=3 862 B7R1.2 N[C@@H]1CC[C@H](C1)N MCULE-5679004800 [0,1,0,0,0,0|1,0,1]=3 863 B7R1.2 N[C@@H]1CC[C@H](C1)N MCULE-7275989455 [0,1,0,0,0,0|1,0,1]=3 864 B7R1.2 N[C@@H]1CC[C@H](C1)N MCULE-9713633356 [0,1,0,0,0,0|1,0,1]=3 865 B7R1.2 N[C@@H]1CC[C@H](C1)O MCULE-3286276562 [0,1,0,0,0,0|0,0,2]=3 866 B7R1.2 N[C@@H]1CC[C@H](C1)O MCULE-5345953109 [0,1,0,0,0,0|0,0,2]=3 867 B7R1.2 N[C@@H]1CC[C@H](C1)O MCULE-6442703385 [0,1,0,0,0,0|0,0,2]=3 868 B7R1.2 N[C@@H]1CC[C@H](C1)O MCULE-7457197538 [0,1,0,0,0,0|0,0,2]=3 869 B7R1.2 N[C@@H]1CNC(=O)C1 MCULE-1502944618 [0,1,0,0,0,0|1,0,0]=2 870 B7R1.2 N[C@@H]1CNC(=O)C1 MCULE-2444469131 [0,1,0,0,0,0|1,0,0]=2 871 B7R1.2 N[C@@H]1CNC(=O)C1 MCULE-7277309874 [0,1,0,0,0,0|1,0,0]=2 872 B7R1.2 N[C@@H]1CNC(=O)C1 MCULE-8533160250 [0,1,0,0,0,0|1,0,0]=2 873 B7R1.2 N[C@@H]1COC(=O)C1 MCULE-2437548952 [0,1,0,0,0,0|1,0,0]=2 874 B7R1.2 N[C@@H]1COC(=O)C1 MCULE-4215135536 [0,1,0,0,0,0|1,0,0]=2 875 B7R1.2 N[C@@H]1COC(=O)C1 MCULE-4884145743 [0,1,0,0,0,0|1,0,0]=2 876 B7R1.2 N[C@@H]1COC(=O)C1 MCULE-9276068415 [0,1,0,0,0,0|1,0,0]=2 877 B7R1.2 N[C@H]1CC[C@@H](C1)F MCULE-7847317272 [0,1,0,0,0,0|1,0,1]=3 878 B7R1.2 N[C@H]1CC[C@@H](C1)F MCULE-8833201415 [0,1,0,0,0,0|1,0,1]=3 879 B7R1.2 N[C@H]1CC[C@@H](C1)N MCULE-3035711729 [0,1,0,0,0,0|1,0,1]=3 880 B7R1.2 N[C@H]1CC[C@@H](C1)N MCULE-6912512686 [0,1,0,0,0,0|1,0,1]=3 881 B7R1.2 N[C@H]1CC[C@@H](C1)O MCULE-2764158583 [0,1,0,0,0,0|0,0,2]=3 882 B7R1.2 N[C@H]1CC[C@@H](C1)O MCULE-5047569623 [0,1,0,0,0,0|0,0,2]=3 883 B7R1.2 N[C@H]1CC[C@@H](C1)O MCULE-7674066148 [0,1,0,0,0,0|0,0,2]=3 884 B7R1.2 N[C@H]1CC[C@@H](C1)O MCULE-8478778872 [0,1,0,0,0,0|0,0,2]=3 885 B7R1.2 N[C@H]1CC[C@H](C1)F MCULE-1792150017 [0,1,0,0,0,0|1,0,1]=3 886 B7R1.2 N[C@H]1CC[C@H](C1)F MCULE-4563758183 [0,1,0,0,0,0|1,0,1]=3 887 B7R1.2 N[C@H]1CC[C@H](C1)F MCULE-4785441600 [0,1,0,0,0,0|1,0,1]=3 888 B7R1.2 N[C@H]1CC[C@H](C1)F MCULE-5413630050 [0,1,0,0,0,0|1,0,1]=3 889 B7R1.2 N[C@H]1CC[C@H](C1)F MCULE-7223746698 [0,1,0,0,0,0|1,0,1]=3 890 B7R1.2 N[C@H]1CC[C@H](C1)F MCULE-9000616089 [0,1,0,0,0,0|1,0,1]=3 891 B7R1.2 N[C@H]1CC[C@H](C1)N MCULE-3378648870 [0,1,0,0,0,0|1,0,1]=3 892 B7R1.2 N[C@H]1CC[C@H](C1)N MCULE-7356571170 [0,1,0,0,0,0|1,0,1]=3 893 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-3786824722 [0,1,0,0,0,0|0,0,2]=3 894 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-4140170961 [0,1,0,0,0,0|0,0,2]=3 895 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-5760466174 [0,1,0,0,0,0|0,0,2]=3 896 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-5995468864 [0,1,0,0,0,0|0,0,2]=3 897 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-6230469368 [0,1,0,0,0,0|0,0,2]=3 898 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-9622062244 [0,1,0,0,0,0|0,0,2]=3 899 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-1884894725 [0,1,0,0,0,0|1,0,0]=2 900 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-2130809002 [0,1,0,0,0,0|1,0,0]=2 901 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-3881338264 [0,1,0,0,0,0|1,0,0]=2 902 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-4324375667 [0,1,0,0,0,0|1,0,0]=2 903 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-5900761307 [0,1,0,0,0,0|1,0,0]=2 904 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-6007209179 [0,1,0,0,0,0|1,0,0]=2 905 B7R1.2 N[C@H]1COC(=O)C1 MCULE-2936782126 [0,1,0,0,0,0|1,0,0]=2 906 B7R1.2 N[C@H]1COC(=O)C1 MCULE-4255876921 [0,1,0,0,0,0|1,0,0]=2 907 B7R1.2 N[C@H]1COC(=O)C1 MCULE-5377151477 [0,1,0,0,0,0|1,0,0]=2 908 B7R1.2 N[C@H]1COC(=O)C1 MCULE-6406960509 [0,1,0,0,0,0|1,0,0]=2 909 B7R1.2 O=C1C=C(CC1)Br MCULE-8421005141 [0,1,0,0,0,0|0,0,2]=3 910 B7R1.2 O=C1C=C(CC1)Cl MCULE-4481059890 [0,1,0,0,0,0|0,0,2]=3 911 B7R1.2 O=C1C=C(CC1)I MCULE-9887353763 [0,1,0,0,0,0|0,0,2]=3 912 B7R1.2 O=C1C=C(CC1)O MCULE-4815747510 [0,1,0,0,0,0|0,0,2]=3 913 B7R1.2 O=C1C=C(CN1)Br MCULE-7250904402 [0,1,0,0,0,0|1,0,2]=4 914 B7R1.2 O=C1C=C(CN1)O MCULE-4305405716 [0,1,0,0,0,0|1,0,2]=4 915 B7R1.2 O=C1C=C(CO1)Br MCULE-8883097432 [0,1,0,0,0,0|1,0,2]=4 916 B7R1.2 O=C1C=C(CO1)O MCULE-5095558101 [0,1,0,0,0,0|1,0,2]=4 917 B7R1.2 O=C1C=CC(=O)C1 MCULE-7662591278 [0,1,0,0,0,0|0,0,3]=4 918 B7R1.2 O=C1C=CC(C1)O MCULE-6464451546 [0,1,0,0,0,0|0,0,2]=3 919 B7R1.2 O=C1C=CC(O1)Br MCULE-3933464968 [0,1,0,0,0,0|1,0,2]=4 920 B7R1.2 O=C1C=CC(O1)O MCULE-7170809381 [0,1,0,0,0,0|1,0,2]=4 921 B7R1.2 O=C1C=C[C@@H](C1)O MCULE-4535052390 [0,1,0,0,0,0|0,0,2]=3 922 B7R1.2 O=C1C=C[C@H](C1)O MCULE-9347047598 [0,1,0,0,0,0|0,0,2]=3 923 B7R1.2 O=C1CC(=CO1)O MCULE-3691688750 [0,1,0,0,0,0|1,0,2]=4 924 B7R1.2 O=C1CC(=O)NN1 MCULE-4591056937 [0,1,0,0,0,0|2,0,1]=4 925 B7R1.2 O=C1CC(CN1)O MCULE-8498039777 [0,1,0,0,0,0|1,0,0]=2 926 B7R1.2 O=C1CC(CN1)S MCULE-3257609096 [0,1,0,0,0,0|1,0,0]=2 927 B7R1.2 O=C1CC(CO1)O MCULE-3779919332 [0,1,0,0,0,0|1,0,0]=2 928 B7R1.2 O=C1CC(CO1)O MCULE-5609071664 [0,1,0,0,0,0|1,0,0]=2 929 B7R1.2 O=C1CCC(=O)C1 MCULE-6436831689 [0,1,0,0,0,0|0,0,1]=2 930 B7R1.2 O=C1CCC(=O)N1 MCULE-8278049979 [0,1,0,0,0,0|1,0,1]=3 931 B7R1.2 O=C1CCC(=O)O1 MCULE-1458819618 [0,1,0,0,0,0|1,0,1]=3 932 B7R1.2 O=C1CCC(C1)F MCULE-9585894610 [0,1,0,0,0,0|0,0,0]=1 933 B7R1.2 O=C1CCC(C1)I MCULE-5558007377 [0,1,0,0,0,0|0,0,0]=1 934 B7R1.2 O=C1CCC(C1)O MCULE-8500536547 [0,1,0,0,0,0|0,0,0]=1 935 B7R1.2 O=C1CCC(N1)O MCULE-1790956080 [0,1,0,0,0,0|1,0,0]=2 936 B7R1.2 O=C1CCC(O1)F MCULE-6874239017 [0,1,0,0,0,0|1,0,0]=2 937 B7R1.2 O=C1CCC(O1)O MCULE-5296344468 [0,1,0,0,0,0|1,0,0]=2 938 B7R1.2 O=C1CNC(=O)C1 MCULE-6981924013 [0,1,0,0,0,0|1,0,1]=3 939 B7R1.2 O=C1CNC(=O)N1 MCULE-6812812243 [0,1,0,0,0,0|2,0,1]=4 940 B7R1.2 O=C1CNC(=O)O1 MCULE-7702120642 [0,1,0,0,0,0|2,0,1]=4 941 B7R1.2 O=C1CNC(=O)S1 MCULE-5050685903 [0,1,0,0,0,0|2,0,1]=4 942 B7R1.2 O=C1CNC(=S)N1 MCULE-3766479597 [0,1,0,0,0,0|2,0,1]=4 943 B7R1.2 O=C1CNC(=S)S1 MCULE-4359186239 [0,1,0,0,0,0|2,0,1]=4 944 B7R1.2 O=C1CNC(S1)S MCULE-9237115672 [0,1,0,0,0,0|2,0,0]=3 945 B7R1.2 O=C1COC(=O)C1 MCULE-3258090872 [0,1,0,0,0,0|1,0,1]=3 946 B7R1.2 O=C1COC(=O)N1 MCULE-3103815953 [0,1,0,0,0,0|2,0,1]=4 947 B7R1.2 O=C1COC(=O)[N-]1 MCULE-2786348217 [0,1,0,0,0,0|2,0,1]=4 948 B7R1.2 O=C1CSC(=O)N1 MCULE-8206580994 [0,1,0,0,0,0|2,0,1]=4 949 B7R1.2 O=C1CSC(=S)N1 MCULE-8840169234 [0,1,0,0,0,0|2,0,1]=4 950 B7R1.2 O=C1C[C@@H](CN1)O MCULE-2016792324 [0,1,0,0,0,0|1,0,0]=2 951 B7R1.2 O=C1C[C@@H](CN1)O MCULE-9756194758 [0,1,0,0,0,0|1,0,0]=2 952 B7R1.2 O=C1C[C@@H](CO1)O MCULE-1467506377 [0,1,0,0,0,0|1,0,0]=2 953 B7R1.2 O=C1C[C@@H](CO1)O MCULE-3668466479 [0,1,0,0,0,0|1,0,0]=2 954 B7R1.2 O=C1C[C@H](CN1)O MCULE-2017150152 [0,1,0,0,0,0|1,0,0]=2 955 B7R1.2 O=C1C[C@H](CN1)O MCULE-5168961542 [0,1,0,0,0,0|1,0,0]=2 956 B7R1.2 O=C1C[C@H](CN1)S MCULE-6980612759 [0,1,0,0,0,0|1,0,0]=2 957 B7R1.2 O=C1C[C@H](CN1)S MCULE-7205538285 [0,1,0,0,0,0|1,0,0]=2 958 B7R1.2 O=C1C[C@H](CO1)O MCULE-5756899897 [0,1,0,0,0,0|1,0,0]=2 959 B7R1.2 O=C1C[C@H](CO1)O MCULE-6247095672 [0,1,0,0,0,0|1,0,0]=2 960 B7R1.2 O=C1NC(=S)CS1 MCULE-8601205978 [0,1,0,0,0,0|2,0,1]=4 961 B7R1.2 O=C1NCC(=S)N1 MCULE-9753398150 [0,1,0,0,0,0|2,0,1]=4 962 B7R1.2 O=C1OCC(O1)Cl MCULE-4046020713 [0,1,0,0,0,0|2,0,0]=3 963 B7R1.2 O=C1OCC(O1)F MCULE-7198712298 [0,1,0,0,0,0|2,0,0]=3 964 B7R1.2 OC1CCC(C1)O MCULE-2799846813 [0,1,0,0,0,0|0,0,2]=3 965 B7R1.2 OC1CCC(O1)O MCULE-8012370358 [0,1,0,0,0,0|1,0,2]=4 966 B7R1.2 O[C@@H]1CC[C@H](C1)O MCULE-4481324218 [0,1,0,0,0,0|0,0,2]=3 967 B7R1.2 O[C@@H]1CC[C@H](C1)O MCULE-6560672131 [0,1,0,0,0,0|0,0,2]=3 968 B7R1.2 O[C@H]1CC[C@H](C1)O MCULE-4640874873 [0,1,0,0,0,0|0,0,2]=3 969 B7R1.2 S=C1CCC(=S)N1 MCULE-1793012495 [0,1,0,0,0,0|1,1,1]=4 970 B7R1.2 [C@@H]1(CC[C@@H](C1)O)N MCULE-3137346382 [0,1,0,0,0,0|0,0,2]=3 971 B7R1.2 [C@@H]1(CC[C@@H](C1)O)N MCULE-9954737796 [0,1,0,0,0,0|0,0,2]=3 972 B7R1.2 [C@H]1(CCC(=O)C1)C MCULE-3827565169 [0,1,0,0,0,0|0,0,0]=1 973 B7R1.2 [C@H]1(CC[C@H](C1)O)O MCULE-4834858159 [0,1,0,0,0,0|0,0,2]=3 974 B7R1.2 [C@H]1(CN[C@@H](C1)C)O MCULE-1916837136 [0,1,0,0,0,0|1,0,2]=4 975 B7R1.2 [C@H]1(CN[C@@H](C1)C)O MCULE-8263093896 [0,1,0,0,0,0|1,0,2]=4 976 B7R1.2 [C@H]1(CN[C@H](C1)C)O MCULE-9065610836 [0,1,0,0,0,0|1,0,2]=4 977 B7R1.2 [C@H]1(CN[C@H](C1)C)O MCULE-9910248291 [0,1,0,0,0,0|1,0,2]=4 978 B7R1.4 BrC1=C(CCC1)Br MCULE-2617233515 [0,1,0,0,0,0|1,0,1]=3 979 B7R1.4 BrC1CCCC1Br MCULE-9172342979 [0,1,0,0,0,0|1,0,1]=3 980 B7R1.4 Br[C@@H]1CCC[C@H]1Br MCULE-5523481790 [0,1,0,0,0,0|1,0,1]=3 981 B7R1.4 C1(CCNC1=O)N MCULE-4906952813 [0,1,0,0,0,0|1,0,0]=2 982 B7R1.4 C1(CCNC1=O)N MCULE-9500853209 [0,1,0,0,0,0|1,0,0]=2 983 B7R1.4 C=C1CCCC1O MCULE-3026250203 [0,1,0,0,0,0|1,0,0]=2 984 B7R1.4 C=C1CCNC1=O MCULE-2729105523 [0,1,0,0,0,0|1,0,1]=3 985 B7R1.4 C=C1CCOC1=O MCULE-5907828600 [0,1,0,0,0,0|1,0,1]=3 986 B7R1.4 C=C1COCC1N MCULE-4632261286 [0,1,0,0,0,0|2,0,0]=3 987 B7R1.4 C=C1COCC1N MCULE-7153575301 [0,1,0,0,0,0|2,0,0]=3 988 B7R1.4 CC1=CCCC1=O MCULE-3713655264 [0,1,0,0,0,0|0,0,2]=3 989 B7R1.4 CC1=CCOC1=O MCULE-9785490540 [0,1,0,0,0,0|1,0,2]=4 990 B7R1.4 CC1C=NNC1=O MCULE-2547711142 [0,1,0,0,0,0|2,0,1]=4 991 B7R1.4 CC1CCCC1=O MCULE-3710290162 [0,1,0,0,0,0|0,0,0]=1 992 B7R1.4 CC1CCCC1Br MCULE-7816907673 [0,1,0,0,0,0|1,0,1]=3 993 B7R1.4 CC1CCCC1N MCULE-4318156403 [0,1,0,0,0,0|1,0,1]=3 994 B7R1.4 CC1CCCC1N MCULE-4434172193 [0,1,0,0,0,0|1,0,1]=3 995 B7R1.4 CC1CCCC1O MCULE-1288711765 [0,1,0,0,0,0|0,0,2]=3 996 B7R1.4 CC1CCNC1=O MCULE-7799644249 [0,1,0,0,0,0|1,0,0]=2 997 B7R1.4 CC1CCNC1C MCULE-2184586167 [0,1,0,0,0,0|2,0,1]=4 998 B7R1.4 CC1CCOC1=O MCULE-2223078294 [0,1,0,0,0,0|1,0,0]=2 999 B7R1.4 CC1CNCC1=O MCULE-2728909327 [0,1,0,0,0,0|1,0,0]=2 1000 B7R1.4 CC1CNCC1=O MCULE-9172381840 [0,1,0,0,0,0|1,0,0]=2 1001 B7R1.4 CC1CNCC1C MCULE-5821391512 [0,1,0,0,0,0|2,0,1]=4 1002 B7R1.4 CC1CNCC1C MCULE-6626101399 [0,1,0,0,0,0|2,0,1]=4 1003 B7R1.4 CC1CNCC1F MCULE-4834888455 [0,1,0,0,0,0|2,0,1]=4 1004 B7R1.4 CC1CNCC1F MCULE-7766072724 [0,1,0,0,0,0|2,0,1]=4 1005 B7R1.4 CC1CNCC1N MCULE-2314973615 [0,1,0,0,0,0|2,0,1]=4 1006 B7R1.4 CC1CNCC1N MCULE-8542352354 [0,1,0,0,0,0|2,0,1]=4 1007 B7R1.4 CC1CNCC1O MCULE-3308447861 [0,1,0,0,0,0|1,0,2]=4 1008 B7R1.4 CC1CNCC1O MCULE-8526879323 [0,1,0,0,0,0|1,0,2]=4 1009 B7R1.4 CC1COCC1=O MCULE-8115238635 [0,1,0,0,0,0|1,0,0]=2 1010 B7R1.4 CC1COCC1N MCULE-5453471722 [0,1,0,0,0,0|2,0,1]=4 1011 B7R1.4 CC1COCC1N MCULE-6647217023 [0,1,0,0,0,0|2,0,1]=4 1012 B7R1.4 CC1COCC1O MCULE-5925280081 [0,1,0,0,0,0|1,0,2]=4 1013 B7R1.4 CC1CON=C1N MCULE-8845082604 [0,1,0,0,0,0|3,0,0]=4 1014 B7R1.4 CC1CSCC1=O MCULE-5611423322 [0,1,0,0,0,0|1,0,0]=2 1015 B7R1.4 CC1CSCC1N MCULE-5628200403 [0,1,0,0,0,0|2,0,1]=4 1016 B7R1.4 CC1NCCC1=O MCULE-4206844406 [0,1,0,0,0,0|1,0,0]=2 1017 B7R1.4 CC1NCCC1=O MCULE-7025918222 [0,1,0,0,0,0|1,0,0]=2 1018 B7R1.4 CC1NCCC1O MCULE-7936666458 [0,1,0,0,0,0|1,0,2]=4 1019 B7R1.4 CC1NCCC1O MCULE-8369948926 [0,1,0,0,0,0|1,0,2]=4 1020 B7R1.4 CC1OCCC1=O MCULE-8278816952 [0,1,0,0,0,0|1,0,0]=2 1021 B7R1.4 CC1OCCC1N MCULE-4343663724 [0,1,0,0,0,0|2,0,1]=4 1022 B7R1.4 CC1OCCC1N MCULE-9003879039 [0,1,0,0,0,0|2,0,1]=4 1023 B7R1.4 CC1OCCC1O MCULE-6904695721 [0,1,0,0,0,0|1,0,2]=4 1024 B7R1.4 CC1OCCC1S MCULE-9127694888 [0,1,0,0,0,0|1,1,1]=4 1025 B7R1.4 CC1SCCC1=O MCULE-5264322365 [0,1,0,0,0,0|1,0,0]=2 1026 B7R1.4 CC1SCCC1N MCULE-5160182865 [0,1,0,0,0,0|2,0,1]=4 1027 B7R1.4 CC1SCCC1N MCULE-8827106279 [0,1,0,0,0,0|2,0,1]=4 1028 B7R1.4 CC1SCCC1O MCULE-4342593310 [0,1,0,0,0,0|1,0,2]=4 1029 B7R1.4 CN1CC=CC1=O MCULE-7879549885 [0,1,0,0,0,0|1,0,2]=4 1030 B7R1.4 CN1CCCC1=O MCULE-1381506705 [0,1,0,0,0,0|1,0,0]=2 1031 B7R1.4 CN1CCCC1=S MCULE-1990879544 [0,1,0,0,0,0|1,1,0]=3 1032 B7R1.4 CN1CCN=C1N MCULE-2837197751 [0,1,0,0,0,0|3,0,0]=4 1033 B7R1.4 CN1CCN=C1N MCULE-3453498956 [0,1,0,0,0,0|3,0,0]=4 1034 B7R1.4 CN1CCN=C1N MCULE-5148335318 [0,1,0,0,0,0|3,0,0]=4 1035 B7R1.4 CN1CCNC1=O MCULE-9774864412 [0,1,0,0,0,0|2,0,0]=3 1036 B7R1.4 CN1CCNC1=S MCULE-5960493935 [0,1,0,0,0,0|2,1,0]=4 1037 B7R1.4 CN1CCOC1=O MCULE-7467321799 [0,1,0,0,0,0|2,0,0]=3 1038 B7R1.4 CN1CCSC1=N MCULE-4301061048 [0,1,0,0,0,0|3,0,0]=4 1039 B7R1.4 CN1CCSC1=N MCULE-6525392774 [0,1,0,0,0,0|3,0,0]=4 1040 B7R1.4 CN1CCSC1=S MCULE-4468510205 [0,1,0,0,0,0|2,1,0]=4 1041 B7R1.4 CN1CNCC1=O MCULE-2252466841 [0,1,0,0,0,0|2,0,0]=3 1042 B7R1.4 CN1N=CCC1=O MCULE-2362806196 [0,1,0,0,0,0|2,0,1]=4 1043 B7R1.4 C[C@@H]1CCC[C@@H]1N MCULE-6206070680 [0,1,0,0,0,0|1,0,1]=3 1044 B7R1.4 C[C@@H]1CCC[C@@H]1N MCULE-9964938082 [0,1,0,0,0,0|1,0,1]=3 1045 B7R1.4 C[C@@H]1CCC[C@@H]1O MCULE-2617120620 [0,1,0,0,0,0|0,0,2]=3 1046 B7R1.4 C[C@@H]1CCC[C@H]1N MCULE-8385969474 [0,1,0,0,0,0|1,0,1]=3 1047 B7R1.4 C[C@@H]1CCC[C@H]1O MCULE-3398682980 [0,1,0,0,0,0|0,0,2]=3 1048 B7R1.4 C[C@@H]1CCNC1=O MCULE-1037883660 [0,1,0,0,0,0|1,0,0]=2 1049 B7R1.4 C[C@@H]1CNC[C@@H]1C MCULE-4592161485 [0,1,0,0,0,0|2,0,1]=4 1050 B7R1.4 C[C@@H]1CNC[C@@H]1C MCULE-5506149631 [0,1,0,0,0,0|2,0,1]=4 1051 B7R1.4 C[C@@H]1CNC[C@@H]1F MCULE-4204399527 [0,1,0,0,0,0|2,0,1]=4 1052 B7R1.4 C[C@@H]1CNC[C@@H]1F MCULE-8451199903 [0,1,0,0,0,0|2,0,1]=4 1053 B7R1.4 C[C@@H]1CNC[C@@H]1N MCULE-2290594563 [0,1,0,0,0,0|2,0,1]=4 1054 B7R1.4 C[C@@H]1CNC[C@@H]1N MCULE-2611807697 [0,1,0,0,0,0|2,0,1]=4 1055 B7R1.4 C[C@@H]1CNC[C@@H]1N MCULE-3707409979 [0,1,0,0,0,0|2,0,1]=4 1056 B7R1.4 C[C@@H]1CNC[C@@H]1N MCULE-4317636252 [0,1,0,0,0,0|2,0,1]=4 1057 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-2015388080 [0,1,0,0,0,0|1,0,2]=4 1058 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-3625149028 [0,1,0,0,0,0|1,0,2]=4 1059 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-5773404554 [0,1,0,0,0,0|1,0,2]=4 1060 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-6014391902 [0,1,0,0,0,0|1,0,2]=4 1061 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-6476104556 [0,1,0,0,0,0|1,0,2]=4 1062 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-6537028059 [0,1,0,0,0,0|1,0,2]=4 1063 B7R1.4 C[C@@H]1CNC[C@H]1C MCULE-2567871968 [0,1,0,0,0,0|2,0,1]=4 1064 B7R1.4 C[C@@H]1CNC[C@H]1C MCULE-5626188867 [0,1,0,0,0,0|2,0,1]=4 1065 B7R1.4 C[C@@H]1CNC[C@H]1C MCULE-7438009663 [0,1,0,0,0,0|2,0,1]=4 1066 B7R1.4 C[C@@H]1CNC[C@H]1C MCULE-8649896095 [0,1,0,0,0,0|2,0,1]=4 1067 B7R1.4 C[C@@H]1CNC[C@H]1O MCULE-4207581523 [0,1,0,0,0,0|1,0,2]=4 1068 B7R1.4 C[C@@H]1CNC[C@H]1O MCULE-6158474994 [0,1,0,0,0,0|1,0,2]=4 1069 B7R1.4 C[C@@H]1CNC[C@H]1O MCULE-7380960276 [0,1,0,0,0,0|1,0,2]=4 1070 B7R1.4 C[C@@H]1CNC[C@H]1O MCULE-7589629864 [0,1,0,0,0,0|1,0,2]=4 1071 B7R1.4 C[C@@H]1COC[C@@H]1O MCULE-3198029643 [0,1,0,0,0,0|1,0,2]=4 1072 B7R1.4 C[C@@H]1COC[C@H]1N MCULE-1145772262 [0,1,0,0,0,0|2,0,1]=4 1073 B7R1.4 C[C@@H]1COC[C@H]1N MCULE-6639849267 [0,1,0,0,0,0|2,0,1]=4 1074 B7R1.4 C[C@@H]1COC[C@H]1N MCULE-9659959713 [0,1,0,0,0,0|2,0,1]=4 1075 B7R1.4 C[C@@H]1COC[C@H]1O MCULE-1967963278 [0,1,0,0,0,0|1,0,2]=4 1076 B7R1.4 C[C@@H]1NCC[C@@H]1O MCULE-1705265213 [0,1,0,0,0,0|1,0,2]=4 1077 B7R1.4 C[C@@H]1NCC[C@@H]1O MCULE-3395898129 [0,1,0,0,0,0|1,0,2]=4 1078 B7R1.4 C[C@@H]1NCC[C@@H]1O MCULE-5909894286 [0,1,0,0,0,0|1,0,2]=4 1079 B7R1.4 C[C@@H]1NCC[C@@H]1O MCULE-9998480727 [0,1,0,0,0,0|1,0,2]=4 1080 B7R1.4 C[C@@H]1NCC[C@H]1O MCULE-1101330824 [0,1,0,0,0,0|1,0,2]=4 1081 B7R1.4 C[C@@H]1NCC[C@H]1O MCULE-3326131093 [0,1,0,0,0,0|1,0,2]=4 1082 B7R1.4 C[C@@H]1NCC[C@H]1O MCULE-3941456644 [0,1,0,0,0,0|1,0,2]=4 1083 B7R1.4 C[C@@H]1NCC[C@H]1O MCULE-8944150043 [0,1,0,0,0,0|1,0,2]=4 1084 B7R1.4 C[C@@H]1OCC[C@H]1N MCULE-5910807847 [0,1,0,0,0,0|2,0,1]=4 1085 B7R1.4 C[C@@H]1OCC[C@H]1N MCULE-7586038907 [0,1,0,0,0,0|2,0,1]=4 1086 B7R1.4 C[C@H]1CCC[C@@H]1N MCULE-4150988023 [0,1,0,0,0,0|1,0,1]=3 1087 B7R1.4 C[C@H]1CCC[C@@H]1O MCULE-5212653059 [0,1,0,0,0,0|0,0,2]=3 1088 B7R1.4 C[C@H]1CCC[C@@H]1O MCULE-7997646273 [0,1,0,0,0,0|0,0,2]=3 1089 B7R1.4 C[C@H]1CCC[C@H]1N MCULE-3329868072 [0,1,0,0,0,0|1,0,1]=3 1090 B7R1.4 C[C@H]1CCC[C@H]1N MCULE-4186145172 [0,1,0,0,0,0|1,0,1]=3 1091 B7R1.4 C[C@H]1CCC[C@H]1O MCULE-3291842365 [0,1,0,0,0,0|0,0,2]=3 1092 B7R1.4 C[C@H]1CCC[C@H]1O MCULE-7570125274 [0,1,0,0,0,0|0,0,2]=3 1093 B7R1.4 C[C@H]1CCNC1=O MCULE-9500360544 [0,1,0,0,0,0|1,0,0]=2 1094 B7R1.4 C[C@H]1CCN[C@@H]1C MCULE-7622265949 [0,1,0,0,0,0|2,0,1]=4 1095 B7R1.4 C[C@H]1CCN[C@@H]1C MCULE-7686056776 [0,1,0,0,0,0|2,0,1]=4 1096 B7R1.4 C[C@H]1CNC[C@@H]1C MCULE-2214344957 [0,1,0,0,0,0|2,0,1]=4 1097 B7R1.4 C[C@H]1CNC[C@@H]1C MCULE-2877312650 [0,1,0,0,0,0|2,0,1]=4 1098 B7R1.4 C[C@H]1CNC[C@@H]1O MCULE-2282810666 [0,1,0,0,0,0|1,0,2]=4 1099 B7R1.4 C[C@H]1CNC[C@@H]1O MCULE-2772361871 [0,1,0,0,0,0|1,0,2]=4 1100 B7R1.4 C[C@H]1CNC[C@@H]1O MCULE-3274154422 [0,1,0,0,0,0|1,0,2]=4 1101 B7R1.4 C[C@H]1CNC[C@@H]1O MCULE-3608199633 [0,1,0,0,0,0|1,0,2]=4 1102 B7R1.4 C[C@H]1CNC[C@H]1N MCULE-6069899229 [0,1,0,0,0,0|2,0,1]=4 1103 B7R1.4 C[C@H]1CNC[C@H]1N MCULE-8539137579 [0,1,0,0,0,0|2,0,1]=4 1104 B7R1.4 C[C@H]1CNC[C@H]1O MCULE-1988679936 [0,1,0,0,0,0|1,0,2]=4 1105 B7R1.4 C[C@H]1CNC[C@H]1O MCULE-3451477960 [0,1,0,0,0,0|1,0,2]=4 1106 B7R1.4 C[C@H]1CNC[C@H]1O MCULE-4396463600 [0,1,0,0,0,0|1,0,2]=4 1107 B7R1.4 C[C@H]1CNC[C@H]1O MCULE-7975653844 [0,1,0,0,0,0|1,0,2]=4 1108 B7R1.4 C[C@H]1COC[C@@H]1O MCULE-3765921602 [0,1,0,0,0,0|1,0,2]=4 1109 B7R1.4 C[C@H]1COC[C@@H]1O MCULE-5201903195 [0,1,0,0,0,0|1,0,2]=4 1110 B7R1.4 C[C@H]1COC[C@H]1O MCULE-2974083166 [0,1,0,0,0,0|1,0,2]=4 1111 B7R1.4 C[C@H]1COC[C@H]1O MCULE-6725207001 [0,1,0,0,0,0|1,0,2]=4 1112 B7R1.4 C[C@H]1NCC[C@@H]1O MCULE-5499798144 [0,1,0,0,0,0|1,0,2]=4 1113 B7R1.4 C[C@H]1NCC[C@@H]1O MCULE-7401004387 [0,1,0,0,0,0|1,0,2]=4 1114 B7R1.4 C[C@H]1NCC[C@H]1O MCULE-7469942077 [0,1,0,0,0,0|1,0,2]=4 1115 B7R1.4 C[C@H]1NCC[C@H]1O MCULE-9976903585 [0,1,0,0,0,0|1,0,2]=4 1116 B7R1.4 C[C@H]1OCC[C@H]1N MCULE-1432785321 [0,1,0,0,0,0|2,0,1]=4 1117 B7R1.4 C[C@H]1OCC[C@H]1N MCULE-3008045787 [0,1,0,0,0,0|2,0,1]=4 1118 B7R1.4 C[C@H]1OCC[C@H]1N MCULE-7656776924 [0,1,0,0,0,0|2,0,1]=4 1119 B7R1.4 C[C@H]1OCC[C@H]1N MCULE-8087379612 [0,1,0,0,0,0|2,0,1]=4 1120 B7R1.4 ClC1CCCC1Cl MCULE-1176916477 [0,1,0,0,0,0|1,0,1]=3 1121 B7R1.4 ClC1CCOC1Cl MCULE-1186010832 [0,1,0,0,0,0|2,0,1]=4 1122 B7R1.4 FC1CNCC1F MCULE-2795759224 [0,1,0,0,0,0|2,0,1]=4 1123 B7R1.4 FC1CNCC1F MCULE-4642260114 [0,1,0,0,0,0|2,0,1]=4 1124 B7R1.4 F[C@@H]1CNC[C@H]1F MCULE-1572445063 [0,1,0,0,0,0|2,0,1]=4 1125 B7R1.4 F[C@@H]1CNC[C@H]1F MCULE-4177562777 [0,1,0,0,0,0|2,0,1]=4 1126 B7R1.4 F[C@@H]1CNC[C@H]1F MCULE-4519639793 [0,1,0,0,0,0|2,0,1]=4 1127 B7R1.4 F[C@@H]1CNC[C@H]1F MCULE-5389552975 [0,1,0,0,0,0|2,0,1]=4 1128 B7R1.4 F[C@@H]1CNC[C@H]1F MCULE-6385794790 [0,1,0,0,0,0|2,0,1]=4 1129 B7R1.4 F[C@@H]1CNC[C@H]1F MCULE-7723721112 [0,1,0,0,0,0|2,0,1]=4 1130 B7R1.4 F[C@H]1CNC[C@@H]1F MCULE-1910510712 [0,1,0,0,0,0|2,0,1]=4 1131 B7R1.4 F[C@H]1CNC[C@@H]1F MCULE-1939514822 [0,1,0,0,0,0|2,0,1]=4 1132 B7R1.4 F[C@H]1CNC[C@@H]1F MCULE-7688312295 [0,1,0,0,0,0|2,0,1]=4 1133 B7R1.4 F[C@H]1CNC[C@@H]1F MCULE-9195313321 [0,1,0,0,0,0|2,0,1]=4 1134 B7R1.4 F[C@H]1CNC[C@H]1F MCULE-1191772323 [0,1,0,0,0,0|2,0,1]=4 1135 B7R1.4 F[C@H]1CNC[C@H]1F MCULE-1441165331 [0,1,0,0,0,0|2,0,1]=4 1136 B7R1.4 F[C@H]1CNC[C@H]1F MCULE-2941635831 [0,1,0,0,0,0|2,0,1]=4 1137 B7R1.4 NC1=CCOC1=O MCULE-9089854091 [0,1,0,0,0,0|1,0,2]=4 1138 B7R1.4 NC1CCCC1=O MCULE-3654949473 [0,1,0,0,0,0|0,0,0]=1 1139 B7R1.4 NC1CCCC1=O MCULE-6579965788 [0,1,0,0,0,0|0,0,0]=1 1140 B7R1.4 NC1CCCC1F MCULE-2221939717 [0,1,0,0,0,0|1,0,1]=3 1141 B7R1.4 NC1CCCC1F MCULE-7473190715 [0,1,0,0,0,0|1,0,1]=3 1142 B7R1.4 NC1CCCC1N MCULE-5161769230 [0,1,0,0,0,0|1,0,1]=3 1143 B7R1.4 NC1CCCC1N MCULE-7834445190 [0,1,0,0,0,0|1,0,1]=3 1144 B7R1.4 NC1CCCC1O MCULE-1657591641 [0,1,0,0,0,0|0,0,2]=3 1145 B7R1.4 NC1CCCC1O MCULE-6248992494 [0,1,0,0,0,0|0,0,2]=3 1146 B7R1.4 NC1CCNC1=O MCULE-2061829370 [0,1,0,0,0,0|1,0,0]=2 1147 B7R1.4 NC1CCNC1=O MCULE-4272585488 [0,1,0,0,0,0|1,0,0]=2 1148 B7R1.4 NC1CCOC1=O MCULE-1011670330 [0,1,0,0,0,0|1,0,0]=2 1149 B7R1.4 NC1CCOC1=O MCULE-1366805966 [0,1,0,0,0,0|1,0,0]=2 1150 B7R1.4 NC1CCOC1=O MCULE-1874490478 [0,1,0,0,0,0|1,0,0]=2 1151 B7R1.4 NC1CCOC1=O MCULE-4434379753 [0,1,0,0,0,0|1,0,0]=2 1152 B7R1.4 NC1CCOC1=O MCULE-7302633352 [0,1,0,0,0,0|1,0,0]=2 1153 B7R1.4 NC1CCOC1=O MCULE-8009953591 [0,1,0,0,0,0|1,0,0]=2 1154 B7R1.4 NC1CCSC1=O MCULE-5181497015 [0,1,0,0,0,0|1,0,0]=2 1155 B7R1.4 NC1CCSC1=O MCULE-8775141567 [0,1,0,0,0,0|1,0,0]=2 1156 B7R1.4 NC1CNCC1F MCULE-1177091135 [0,1,0,0,0,0|2,0,1]=4 1157 B7R1.4 NC1CNCC1F MCULE-8259596061 [0,1,0,0,0,0|2,0,1]=4 1158 B7R1.4 NC1COCC1Br MCULE-5821692966 [0,1,0,0,0,0|2,0,1]=4 1159 B7R1.4 NC1COCC1F MCULE-5032224318 [0,1,0,0,0,0|2,0,1]=4 1160 B7R1.4 NC1COCC1F MCULE-8302920845 [0,1,0,0,0,0|2,0,1]=4 1161 B7R1.4 NC1COCC1N MCULE-1202195361 [0,1,0,0,0,0|2,0,1]=4 1162 B7R1.4 NC1COCC1N MCULE-4117465167 [0,1,0,0,0,0|2,0,1]=4 1163 B7R1.4 NC1COCC1O MCULE-3115911209 [0,1,0,0,0,0|1,0,2]=4 1164 B7R1.4 NC1COCC1O MCULE-9837103399 [0,1,0,0,0,0|1,0,2]=4 1165 B7R1.4 NC1CONC1=O MCULE-3118867985 [0,1,0,0,0,0|2,0,0]=3 1166 B7R1.4 NC1CONC1=O MCULE-3159218372 [0,1,0,0,0,0|2,0,0]=3 1167 B7R1.4 NC1CSCC1O MCULE-4474934833 [0,1,0,0,0,0|1,0,2]=4 1168 B7R1.4 NC1CSCC1O MCULE-5059305463 [0,1,0,0,0,0|1,0,2]=4 1169 B7R1.4 NC1CSCC1O MCULE-8633680588 [0,1,0,0,0,0|1,0,2]=4 1170 B7R1.4 NN1CCCC1=O MCULE-2994786381 [0,1,0,0,0,0|1,0,0]=2 1171 B7R1.4 NN1CCCC1=O MCULE-5599329775 [0,1,0,0,0,0|1,0,0]=2 1172 B7R1.4 NN1CCNC1=O MCULE-9094725216 [0,1,0,0,0,0|2,0,0]=3 1173 B7R1.4 NN1CCNC1=S MCULE-6710971353 [0,1,0,0,0,0|2,1,0]=4 1174 B7R1.4 NN1CCOC1=O MCULE-7407834106 [0,1,0,0,0,0|2,0,0]=3 1175 B7R1.4 NN1CCOC1=O MCULE-8091613930 [0,1,0,0,0,0|2,0,0]=3 1176 B7R1.4 N[C@@H]1CCC[C@@H]1F MCULE-5918995947 [0,1,0,0,0,0|1,0,1]=3 1177 B7R1.4 N[C@@H]1CCC[C@@H]1O MCULE-3619202671 [0,1,0,0,0,0|0,0,2]=3 1178 B7R1.4 N[C@@H]1CCC[C@@H]1O MCULE-5588562063 [0,1,0,0,0,0|0,0,2]=3 1179 B7R1.4 N[C@@H]1CCC[C@@H]1O MCULE-8937650915 [0,1,0,0,0,0|0,0,2]=3 1180 B7R1.4 N[C@@H]1CCC[C@@H]1O MCULE-9550479411 [0,1,0,0,0,0|0,0,2]=3 1181 B7R1.4 N[C@@H]1CCC[C@@H]1O MCULE-9908988904 [0,1,0,0,0,0|0,0,2]=3 1182 B7R1.4 N[C@@H]1CCC[C@H]1F MCULE-1389039924 [0,1,0,0,0,0|1,0,1]=3 1183 B7R1.4 N[C@@H]1CCC[C@H]1F MCULE-2197861570 [0,1,0,0,0,0|1,0,1]=3 1184 B7R1.4 N[C@@H]1CCC[C@H]1F MCULE-3318849776 [0,1,0,0,0,0|1,0,1]=3 1185 B7R1.4 N[C@@H]1CCC[C@H]1F MCULE-5395257521 [0,1,0,0,0,0|1,0,1]=3 1186 B7R1.4 N[C@@H]1CCC[C@H]1F MCULE-8318262942 [0,1,0,0,0,0|1,0,1]=3 1187 B7R1.4 N[C@@H]1CCC[C@H]1F MCULE-9877401480 [0,1,0,0,0,0|1,0,1]=3 1188 B7R1.4 N[C@@H]1CCC[C@H]1N MCULE-1630250066 [0,1,0,0,0,0|1,0,1]=3 1189 B7R1.4 N[C@@H]1CCC[C@H]1N MCULE-5738867214 [0,1,0,0,0,0|1,0,1]=3 1190 B7R1.4 N[C@@H]1CCC[C@H]1N MCULE-5794367720 [0,1,0,0,0,0|1,0,1]=3 1191 B7R1.4 N[C@@H]1CCC[C@H]1N MCULE-6079002018 [0,1,0,0,0,0|1,0,1]=3 1192 B7R1.4 N[C@@H]1CCC[C@H]1N MCULE-7332231839 [0,1,0,0,0,0|1,0,1]=3 1193 B7R1.4 N[C@@H]1CCC[C@H]1N MCULE-7604406385 [0,1,0,0,0,0|1,0,1]=3 1194 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-2283352070 [0,1,0,0,0,0|0,0,2]=3 1195 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-3279782742 [0,1,0,0,0,0|0,0,2]=3 1196 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-6823698796 [0,1,0,0,0,0|0,0,2]=3 1197 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-7752087047 [0,1,0,0,0,0|0,0,2]=3 1198 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-8823714511 [0,1,0,0,0,0|0,0,2]=3 1199 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-9789739251 [0,1,0,0,0,0|0,0,2]=3 1200 B7R1.4 N[C@@H]1CCNC1=O MCULE-2357766642 [0,1,0,0,0,0|1,0,0]=2 1201 B7R1.4 N[C@@H]1CCNC1=O MCULE-9089591546 [0,1,0,0,0,0|1,0,0]=2 1202 B7R1.4 N[C@@H]1CCNC1=O MCULE-9558758567 [0,1,0,0,0,0|1,0,0]=2 1203 B7R1.4 N[C@@H]1CCNC1=O MCULE-9668255740 [0,1,0,0,0,0|1,0,0]=2 1204 B7R1.4 N[C@@H]1CCOC1=O MCULE-1027751896 [0,1,0,0,0,0|1,0,0]=2 1205 B7R1.4 N[C@@H]1CCOC1=O MCULE-4034349263 [0,1,0,0,0,0|1,0,0]=2 1206 B7R1.4 N[C@@H]1CCOC1=O MCULE-8790782772 [0,1,0,0,0,0|1,0,0]=2 1207 B7R1.4 N[C@@H]1CCOC1=O MCULE-9300265861 [0,1,0,0,0,0|1,0,0]=2 1208 B7R1.4 N[C@@H]1CCSC1=O MCULE-1269968791 [0,1,0,0,0,0|1,0,0]=2 1209 B7R1.4 N[C@@H]1CCSC1=O MCULE-5374422420 [0,1,0,0,0,0|1,0,0]=2 1210 B7R1.4 N[C@@H]1CCSC1=O MCULE-8203732076 [0,1,0,0,0,0|1,0,0]=2 1211 B7R1.4 N[C@@H]1CCSC1=O MCULE-8418670804 [0,1,0,0,0,0|1,0,0]=2 1212 B7R1.4 N[C@@H]1CNC[C@H]1F MCULE-1708344428 [0,1,0,0,0,0|2,0,1]=4 1213 B7R1.4 N[C@@H]1CNC[C@H]1F MCULE-3614628548 [0,1,0,0,0,0|2,0,1]=4 1214 B7R1.4 N[C@@H]1CNC[C@H]1F MCULE-5868430910 [0,1,0,0,0,0|2,0,1]=4 1215 B7R1.4 N[C@@H]1CNC[C@H]1F MCULE-9283549047 [0,1,0,0,0,0|2,0,1]=4 1216 B7R1.4 N[C@@H]1COC[C@@H]1F MCULE-1582887664 [0,1,0,0,0,0|2,0,1]=4 1217 B7R1.4 N[C@@H]1COC[C@@H]1F MCULE-3978694929 [0,1,0,0,0,0|2,0,1]=4 1218 B7R1.4 N[C@@H]1COC[C@@H]1F MCULE-4503972605 [0,1,0,0,0,0|2,0,1]=4 1219 B7R1.4 N[C@@H]1COC[C@@H]1F MCULE-6640537480 [0,1,0,0,0,0|2,0,1]=4 1220 B7R1.4 N[C@@H]1COC[C@@H]1N MCULE-5625344145 [0,1,0,0,0,0|2,0,1]=4 1221 B7R1.4 N[C@@H]1COC[C@@H]1N MCULE-5743565778 [0,1,0,0,0,0|2,0,1]=4 1222 B7R1.4 N[C@@H]1COC[C@@H]1N MCULE-7916026303 [0,1,0,0,0,0|2,0,1]=4 1223 B7R1.4 N[C@@H]1COC[C@@H]1O MCULE-2891920420 [0,1,0,0,0,0|1,0,2]=4 1224 B7R1.4 N[C@@H]1COC[C@@H]1O MCULE-5764643856 [0,1,0,0,0,0|1,0,2]=4 1225 B7R1.4 N[C@@H]1COC[C@H]1F MCULE-3183837574 [0,1,0,0,0,0|2,0,1]=4 1226 B7R1.4 N[C@@H]1COC[C@H]1F MCULE-3329511858 [0,1,0,0,0,0|2,0,1]=4 1227 B7R1.4 N[C@@H]1COC[C@H]1N MCULE-3234416434 [0,1,0,0,0,0|2,0,1]=4 1228 B7R1.4 N[C@@H]1COC[C@H]1N MCULE-3421021007 [0,1,0,0,0,0|2,0,1]=4 1229 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-1399984261 [0,1,0,0,0,0|1,0,2]=4 1230 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-2321912677 [0,1,0,0,0,0|1,0,2]=4 1231 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-4422404071 [0,1,0,0,0,0|1,0,2]=4 1232 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-7801515292 [0,1,0,0,0,0|1,0,2]=4 1233 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-9112718041 [0,1,0,0,0,0|1,0,2]=4 1234 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-9447703783 [0,1,0,0,0,0|1,0,2]=4 1235 B7R1.4 N[C@@H]1CONC1=O MCULE-4212827696 [0,1,0,0,0,0|2,0,0]=3 1236 B7R1.4 N[C@@H]1CONC1=O MCULE-6014142329 [0,1,0,0,0,0|2,0,0]=3 1237 B7R1.4 N[C@@H]1CSC[C@@H]1O MCULE-4507133192 [0,1,0,0,0,0|1,0,2]=4 1238 B7R1.4 N[C@@H]1CSC[C@@H]1O MCULE-9327920188 [0,1,0,0,0,0|1,0,2]=4 1239 B7R1.4 N[C@@H]1CSC[C@H]1O MCULE-5323319055 [0,1,0,0,0,0|1,0,2]=4 1240 B7R1.4 N[C@@H]1CSC[C@H]1O MCULE-8008053411 [0,1,0,0,0,0|1,0,2]=4 1241 B7R1.4 N[C@H]1CCC[C@@H]1O MCULE-6629056296 [0,1,0,0,0,0|0,0,2]=3 1242 B7R1.4 N[C@H]1CCC[C@@H]1O MCULE-7682114350 [0,1,0,0,0,0|0,0,2]=3 1243 B7R1.4 N[C@H]1CCC[C@@H]1O MCULE-8554796061 [0,1,0,0,0,0|0,0,2]=3 1244 B7R1.4 N[C@H]1CCC[C@@H]1O MCULE-9329258920 [0,1,0,0,0,0|0,0,2]=3 1245 B7R1.4 N[C@H]1CCC[C@H]1N MCULE-1361897949 [0,1,0,0,0,0|1,0,1]=3 1246 B7R1.4 N[C@H]1CCC[C@H]1N MCULE-4545374374 [0,1,0,0,0,0|1,0,1]=3 1247 B7R1.4 N[C@H]1CCC[C@H]1O MCULE-1156997833 [0,1,0,0,0,0|0,0,2]=3 1248 B7R1.4 N[C@H]1CCC[C@H]1O MCULE-2524879699 [0,1,0,0,0,0|0,0,2]=3 1249 B7R1.4 N[C@H]1CCC[C@H]1O MCULE-7034968971 [0,1,0,0,0,0|0,0,2]=3 1250 B7R1.4 N[C@H]1CCC[C@H]1O MCULE-9262461574 [0,1,0,0,0,0|0,0,2]=3 1251 B7R1.4 N[C@H]1CCC[C@H]1O MCULE-9904485750 [0,1,0,0,0,0|0,0,2]=3 1252 B7R1.4 N[C@H]1CCNC1=O MCULE-2327147408 [0,1,0,0,0,0|1,0,0]=2 1253 B7R1.4 N[C@H]1CCNC1=O MCULE-2923469662 [0,1,0,0,0,0|1,0,0]=2 1254 B7R1.4 N[C@H]1CCNC1=O MCULE-5882745021 [0,1,0,0,0,0|1,0,0]=2 1255 B7R1.4 N[C@H]1CCNC1=O MCULE-7846724738 [0,1,0,0,0,0|1,0,0]=2 1256 B7R1.4 N[C@H]1CCOC1=O MCULE-4393293388 [0,1,0,0,0,0|1,0,0]=2 1257 B7R1.4 N[C@H]1CCOC1=O MCULE-4751602783 [0,1,0,0,0,0|1,0,0]=2 1258 B7R1.4 N[C@H]1CCOC1=O MCULE-7924572479 [0,1,0,0,0,0|1,0,0]=2 1259 B7R1.4 N[C@H]1CCOC1=O MCULE-8545644747 [0,1,0,0,0,0|1,0,0]=2 1260 B7R1.4 N[C@H]1CCOC1=O MCULE-8634641228 [0,1,0,0,0,0|1,0,0]=2 1261 B7R1.4 N[C@H]1CCSC1=O MCULE-4497814170 [0,1,0,0,0,0|1,0,0]=2 1262 B7R1.4 N[C@H]1CCSC1=O MCULE-6209097230 [0,1,0,0,0,0|1,0,0]=2 1263 B7R1.4 N[C@H]1CCSC1=O MCULE-6419348515 [0,1,0,0,0,0|1,0,0]=2 1264 B7R1.4 N[C@H]1CCSC1=O MCULE-9091827364 [0,1,0,0,0,0|1,0,0]=2 1265 B7R1.4 N[C@H]1COC[C@@H]1F MCULE-1031359839 [0,1,0,0,0,0|2,0,1]=4 1266 B7R1.4 N[C@H]1COC[C@@H]1F MCULE-6239060869 [0,1,0,0,0,0|2,0,1]=4 1267 B7R1.4 N[C@H]1COC[C@@H]1N MCULE-4495433095 [0,1,0,0,0,0|2,0,1]=4 1268 B7R1.4 N[C@H]1COC[C@@H]1N MCULE-6217406845 [0,1,0,0,0,0|2,0,1]=4 1269 B7R1.4 N[C@H]1COC[C@@H]1N MCULE-9762071646 [0,1,0,0,0,0|2,0,1]=4 1270 B7R1.4 N[C@H]1COC[C@@H]1O MCULE-1604156911 [0,1,0,0,0,0|1,0,2]=4 1271 B7R1.4 N[C@H]1COC[C@@H]1O MCULE-3157811195 [0,1,0,0,0,0|1,0,2]=4 1272 B7R1.4 N[C@H]1COC[C@@H]1O MCULE-4377495223 [0,1,0,0,0,0|1,0,2]=4 1273 B7R1.4 N[C@H]1COC[C@@H]1O MCULE-8412403655 [0,1,0,0,0,0|1,0,2]=4 1274 B7R1.4 N[C@H]1COC[C@H]1F MCULE-7980939593 [0,1,0,0,0,0|2,0,1]=4 1275 B7R1.4 N[C@H]1COC[C@H]1F MCULE-8990550970 [0,1,0,0,0,0|2,0,1]=4 1276 B7R1.4 N[C@H]1COC[C@H]1O MCULE-5907972681 [0,1,0,0,0,0|1,0,2]=4 1277 B7R1.4 N[C@H]1COC[C@H]1O MCULE-7502895716 [0,1,0,0,0,0|1,0,2]=4 1278 B7R1.4 N[C@H]1COC[C@H]1O MCULE-8985833831 [0,1,0,0,0,0|1,0,2]=4 1279 B7R1.4 N[C@H]1COC[C@H]1O MCULE-9971794275 [0,1,0,0,0,0|1,0,2]=4 1280 B7R1.4 N[C@H]1CONC1=O MCULE-4286940154 [0,1,0,0,0,0|2,0,0]=3 1281 B7R1.4 N[C@H]1CONC1=O MCULE-9925977120 [0,1,0,0,0,0|2,0,0]=3 1282 B7R1.4 O=C1CCC=C1Br MCULE-1509582125 [0,1,0,0,0,0|0,0,2]=3 1283 B7R1.4 O=C1CCC=C1I MCULE-2710048446 [0,1,0,0,0,0|0,0,2]=3 1284 B7R1.4 O=C1CCC=C1O MCULE-8745661989 [0,1,0,0,0,0|0,0,2]=3 1285 B7R1.4 O=C1CCCC1=O MCULE-8040167119 [0,1,0,0,0,0|0,0,1]=2 1286 B7R1.4 O=C1CCCC1Br MCULE-3651373380 [0,1,0,0,0,0|0,0,0]=1 1287 B7R1.4 O=C1CCCC1Cl MCULE-7745647260 [0,1,0,0,0,0|0,0,0]=1 1288 B7R1.4 O=C1CCCC1F MCULE-8001765295 [0,1,0,0,0,0|0,0,0]=1 1289 B7R1.4 O=C1CCCC1O MCULE-6795188798 [0,1,0,0,0,0|0,0,0]=1 1290 B7R1.4 O=C1CCNC1=O MCULE-6243503430 [0,1,0,0,0,0|1,0,1]=3 1291 B7R1.4 O=C1NCCC1Br MCULE-5321265801 [0,1,0,0,0,0|1,0,0]=2 1292 B7R1.4 O=C1NCCC1Cl MCULE-1663035789 [0,1,0,0,0,0|1,0,0]=2 1293 B7R1.4 O=C1NCCC1F MCULE-2209899044 [0,1,0,0,0,0|1,0,0]=2 1294 B7R1.4 O=C1NCCC1O MCULE-8818841339 [0,1,0,0,0,0|1,0,0]=2 1295 B7R1.4 O=C1NCCC1O MCULE-9662824811 [0,1,0,0,0,0|1,0,0]=2 1296 B7R1.4 O=C1NCC[C@@H]1O MCULE-3212474164 [0,1,0,0,0,0|1,0,0]=2 1297 B7R1.4 O=C1NCC[C@@H]1O MCULE-7816291255 [0,1,0,0,0,0|1,0,0]=2 1298 B7R1.4 O=C1NCC[C@H]1O MCULE-1281835510 [0,1,0,0,0,0|1,0,0]=2 1299 B7R1.4 O=C1NCC[C@H]1O MCULE-6809356348 [0,1,0,0,0,0|1,0,0]=2 1300 B7R1.4 O=C1OCC=C1Br MCULE-9287853531 [0,1,0,0,0,0|1,0,2]=4 1301 B7R1.4 O=C1OCCC1Br MCULE-8316114331 [0,1,0,0,0,0|1,0,0]=2 1302 B7R1.4 O=C1OCCC1O MCULE-2144002601 [0,1,0,0,0,0|1,0,0]=2 1303 B7R1.4 O=C1OCCC1S MCULE-2130434062 [0,1,0,0,0,0|1,0,0]=2 1304 B7R1.4 O=C1OCC[C@@H]1O MCULE-7764011790 [0,1,0,0,0,0|1,0,0]=2 1305 B7R1.4 O=C1OCC[C@@H]1O MCULE-9001729998 [0,1,0,0,0,0|1,0,0]=2 1306 B7R1.4 O=C1OCC[C@H]1O MCULE-6949645282 [0,1,0,0,0,0|1,0,0]=2 1307 B7R1.4 O=C1OCC[C@H]1O MCULE-7110242636 [0,1,0,0,0,0|1,0,0]=2 1308 B7R1.4 OC1CCC=C1Br MCULE-2577502971 [0,1,0,0,0,0|1,0,1]=3 1309 B7R1.4 OC1CCCC1Br MCULE-9027030471 [0,1,0,0,0,0|0,0,2]=3 1310 B7R1.4 OC1CCCC1Cl MCULE-5561130140 [0,1,0,0,0,0|0,0,2]=3 1311 B7R1.4 OC1CCCC1F MCULE-9111039481 [0,1,0,0,0,0|0,0,2]=3 1312 B7R1.4 OC1CCCC1O MCULE-2003945768 [0,1,0,0,0,0|0,0,2]=3 1313 B7R1.4 OC1CNCC1Br MCULE-1241091506 [0,1,0,0,0,0|1,0,2]=4 1314 B7R1.4 OC1CNCC1Br MCULE-4889737174 [0,1,0,0,0,0|1,0,2]=4 1315 B7R1.4 OC1CNCC1F MCULE-3412240528 [0,1,0,0,0,0|1,0,2]=4 1316 B7R1.4 OC1CNCC1F MCULE-7214807363 [0,1,0,0,0,0|1,0,2]=4 1317 B7R1.4 OC1CNCC1O MCULE-4416566731 [0,1,0,0,0,0|1,0,2]=4 1318 B7R1.4 OC1CNCC1O MCULE-7287658845 [0,1,0,0,0,0|1,0,2]=4 1319 B7R1.4 OC1COCC1Br MCULE-8642236751 [0,1,0,0,0,0|1,0,2]=4 1320 B7R1.4 OC1COCC1F MCULE-3255803142 [0,1,0,0,0,0|1,0,2]=4 1321 B7R1.4 OC1COCC1O MCULE-2982401803 [0,1,0,0,0,0|1,0,2]=4 1322 B7R1.4 O[C@@H]1CCC[C@H]1Cl MCULE-5851051143 [0,1,0,0,0,0|0,0,2]=3 1323 B7R1.4 O[C@@H]1CCC[C@H]1Cl MCULE-6816188915 [0,1,0,0,0,0|0,0,2]=3 1324 B7R1.4 O[C@@H]1CCC[C@H]1F MCULE-6825738824 [0,1,0,0,0,0|0,0,2]=3 1325 B7R1.4 O[C@@H]1CCC[C@H]1O MCULE-3171045763 [0,1,0,0,0,0|0,0,2]=3 1326 B7R1.4 O[C@@H]1CCC[C@H]1O MCULE-4369287998 [0,1,0,0,0,0|0,0,2]=3 1327 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-4544085940 [0,1,0,0,0,0|1,0,2]=4 1328 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-6356393045 [0,1,0,0,0,0|1,0,2]=4 1329 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-7332143154 [0,1,0,0,0,0|1,0,2]=4 1330 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-8032995983 [0,1,0,0,0,0|1,0,2]=4 1331 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-8052505932 [0,1,0,0,0,0|1,0,2]=4 1332 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-8564653401 [0,1,0,0,0,0|1,0,2]=4 1333 B7R1.4 O[C@@H]1CNC[C@H]1F MCULE-2691246784 [0,1,0,0,0,0|1,0,2]=4 1334 B7R1.4 O[C@@H]1CNC[C@H]1F MCULE-7250968554 [0,1,0,0,0,0|1,0,2]=4 1335 B7R1.4 O[C@@H]1CNC[C@H]1F MCULE-8439784112 [0,1,0,0,0,0|1,0,2]=4 1336 B7R1.4 O[C@@H]1CNC[C@H]1F MCULE-8682802807 [0,1,0,0,0,0|1,0,2]=4 1337 B7R1.4 O[C@@H]1CNC[C@H]1O MCULE-2199886254 [0,1,0,0,0,0|1,0,2]=4 1338 B7R1.4 O[C@@H]1CNC[C@H]1O MCULE-3341203076 [0,1,0,0,0,0|1,0,2]=4 1339 B7R1.4 O[C@@H]1CNC[C@H]1O MCULE-5521619072 [0,1,0,0,0,0|1,0,2]=4 1340 B7R1.4 O[C@@H]1COC[C@H]1F MCULE-2460253154 [0,1,0,0,0,0|1,0,2]=4 1341 B7R1.4 O[C@@H]1COC[C@H]1F MCULE-3624406213 [0,1,0,0,0,0|1,0,2]=4 1342 B7R1.4 O[C@@H]1COC[C@H]1O MCULE-5846282762 [0,1,0,0,0,0|1,0,2]=4 1343 B7R1.4 O[C@H]1CCC[C@@H]1F MCULE-5487297072 [0,1,0,0,0,0|0,0,2]=3 1344 B7R1.4 O[C@H]1CCC[C@@H]1O MCULE-4051443060 [0,1,0,0,0,0|0,0,2]=3 1345 B7R1.4 O[C@H]1CCC[C@@H]1O MCULE-4644231649 [0,1,0,0,0,0|0,0,2]=3 1346 B7R1.4 O[C@H]1CCC[C@@H]1O MCULE-6847877597 [0,1,0,0,0,0|0,0,2]=3 1347 B7R1.4 O[C@H]1CCC[C@H]1Br MCULE-2758354858 [0,1,0,0,0,0|0,0,2]=3 1348 B7R1.4 O[C@H]1CCC[C@H]1Cl MCULE-6157730443 [0,1,0,0,0,0|0,0,2]=3 1349 B7R1.4 O[C@H]1CCC[C@H]1Cl MCULE-8785327416 [0,1,0,0,0,0|0,0,2]=3 1350 B7R1.4 O[C@H]1CCC[C@H]1O MCULE-7305350842 [0,1,0,0,0,0|0,0,2]=3 1351 B7R1.4 O[C@H]1CNC[C@@H]1F MCULE-3839318633 [0,1,0,0,0,0|1,0,2]=4 1352 B7R1.4 O[C@H]1CNC[C@@H]1F MCULE-4218821429 [0,1,0,0,0,0|1,0,2]=4 1353 B7R1.4 O[C@H]1CNC[C@@H]1F MCULE-7845583982 [0,1,0,0,0,0|1,0,2]=4 1354 B7R1.4 O[C@H]1CNC[C@@H]1F MCULE-9325791348 [0,1,0,0,0,0|1,0,2]=4 1355 B7R1.4 O[C@H]1CNC[C@@H]1O MCULE-5585016580 [0,1,0,0,0,0|1,0,2]=4 1356 B7R1.4 O[C@H]1CNC[C@@H]1O MCULE-6252837981 [0,1,0,0,0,0|1,0,2]=4 1357 B7R1.4 O[C@H]1CNC[C@@H]1O MCULE-7474807017 [0,1,0,0,0,0|1,0,2]=4 1358 B7R1.4 O[C@H]1CNC[C@@H]1O MCULE-8814174366 [0,1,0,0,0,0|1,0,2]=4 1359 B7R1.4 O[C@H]1CNC[C@@H]1O MCULE-9936814184 [0,1,0,0,0,0|1,0,2]=4 1360 B7R1.4 O[C@H]1CNC[C@H]1F MCULE-2104048645 [0,1,0,0,0,0|1,0,2]=4 1361 B7R1.4 O[C@H]1CNC[C@H]1F MCULE-5086480017 [0,1,0,0,0,0|1,0,2]=4 1362 B7R1.4 O[C@H]1CNC[C@H]1F MCULE-5328004683 [0,1,0,0,0,0|1,0,2]=4 1363 B7R1.4 O[C@H]1CNC[C@H]1F MCULE-5990996560 [0,1,0,0,0,0|1,0,2]=4 1364 B7R1.4 O[C@H]1CNC[C@H]1O MCULE-8087937166 [0,1,0,0,0,0|1,0,2]=4 1365 B7R1.4 O[C@H]1CNC[C@H]1O MCULE-9522092804 [0,1,0,0,0,0|1,0,2]=4 1366 B7R1.4 O[C@H]1COC[C@@H]1F MCULE-7724910066 [0,1,0,0,0,0|1,0,2]=4 1367 B7R1.4 O[C@H]1COC[C@@H]1O MCULE-2140544466 [0,1,0,0,0,0|1,0,2]=4 1368 B7R1.4 O[C@H]1COC[C@@H]1O MCULE-9526811966 [0,1,0,0,0,0|1,0,2]=4 1369 B7R1.4 O[C@H]1COC[C@H]1O MCULE-2862505352 [0,1,0,0,0,0|1,0,2]=4 1370 B7R1.4 [C@@H]1(CCC[C@H]1N)C MCULE-2430440513 [0,1,0,0,0,0|1,0,1]=3 1371 B7R1.4 [C@@H]1(CCC[C@H]1N)C MCULE-8503171996 [0,1,0,0,0,0|1,0,1]=3 1372 B7R1.4 [C@@H]1(CCC[C@H]1N)F MCULE-5545998720 [0,1,0,0,0,0|1,0,1]=3 1373 B7R1.4 [C@@H]1(CNC[C@@H]1O)O MCULE-2661544949 [0,1,0,0,0,0|1,0,2]=4 1374 B7R1.4 [C@@H]1(COC[C@@H]1F)N MCULE-3635591654 [0,1,0,0,0,0|2,0,1]=4 1375 B7R1.4 [C@@H]1(COC[C@@H]1F)N MCULE-5914925477 [0,1,0,0,0,0|2,0,1]=4 1376 B7R1.4 [C@@H]1(COC[C@@H]1N)N MCULE-4324328112 [0,1,0,0,0,0|2,0,1]=4 1377 B7R1.4 [C@H]1(CNC[C@H]1F)O MCULE-1484680203 [0,1,0,0,0,0|1,0,2]=4 1378 B7R1.4 [C@H]1(CNC[C@H]1F)O MCULE-7754900549 [0,1,0,0,0,0|1,0,2]=4 1379 B7R1.4 [C@H]1(COC[C@H]1N)C MCULE-5920046767 [0,1,0,0,0,0|2,0,1]=4 1380 B7R1.4 [C@H]1(COC[C@H]1N)C MCULE-6282053067 [0,1,0,0,0,0|2,0,1]=4 1381 B7R1.4 [C@H]1(COC[C@H]1N)C MCULE-8432332245 [0,1,0,0,0,0|2,0,1]=4 1382 B7R1.4 [NH3+][C@@H]1CSC[C@@H]1O MCULE-5747970201 [0,1,0,0,0,0|1,0,2]=4 1383 B7R1.4 [NH3+][C@@H]1CSC[C@H]1O MCULE-4897701746 [0,1,0,0,0,0|1,0,2]=4 1384 B7R1.4 [NH3+][C@H]1CCOC1=O MCULE-8903471982 [0,1,0,0,0,0|1,0,0]=2 1385 B7R1.14 CC1(CCCC1)Br MCULE-8706490914 [0,1,0,0,0,0|1,0,1]=3 1386 B7R1.14 CC1(CCCC1)N MCULE-1696024032 [0,1,0,0,0,0|1,0,1]=3 1387 B7R1.14 CC1(CCCC1)N MCULE-7897960444 [0,1,0,0,0,0|1,0,1]=3 1388 B7R1.14 CC1(CCCC1)O MCULE-1425529053 [0,1,0,0,0,0|0,0,2]=3 1389 B7R1.14 CC1(CCCN1)C MCULE-3172250386 [0,1,0,0,0,0|2,0,1]=4 1390 B7R1.14 CC1(CCCN1)C MCULE-6227706175 [0,1,0,0,0,0|2,0,1]=4 1391 B7R1.14 CC1(CCNC1)C MCULE-3460660754 [0,1,0,0,0,0|2,0,1]=4 1392 B7R1.14 CC1(CCNC1)C MCULE-7874744806 [0,1,0,0,0,0|2,0,1]=4 1393 B7R1.14 CC1(CCNC1)C MCULE-9717378283 [0,1,0,0,0,0|2,0,1]=4 1394 B7R1.14 CC1(CCNC1)F MCULE-1205333206 [0,1,0,0,0,0|2,0,1]=4 1395 B7R1.14 CC1(CCNC1)F MCULE-8512729081 [0,1,0,0,0,0|2,0,1]=4 1396 B7R1.14 CC1(CCNC1)N MCULE-9317786482 [0,1,0,0,0,0|2,0,1]=4 1397 B7R1.14 CC1(CCNC1)N MCULE-9638120938 [0,1,0,0,0,0|2,0,1]=4 1398 B7R1.14 CC1(CCNC1)O MCULE-1812572207 [0,1,0,0,0,0|1,0,2]=4 1399 B7R1.14 CC1(CCNC1)O MCULE-3978790995 [0,1,0,0,0,0|1,0,2]=4 1400 B7R1.14 CC1(CCNC1)O MCULE-6355817754 [0,1,0,0,0,0|1,0,2]=4 1401 B7R1.14 CC1(CCNC1)O MCULE-7199660654 [0,1,0,0,0,0|1,0,2]=4 1402 B7R1.14 CC1(CCOC1)N MCULE-1997756007 [0,1,0,0,0,0|2,0,1]=4 1403 B7R1.14 CC1(CCOC1)N MCULE-5807249895 [0,1,0,0,0,0|2,0,1]=4 1404 B7R1.14 CC1(CCOC1)O MCULE-5065022086 [0,1,0,0,0,0|1,0,2]=4 1405 B7R1.14 CC1(CCSC1)O MCULE-3138867143 [0,1,0,0,0,0|1,0,2]=4 1406 B7R1.14 CP1(=O)CC=CC1 MCULE-4152900149 [0,1,0,0,0,0|1,0,2]=4 1407 B7R1.14 C[C@@]1(CCNC1)F MCULE-1340440767 [0,1,0,0,0,0|2,0,1]=4 1408 B7R1.14 C[C@@]1(CCNC1)F MCULE-5898059594 [0,1,0,0,0,0|2,0,1]=4 1409 B7R1.14 C[C@@]1(CCNC1)F MCULE-6901424312 [0,1,0,0,0,0|2,0,1]=4 1410 B7R1.14 C[C@@]1(CCNC1)F MCULE-9433824470 [0,1,0,0,0,0|2,0,1]=4 1411 B7R1.14 C[C@@]1(CCNC1)N MCULE-3652011553 [0,1,0,0,0,0|2,0,1]=4 1412 B7R1.14 C[C@@]1(CCNC1)O MCULE-2185266890 [0,1,0,0,0,0|1,0,2]=4 1413 B7R1.14 C[C@@]1(CCNC1)O MCULE-4472850857 [0,1,0,0,0,0|1,0,2]=4 1414 B7R1.14 C[C@@]1(CCNC1)O MCULE-7216590589 [0,1,0,0,0,0|1,0,2]=4 1415 B7R1.14 C[C@@]1(CCNC1)O MCULE-9031112405 [0,1,0,0,0,0|1,0,2]=4 1416 B7R1.14 C[C@]1(CCNC1)F MCULE-1291336282 [0,1,0,0,0,0|2,0,1]=4 1417 B7R1.14 C[C@]1(CCNC1)F MCULE-2571688853 [0,1,0,0,0,0|2,0,1]=4 1418 B7R1.14 C[C@]1(CCNC1)O MCULE-2513078981 [0,1,0,0,0,0|1,0,2]=4 1419 B7R1.14 C[C@]1(CCNC1)O MCULE-2837064957 [0,1,0,0,0,0|1,0,2]=4 1420 B7R1.14 C[C@]1(CCNC1)O MCULE-5133863014 [0,1,0,0,0,0|1,0,2]=4 1421 B7R1.14 C[C@]1(CCNC1)O MCULE-5887726834 [0,1,0,0,0,0|1,0,2]=4 1422 B7R1.14 C[N+]1(CCCC1)C MCULE-3715522497 [0,1,0,0,0,0|2,0,0]=3 1423 B7R1.14 C[N+]1(CCCC1)C MCULE-9941565311 [0,1,0,0,0,0|2,0,0]=3 1424 B7R1.14 C[Si]1(CCCC1)C MCULE-1541355807 [0,1,0,0,0,0|1,1,0]=3 1425 B7R1.14 Cl[Si]1(CCCC1)Cl MCULE-3311328568 [0,1,0,0,0,0|1,1,0]=3 1426 B7R1.14 FC1(CCNC1)F MCULE-9262317649 [0,1,0,0,0,0|2,0,1]=4 1427 B7R1.14 FC1(CC[NH2+]C1)F MCULE-5155002822 [0,1,0,0,0,0|2,0,1]=4 1428 B7R1.14 N=S1(=O)CCCC1 MCULE-6922708158 [0,1,0,0,0,0|1,0,0]=2 1429 B7R1.14 O=P1(C=CCC1)Cl MCULE-4153870806 [0,1,0,0,0,0|1,0,2]=4 1430 B7R1.14 O=P1(CC=CC1)Cl MCULE-8307035489 [0,1,0,0,0,0|1,0,2]=4 1431 B7R1.14 O=P1(CCCC1)Cl MCULE-9877294162 [0,1,0,0,0,0|1,0,0]=2 1432 B7R1.14 O=P1(OCCO1)Cl MCULE-8220157277 [0,1,0,0,0,0|3,0,0]=4 1433 B7R1.14 O=S1(=O)C=CCC1 MCULE-7689521769 [0,1,0,0,0,0|1,0,2]=4 1434 B7R1.14 O=S1(=O)CC=CC1 MCULE-5003570891 [0,1,0,0,0,0|1,0,2]=4 1435 B7R1.14 O=S1(=O)CCC=N1 MCULE-3928927688 [0,1,0,0,0,0|2,0,1]=4 1436 B7R1.14 O=S1(=O)CCCC1 MCULE-3506686856 [0,1,0,0,0,0|1,0,0]=2 1437 B7R1.14 O=S1(=O)CCCN1 MCULE-8201546192 [0,1,0,0,0,0|2,0,0]=3 1438 B7R1.14 O=S1(=O)CCCO1 MCULE-4897687828 [0,1,0,0,0,0|2,0,0]=3 1439 B7R1.14 O=S1(=O)NCCN1 MCULE-4603146826 [0,1,0,0,0,0|3,0,0]=4 1440 B7R1.14 O=S1(=O)NCCO1 MCULE-2978152198 [0,1,0,0,0,0|3,0,0]=4 1441 B7R1.14 O=S1(=O)OCCO1 MCULE-4563579294 [0,1,0,0,0,0|3,0,0]=4 1442 B5R0.1 C#CCC(=O)O MCULE-4680699666 [0,0,1,0,0,0|1,0,2]=4 1443 B5R0.1 C(C)(N)CCC MCULE-4800297905 [0,0,1,0,0,0|1,0,1]=3 1444 B5R0.1 C(C)(N)CCC MCULE-7674864567 [0,0,1,0,0,0|1,0,1]=3 1445 B5R0.1 C(C)(N)CCO MCULE-5545469271 [0,0,1,0,0,0|2,0,1]=4 1446 B5R0.1 C/C(=C/CI)/I MCULE-4907089043 [0,0,1,0,0,0|2,0,1]=4 1447 B5R0.1 C/C(=C/CN)/Cl MCULE-1091573118 [0,0,1,0,0,0|2,0,1]=4 1448 B5R0.1 C/C(=C/CN)/Cl MCULE-8112023611 [0,0,1,0,0,0|2,0,1]=4 1449 B5R0.1 C/C(=C\CCl)/Cl MCULE-6679259233 [0,0,1,0,0,0|2,0,1]=4 1450 B5R0.1 C/C=C/C(=O)C MCULE-2109656516 [0,0,1,0,0,0|0,0,2]=3 1451 B5R0.1 C/C=C/C(=O)Cl MCULE-8378824386 [0,0,1,0,0,0|1,0,2]=4 1452 B5R0.1 C/C=C/C(=O)N MCULE-2532228624 [0,0,1,0,0,0|1,0,2]=4 1453 B5R0.1 C/C=C/C(=O)O MCULE-6937494852 [0,0,1,0,0,0|1,0,2]=4 1454 B5R0.1 C=C(Br)CCBr MCULE-7638627279 [0,0,1,0,0,0|2,0,1]=4 1455 B5R0.1 C=C(Br)CCO MCULE-3743908958 [0,0,1,0,0,0|2,0,1]=4 1456 B5R0.1 C=C(Br)COC MCULE-5349428431 [0,0,1,0,0,0|2,0,1]=4 1457 B5R0.1 C=C(C)CCBr MCULE-3439794005 [0,0,1,0,0,0|2,0,0]=3 1458 B5R0.1 C=C(C)CCC MCULE-8225129744 [0,0,1,0,0,0|1,0,0]=2 1459 B5R0.1 C=C(C)CCCl MCULE-2816016781 [0,0,1,0,0,0|2,0,0]=3 1460 B5R0.1 C=C(C)CCI MCULE-6317205481 [0,0,1,0,0,0|2,0,0]=3 1461 B5R0.1 C=C(C)CCN MCULE-4037025602 [0,0,1,0,0,0|2,0,0]=3 1462 B5R0.1 C=C(C)CCN MCULE-5001503744 [0,0,1,0,0,0|2,0,0]=3 1463 B5R0.1 C=C(C)CCO MCULE-2689800711 [0,0,1,0,0,0|2,0,0]=3 1464 B5R0.1 C=C(C)CNC MCULE-6783886553 [0,0,1,0,0,0|2,0,0]=3 1465 B5R0.1 C=C(C)CNC MCULE-8292313282 [0,0,1,0,0,0|2,0,0]=3 1466 B5R0.1 C=C(C)CNN MCULE-1117931770 [0,0,1,0,0,0|3,0,0]=4 1467 B5R0.1 C=C(C)CON MCULE-2773974323 [0,0,1,0,0,0|3,0,0]=4 1468 B5R0.1 C=C(C)CON MCULE-5978680243 [0,0,1,0,0,0|3,0,0]=4 1469 B5R0.1 C=C(C)OCC MCULE-5303468686 [0,0,1,0,0,0|2,0,0]=3 1470 B5R0.1 C=CCC(=C)C MCULE-6294070836 [0,0,1,0,0,0|1,0,2]=4 1471 B5R0.1 C=CCC(=O)Cl MCULE-6033189203 [0,0,1,0,0,0|1,0,2]=4 1472 B5R0.1 C=CCC(=O)N MCULE-1205335257 [0,0,1,0,0,0|1,0,2]=4 1473 B5R0.1 C=CCC(=O)O MCULE-6288979337 [0,0,1,0,0,0|1,0,2]=4 1474 B5R0.1 C=CNC(=O)C MCULE-1260296806 [0,0,1,0,0,0|1,0,2]=4 1475 B5R0.1 C=COC(=O)C MCULE-7626795765 [0,0,1,0,0,0|1,0,2]=4 1476 B5R0.1 C=NCC(=O)N MCULE-7609497329 [0,0,1,0,0,0|2,0,1]=4 1477 B5R0.1 CC#CC(=O)C MCULE-4083248904 [0,0,1,0,0,0|0,0,2]=3 1478 B5R0.1 CC#CC(=O)Cl MCULE-6807810093 [0,0,1,0,0,0|1,0,2]=4 1479 B5R0.1 CC#CC(=O)O MCULE-9994142213 [0,0,1,0,0,0|1,0,2]=4 1480 B5R0.1 CC(=CCBr)C MCULE-7961276795 [0,0,1,0,0,0|2,0,1]=4 1481 B5R0.1 CC(=CCCl)C MCULE-1110417103 [0,0,1,0,0,0|2,0,1]=4 1482 B5R0.1 CC(=CCCl)Cl MCULE-9735045489 [0,0,1,0,0,0|2,0,1]=4 1483 B5R0.1 CC(=CCI)I MCULE-4204968539 [0,0,1,0,0,0|2,0,1]=4 1484 B5R0.1 CC(=CCN)C MCULE-7220252581 [0,0,1,0,0,0|2,0,1]=4 1485 B5R0.1 CC(=CCN)C MCULE-8394581250 [0,0,1,0,0,0|2,0,1]=4 1486 B5R0.1 CC(=CCN)Cl MCULE-1749173363 [0,0,1,0,0,0|2,0,1]=4 1487 B5R0.1 CC(=CCN)Cl MCULE-5722512850 [0,0,1,0,0,0|2,0,1]=4 1488 B5R0.1 CC(=CCO)C MCULE-3984123588 [0,0,1,0,0,0|2,0,1]=4 1489 B5R0.1 CC(=CCO)Cl MCULE-6459066496 [0,0,1,0,0,0|2,0,1]=4 1490 B5R0.1 CC(=CCO)I MCULE-4600854759 [0,0,1,0,0,0|2,0,1]=4 1491 B5R0.1 CC(=CCS)C MCULE-4180446913 [0,0,1,0,0,0|2,0,1]=4 1492 B5R0.1 CC(=O)/C=N/O MCULE-5424156575 [0,0,1,0,0,0|2,0,1]=4 1493 B5R0.1 CC(=O)/C=N\O MCULE-9083768531 [0,0,1,0,0,0|2,0,1]=4 1494 B5R0.1 CC(=O)C=C=O MCULE-4335598177 [0,0,1,0,0,0|1,0,2]=4 1495 B5R0.1 CC(=O)C=NO MCULE-5513006918 [0,0,1,0,0,0|2,0,1]=4 1496 B5R0.1 CC(=O)CC#N MCULE-7203242552 [0,0,1,0,0,0|1,0,1]=3 1497 B5R0.1 CC(=O)CCBr MCULE-2615300206 [0,0,1,0,0,0|1,0,0]=2 1498 B5R0.1 CC(=O)CCCl MCULE-8019748964 [0,0,1,0,0,0|1,0,0]=2 1499 B5R0.1 CC(=O)CCN MCULE-7550348751 [0,0,1,0,0,0|1,0,0]=2 1500 B5R0.1 CC(=O)CCN MCULE-9519063810 [0,0,1,0,0,0|1,0,0]=2 1501 B5R0.1 CC(=O)CCO MCULE-6328537335 [0,0,1,0,0,0|1,0,0]=2 1502 B5R0.1 CC(=O)N=C=S MCULE-7540453687 [0,0,1,0,0,0|2,0,1]=4 1503 B5R0.1 CC(=O)N=S=O MCULE-1420371815 [0,0,1,0,0,0|3,0,0]=4 1504 B5R0.1 CC(=O)NC#N MCULE-8444599659 [0,0,1,0,0,0|2,0,1]=4 1505 B5R0.1 CC(=O)NCO MCULE-4563335540 [0,0,1,0,0,0|2,0,0]=3 1506 B5R0.1 CC(=O)OCBr MCULE-9842804945 [0,0,1,0,0,0|2,0,0]=3 1507 B5R0.1 CC(=O)OCCl MCULE-6822222026 [0,0,1,0,0,0|2,0,0]=3 1508 B5R0.1 CC(=O)SCBr MCULE-9794607323 [0,0,1,0,0,0|2,0,0]=3 1509 B5R0.1 CC(Br)CCBr MCULE-1045475402 [0,0,1,0,0,0|2,0,1]=4 1510 B5R0.1 CC(C)CCBr MCULE-7163010428 [0,0,1,0,0,0|2,0,1]=4 1511 B5R0.1 CC(C)CCCl MCULE-8360122696 [0,0,1,0,0,0|2,0,1]=4 1512 B5R0.1 CC(C)CCCl MCULE-9017922949 [0,0,1,0,0,0|2,0,1]=4 1513 B5R0.1 CC(C)CCI MCULE-4934529500 [0,0,1,0,0,0|2,0,1]=4 1514 B5R0.1 CC(C)CCN MCULE-3081003576 [0,0,1,0,0,0|2,0,1]=4 1515 B5R0.1 CC(C)CCN MCULE-5118782389 [0,0,1,0,0,0|2,0,1]=4 1516 B5R0.1 CC(C)CCN MCULE-5217981670 [0,0,1,0,0,0|2,0,1]=4 1517 B5R0.1 CC(C)CCN MCULE-6280940933 [0,0,1,0,0,0|2,0,1]=4 1518 B5R0.1 CC(C)CCO MCULE-7411270401 [0,0,1,0,0,0|2,0,1]=4 1519 B5R0.1 CC(C)CCS MCULE-7115473363 [0,0,1,0,0,0|2,0,1]=4 1520 B5R0.1 CC(Cl)CCCl MCULE-3656498608 [0,0,1,0,0,0|2,0,1]=4 1521 B5R0.1 CC(Cl)CCO MCULE-1955496242 [0,0,1,0,0,0|2,0,1]=4 1522 B5R0.1 CC(F)CCBr MCULE-3035340901 [0,0,1,0,0,0|2,0,1]=4 1523 B5R0.1 CC(F)CCI MCULE-6469250150 [0,0,1,0,0,0|2,0,1]=4 1524 B5R0.1 CC(F)CCN MCULE-2805813131 [0,0,1,0,0,0|2,0,1]=4 1525 B5R0.1 CC(F)CCN MCULE-5849913362 [0,0,1,0,0,0|2,0,1]=4 1526 B5R0.1 CC(N)CCN MCULE-5308134596 [0,0,1,0,0,0|2,0,1]=4 1527 B5R0.1 CC(N)CCN MCULE-5880045507 [0,0,1,0,0,0|2,0,1]=4 1528 B5R0.1 CC(N)CCN MCULE-7827515430 [0,0,1,0,0,0|2,0,1]=4 1529 B5R0.1 CC(N)CCO MCULE-1771399942 [0,0,1,0,0,0|2,0,1]=4 1530 B5R0.1 CC(N)CCO MCULE-7239872808 [0,0,1,0,0,0|2,0,1]=4 1531 B5R0.1 CC(O)CCBr MCULE-7983169885 [0,0,1,0,0,0|1,0,2]=4 1532 B5R0.1 CC(O)CCCl MCULE-2952545606 [0,0,1,0,0,0|1,0,2]=4 1533 B5R0.1 CC(O)CCN MCULE-6836791276 [0,0,1,0,0,0|1,0,2]=4 1534 B5R0.1 CC(O)CCN MCULE-7186260925 [0,0,1,0,0,0|1,0,2]=4 1535 B5R0.1 CC(O)CCO MCULE-1694239851 [0,0,1,0,0,0|1,0,2]=4 1536 B5R0.1 CC(O)CCO MCULE-7784884948 [0,0,1,0,0,0|1,0,2]=4 1537 B5R0.1 CC(S)CCO MCULE-5702212503 [0,0,1,0,0,0|1,1,1]=4 1538 B5R0.1 CC=CC(=O)C MCULE-4826977340 [0,0,1,0,0,0|0,0,2]=3 1539 B5R0.1 CC=CC(=O)Cl MCULE-2747622237 [0,0,1,0,0,0|1,0,2]=4 1540 B5R0.1 CC=CC(=O)N MCULE-9693879476 [0,0,1,0,0,0|1,0,2]=4 1541 B5R0.1 CC=CC(=O)O MCULE-7970410217 [0,0,1,0,0,0|1,0,2]=4 1542 B5R0.1 CCC=C(C)C MCULE-2405063894 [0,0,1,0,0,0|1,0,1]=3 1543 B5R0.1 CCC=C(F)F MCULE-5180612061 [0,0,1,0,0,0|2,0,1]=4 1544 B5R0.1 CCCB(O)O MCULE-4994980798 [0,0,1,0,0,0|2,0,1]=4 1545 B5R0.1 CCCC(=N)N MCULE-5974105638 [0,0,1,0,0,0|2,0,0]=3 1546 B5R0.1 CCCC(=N)N MCULE-9230704591 [0,0,1,0,0,0|2,0,0]=3 1547 B5R0.1 CCCC(=O)C MCULE-7174095676 [0,0,1,0,0,0|0,0,0]=1 1548 B5R0.1 CCCC(=O)Cl MCULE-3288175193 [0,0,1,0,0,0|1,0,0]=2 1549 B5R0.1 CCCC(=O)N MCULE-2712067671 [0,0,1,0,0,0|1,0,0]=2 1550 B5R0.1 CCCC(=O)O MCULE-4116382006 [0,0,1,0,0,0|1,0,0]=2 1551 B5R0.1 CCCC(=O)[O-] MCULE-8706538802 [0,0,1,0,0,0|1,0,0]=2 1552 B5R0.1 CCCC(=O)[O-] MCULE-9764702574 [0,0,1,0,0,0|1,0,0]=2 1553 B5R0.1 CCCC(=S)N MCULE-3529335988 [0,0,1,0,0,0|1,1,0]=3 1554 B5R0.1 CCCC(=S)O MCULE-3382199964 [0,0,1,0,0,0|1,0,1]=3 1555 B5R0.1 CCCC(C)Br MCULE-3178073667 [0,0,1,0,0,0|1,0,1]=3 1556 B5R0.1 CCCC(C)C MCULE-9604552974 [0,0,1,0,0,0|1,0,1]=3 1557 B5R0.1 CCCC(C)N MCULE-2640298430 [0,0,1,0,0,0|1,0,1]=3 1558 B5R0.1 CCCC(C)N MCULE-7225905167 [0,0,1,0,0,0|1,0,1]=3 1559 B5R0.1 CCCC(C)O MCULE-8205906299 [0,0,1,0,0,0|0,0,2]=3 1560 B5R0.1 CCCC(C)S MCULE-1649095713 [0,0,1,0,0,0|0,1,1]=3 1561 B5R0.1 CCCC(O)Cl MCULE-3188577082 [0,0,1,0,0,0|1,0,2]=4 1562 B5R0.1 CCCN(=O)=O MCULE-5615753372 [0,0,1,0,0,0|2,0,0]=3 1563 B5R0.1 CCCN(C)C MCULE-8702643596 [0,0,1,0,0,0|2,0,0]=3 1564 B5R0.1 CCCS(=O)[O-] MCULE-4306915022 [0,0,1,0,0,0|2,0,0]=3 1565 B5R0.1 CCCS(=O)[O-] MCULE-9775151913 [0,0,1,0,0,0|2,0,0]=3 1566 B5R0.1 CCC[C@@H](C)N MCULE-2394536966 [0,0,1,0,0,0|1,0,1]=3 1567 B5R0.1 CCC[C@@H](C)N MCULE-3008898216 [0,0,1,0,0,0|1,0,1]=3 1568 B5R0.1 CCC[C@@H](C)N MCULE-5656861143 [0,0,1,0,0,0|1,0,1]=3 1569 B5R0.1 CCC[C@@H](C)N MCULE-8113159645 [0,0,1,0,0,0|1,0,1]=3 1570 B5R0.1 CCC[C@@H](C)O MCULE-1540573875 [0,0,1,0,0,0|0,0,2]=3 1571 B5R0.1 CCC[C@H](C)N MCULE-2068574015 [0,0,1,0,0,0|1,0,1]=3 1572 B5R0.1 CCC[C@H](C)N MCULE-3439133019 [0,0,1,0,0,0|1,0,1]=3 1573 B5R0.1 CCC[C@H](C)N MCULE-5495177657 [0,0,1,0,0,0|1,0,1]=3 1574 B5R0.1 CCC[C@H](C)N MCULE-7962028651 [0,0,1,0,0,0|1,0,1]=3 1575 B5R0.1 CCC[C@H](C)O MCULE-6976816276 [0,0,1,0,0,0|0,0,2]=3 1576 B5R0.1 CCNC(=N)N MCULE-4729418155 [0,0,1,0,0,0|3,0,0]=4 1577 B5R0.1 CCNC(=N)N MCULE-5123343071 [0,0,1,0,0,0|3,0,0]=4 1578 B5R0.1 CCNC(=O)C MCULE-7543656350 [0,0,1,0,0,0|1,0,0]=2 1579 B5R0.1 CCNC(=O)Cl MCULE-5831262934 [0,0,1,0,0,0|2,0,0]=3 1580 B5R0.1 CCNC(=O)N MCULE-1913599861 [0,0,1,0,0,0|2,0,0]=3 1581 B5R0.1 CCNC(=S)N MCULE-3849517146 [0,0,1,0,0,0|2,1,0]=4 1582 B5R0.1 CCNC(C)C MCULE-8064118469 [0,0,1,0,0,0|2,0,1]=4 1583 B5R0.1 CCOC(=N)C MCULE-3060267072 [0,0,1,0,0,0|2,0,0]=3 1584 B5R0.1 CCOC(=N)C MCULE-3943786182 [0,0,1,0,0,0|2,0,0]=3 1585 B5R0.1 CCOC(=N)N MCULE-3570858508 [0,0,1,0,0,0|3,0,0]=4 1586 B5R0.1 CCOC(=N)N MCULE-6061063856 [0,0,1,0,0,0|3,0,0]=4 1587 B5R0.1 CCOC(=O)C MCULE-6628539781 [0,0,1,0,0,0|1,0,0]=2 1588 B5R0.1 CCOC(=O)Cl MCULE-4167904934 [0,0,1,0,0,0|2,0,0]=3 1589 B5R0.1 CCOC(=O)N MCULE-1776877276 [0,0,1,0,0,0|2,0,0]=3 1590 B5R0.1 CCOC(=S)C MCULE-3358897597 [0,0,1,0,0,0|1,1,0]=3 1591 B5R0.1 CCOC(=S)N MCULE-4649285010 [0,0,1,0,0,0|2,1,0]=4 1592 B5R0.1 CCOC(=S)[S-] MCULE-6247969567 [0,0,1,0,0,0|2,1,0]=4 1593 B5R0.1 CCOC(=S)[S-] MCULE-6902289618 [0,0,1,0,0,0|2,1,0]=4 1594 B5R0.1 CCOC(=S)[S-] MCULE-9105300958 [0,0,1,0,0,0|2,1,0]=4 1595 B5R0.1 CCOC(C)C MCULE-1934548340 [0,0,1,0,0,0|2,0,1]=4 1596 B5R0.1 CCOC(C)Cl MCULE-8486994638 [0,0,1,0,0,0|2,0,1]=4 1597 B5R0.1 CCSC(=N)N MCULE-2161729152 [0,0,1,0,0,0|3,0,0]=4 1598 B5R0.1 CCSC(=N)N MCULE-2547252984 [0,0,1,0,0,0|3,0,0]=4 1599 B5R0.1 CCSC(=O)C MCULE-8015440229 [0,0,1,0,0,0|1,0,0]=2 1600 B5R0.1 CCSC(=S)C MCULE-1502137460 [0,0,1,0,0,0|1,1,0]=3 1601 B5R0.1 CCSC(=S)[S-] MCULE-2573650807 [0,0,1,0,0,0|2,1,0]=4 1602 B5R0.1 CCSC(=S)[S-] MCULE-6172057982 [0,0,1,0,0,0|2,1,0]=4 1603 B5R0.1 CCSC(C)C MCULE-3738251898 [0,0,1,0,0,0|2,0,1]=4 1604 B5R0.1 CC[NH2+]C(=N)N MCULE-1701852752 [0,0,1,0,0,0|3,0,0]=4 1605 B5R0.1 CC[O+]=C(N)N MCULE-2484225131 [0,0,1,0,0,0|3,0,0]=4 1606 B5R0.1 CC[O+]=C(N)N MCULE-6688774534 [0,0,1,0,0,0|3,0,0]=4 1607 B5R0.1 CN(C)CCBr MCULE-4844398053 [0,0,1,0,0,0|3,0,0]=4 1608 B5R0.1 CN(C)CCCl MCULE-4297554717 [0,0,1,0,0,0|3,0,0]=4 1609 B5R0.1 CN(C)CCCl MCULE-4465544992 [0,0,1,0,0,0|3,0,0]=4 1610 B5R0.1 CN(C)CCI MCULE-4687894526 [0,0,1,0,0,0|3,0,0]=4 1611 B5R0.1 CN(C)CCI MCULE-7464680246 [0,0,1,0,0,0|3,0,0]=4 1612 B5R0.1 CN(C)CCI MCULE-9051868668 [0,0,1,0,0,0|3,0,0]=4 1613 B5R0.1 CN(C)CCN MCULE-6693759372 [0,0,1,0,0,0|3,0,0]=4 1614 B5R0.1 CN(C)CCN MCULE-6929925748 [0,0,1,0,0,0|3,0,0]=4 1615 B5R0.1 CN(C)CCN MCULE-7881547574 [0,0,1,0,0,0|3,0,0]=4 1616 B5R0.1 CN(C)CCO MCULE-5715813465 [0,0,1,0,0,0|3,0,0]=4 1617 B5R0.1 CN(C)CCO MCULE-7567469160 [0,0,1,0,0,0|3,0,0]=4 1618 B5R0.1 CN(C)CCO MCULE-9024108074 [0,0,1,0,0,0|3,0,0]=4 1619 B5R0.1 CN(C)CCS MCULE-4356815596 [0,0,1,0,0,0|3,0,0]=4 1620 B5R0.1 CN(C)CCS MCULE-4611688723 [0,0,1,0,0,0|3,0,0]=4 1621 B5R0.1 CN(C)CCS MCULE-6259585517 [0,0,1,0,0,0|3,0,0]=4 1622 B5R0.1 CN(N)CCN MCULE-2782966878 [0,0,1,0,0,0|3,0,0]=4 1623 B5R0.1 CNCC(=O)C MCULE-3695443024 [0,0,1,0,0,0|1,0,0]=2 1624 B5R0.1 CNCC(=O)C MCULE-7402723072 [0,0,1,0,0,0|1,0,0]=2 1625 B5R0.1 CNCC(=O)N MCULE-2328887394 [0,0,1,0,0,0|2,0,0]=3 1626 B5R0.1 CNCC(=O)N MCULE-3031605853 [0,0,1,0,0,0|2,0,0]=3 1627 B5R0.1 CNCC(=O)N MCULE-7300977677 [0,0,1,0,0,0|2,0,0]=3 1628 B5R0.1 CNCC(=O)O MCULE-3448356048 [0,0,1,0,0,0|2,0,0]=3 1629 B5R0.1 CNCC(=O)O MCULE-4484444573 [0,0,1,0,0,0|2,0,0]=3 1630 B5R0.1 CNCC(=O)[O-] MCULE-7993701866 [0,0,1,0,0,0|2,0,0]=3 1631 B5R0.1 CNCC(C)C MCULE-6582386339 [0,0,1,0,0,0|2,0,1]=4 1632 B5R0.1 CNCC(C)C MCULE-6856717783 [0,0,1,0,0,0|2,0,1]=4 1633 B5R0.1 CNCC(C)F MCULE-4381138647 [0,0,1,0,0,0|2,0,1]=4 1634 B5R0.1 CNCC(C)F MCULE-9018181183 [0,0,1,0,0,0|2,0,1]=4 1635 B5R0.1 CNCC(C)O MCULE-3671071529 [0,0,1,0,0,0|1,0,2]=4 1636 B5R0.1 CNCC(C)O MCULE-4171705304 [0,0,1,0,0,0|1,0,2]=4 1637 B5R0.1 CNC[C@@H](C)O MCULE-2953164520 [0,0,1,0,0,0|1,0,2]=4 1638 B5R0.1 CNC[C@@H](C)O MCULE-3161721140 [0,0,1,0,0,0|1,0,2]=4 1639 B5R0.1 CNC[C@@H](C)O MCULE-6218150837 [0,0,1,0,0,0|1,0,2]=4 1640 B5R0.1 CNC[C@@H](C)O MCULE-8245274547 [0,0,1,0,0,0|1,0,2]=4 1641 B5R0.1 CNC[C@H](C)O MCULE-2655303492 [0,0,1,0,0,0|1,0,2]=4 1642 B5R0.1 CNC[C@H](C)O MCULE-7346940457 [0,0,1,0,0,0|1,0,2]=4 1643 B5R0.1 CNN=C(C)C MCULE-6307375856 [0,0,1,0,0,0|3,0,0]=4 1644 B5R0.1 CNOC(=O)C MCULE-1464426541 [0,0,1,0,0,0|2,0,0]=3 1645 B5R0.1 CNOC(=O)C MCULE-2976282666 [0,0,1,0,0,0|2,0,0]=3 1646 B5R0.1 COC=C(C)C MCULE-6348538911 [0,0,1,0,0,0|2,0,1]=4 1647 B5R0.1 COCC(=N)N MCULE-4711728356 [0,0,1,0,0,0|3,0,0]=4 1648 B5R0.1 COCC(=N)N MCULE-7163250467 [0,0,1,0,0,0|3,0,0]=4 1649 B5R0.1 COCC(=O)C MCULE-7262197587 [0,0,1,0,0,0|1,0,0]=2 1650 B5R0.1 COCC(=O)Cl MCULE-5449267495 [0,0,1,0,0,0|2,0,0]=3 1651 B5R0.1 COCC(=O)N MCULE-6674958132 [0,0,1,0,0,0|2,0,0]=3 1652 B5R0.1 COCC(=O)O MCULE-3945589151 [0,0,1,0,0,0|2,0,0]=3 1653 B5R0.1 COCC(=S)N MCULE-2046809269 [0,0,1,0,0,0|2,1,0]=4 1654 B5R0.1 COCC(C)Br MCULE-6850689931 [0,0,1,0,0,0|2,0,1]=4 1655 B5R0.1 COCC(C)I MCULE-8608265714 [0,0,1,0,0,0|2,0,1]=4 1656 B5R0.1 COCC(C)N MCULE-1896873634 [0,0,1,0,0,0|2,0,1]=4 1657 B5R0.1 COCC(C)N MCULE-2549420211 [0,0,1,0,0,0|2,0,1]=4 1658 B5R0.1 COCC(C)N MCULE-3490410444 [0,0,1,0,0,0|2,0,1]=4 1659 B5R0.1 COCC(C)N MCULE-7089888882 [0,0,1,0,0,0|2,0,1]=4 1660 B5R0.1 COCC(C)O MCULE-4022733014 [0,0,1,0,0,0|1,0,2]=4 1661 B5R0.1 COCC(C)O MCULE-7513310960 [0,0,1,0,0,0|1,0,2]=4 1662 B5R0.1 COCN(C)C MCULE-1963225930 [0,0,1,0,0,0|3,0,0]=4 1663 B5R0.1 COC[C@@H](C)N MCULE-1225912236 [0,0,1,0,0,0|2,0,1]=4 1664 B5R0.1 COC[C@@H](C)N MCULE-2754628271 [0,0,1,0,0,0|2,0,1]=4 1665 B5R0.1 COC[C@@H](C)N MCULE-4676764915 [0,0,1,0,0,0|2,0,1]=4 1666 B5R0.1 COC[C@@H](C)N MCULE-8891950737 [0,0,1,0,0,0|2,0,1]=4 1667 B5R0.1 COC[C@@H](C)O MCULE-6287552520 [0,0,1,0,0,0|1,0,2]=4 1668 B5R0.1 COC[C@@H](C)O MCULE-7942118801 [0,0,1,0,0,0|1,0,2]=4 1669 B5R0.1 COC[C@H](C)N MCULE-2465679418 [0,0,1,0,0,0|2,0,1]=4 1670 B5R0.1 COC[C@H](C)N MCULE-2998593539 [0,0,1,0,0,0|2,0,1]=4 1671 B5R0.1 COC[C@H](C)N MCULE-3161045661 [0,0,1,0,0,0|2,0,1]=4 1672 B5R0.1 COC[C@H](C)N MCULE-9550165578 [0,0,1,0,0,0|2,0,1]=4 1673 B5R0.1 COC[C@H](C)O MCULE-5908531683 [0,0,1,0,0,0|1,0,2]=4 1674 B5R0.1 COC[C@H](C)O MCULE-8619138238 [0,0,1,0,0,0|1,0,2]=4 1675 B5R0.1 CONC(=O)C MCULE-6601866630 [0,0,1,0,0,0|2,0,0]=3 1676 B5R0.1 CONC(=O)N MCULE-3063713861 [0,0,1,0,0,0|3,0,0]=4 1677 B5R0.1 CONC(=S)C MCULE-1876042939 [0,0,1,0,0,0|2,1,0]=4 1678 B5R0.1 CS(=O)CC#N MCULE-1246621507 [0,0,1,0,0,0|2,0,1]=4 1679 B5R0.1 CS(=O)CCBr MCULE-7846126230 [0,0,1,0,0,0|2,0,0]=3 1680 B5R0.1 CS(=O)CCCl MCULE-7012781505 [0,0,1,0,0,0|2,0,0]=3 1681 B5R0.1 CS(=O)CCN MCULE-6497874560 [0,0,1,0,0,0|2,0,0]=3 1682 B5R0.1 CS(=O)CCN MCULE-8275663766 [0,0,1,0,0,0|2,0,0]=3 1683 B5R0.1 CS(=O)CCN MCULE-8330490290 [0,0,1,0,0,0|2,0,0]=3 1684 B5R0.1 CS(=O)CCO MCULE-8331553582 [0,0,1,0,0,0|2,0,0]=3 1685 B5R0.1 CSCC(=N)N MCULE-7800929509 [0,0,1,0,0,0|3,0,0]=4 1686 B5R0.1 CSCC(=N)N MCULE-8499985777 [0,0,1,0,0,0|3,0,0]=4 1687 B5R0.1 CSCC(=O)C MCULE-4131794172 [0,0,1,0,0,0|1,0,0]=2 1688 B5R0.1 CSCC(=O)Cl MCULE-9750052685 [0,0,1,0,0,0|2,0,0]=3 1689 B5R0.1 CSCC(=O)N MCULE-4865579476 [0,0,1,0,0,0|2,0,0]=3 1690 B5R0.1 CSCC(=O)O MCULE-7003418159 [0,0,1,0,0,0|2,0,0]=3 1691 B5R0.1 CSCC(=S)N MCULE-5029100305 [0,0,1,0,0,0|2,1,0]=4 1692 B5R0.1 CSCC(C)N MCULE-7985946030 [0,0,1,0,0,0|2,0,1]=4 1693 B5R0.1 CSCC(C)O MCULE-2227652351 [0,0,1,0,0,0|1,0,2]=4 1694 B5R0.1 CSCN(C)C MCULE-2931143051 [0,0,1,0,0,0|3,0,0]=4 1695 B5R0.1 CSCS(=O)C MCULE-3167702486 [0,0,1,0,0,0|2,0,0]=3 1696 B5R0.1 CSNC(=O)C MCULE-7350061514 [0,0,1,0,0,0|2,0,0]=3 1697 B5R0.1 C[C@@H](N)CCO MCULE-4224878672 [0,0,1,0,0,0|2,0,1]=4 1698 B5R0.1 C[C@@H](N)CCO MCULE-5727539473 [0,0,1,0,0,0|2,0,1]=4 1699 B5R0.1 C[C@@H](O)CCN MCULE-7588849994 [0,0,1,0,0,0|1,0,2]=4 1700 B5R0.1 C[C@@H](O)CCN MCULE-7895006310 [0,0,1,0,0,0|1,0,2]=4 1701 B5R0.1 C[C@@H](O)CCN MCULE-9071323255 [0,0,1,0,0,0|1,0,2]=4 1702 B5R0.1 C[C@@H](O)CCN MCULE-9627550610 [0,0,1,0,0,0|1,0,2]=4 1703 B5R0.1 C[C@@H](O)CCO MCULE-6277947442 [0,0,1,0,0,0|1,0,2]=4 1704 B5R0.1 C[C@@H](O)CCO MCULE-9742368348 [0,0,1,0,0,0|1,0,2]=4 1705 B5R0.1 C[C@H](N)CCO MCULE-1496375567 [0,0,1,0,0,0|2,0,1]=4 1706 B5R0.1 C[C@H](N)CCO MCULE-4744824708 [0,0,1,0,0,0|2,0,1]=4 1707 B5R0.1 C[C@H](N)CCO MCULE-7219173683 [0,0,1,0,0,0|2,0,1]=4 1708 B5R0.1 C[C@H](N)CCO MCULE-9164942837 [0,0,1,0,0,0|2,0,1]=4 1709 B5R0.1 C[C@H](O)CCN MCULE-7570743309 [0,0,1,0,0,0|1,0,2]=4 1710 B5R0.1 C[C@H](O)CCN MCULE-9428853702 [0,0,1,0,0,0|1,0,2]=4 1711 B5R0.1 C[C@H](O)CCO MCULE-2504912618 [0,0,1,0,0,0|1,0,2]=4 1712 B5R0.1 C[C@H](O)CCO MCULE-2958119786 [0,0,1,0,0,0|1,0,2]=4 1713 B5R0.1 C[NH+](C)CCBr MCULE-4990293495 [0,0,1,0,0,0|3,0,0]=4 1714 B5R0.1 C[S+](C)CCCl MCULE-1305595131 [0,0,1,0,0,0|3,0,0]=4 1715 B5R0.1 C[S+](C)CCCl MCULE-9761617787 [0,0,1,0,0,0|3,0,0]=4 1716 B5R0.1 C[S@@](=O)CCO MCULE-4485824334 [0,0,1,0,0,0|2,0,0]=3 1717 B5R0.1 N#CCC(=O)Cl MCULE-7971055738 [0,0,1,0,0,0|2,0,1]=4 1718 B5R0.1 N#CCC(=O)N MCULE-8538286230 [0,0,1,0,0,0|2,0,1]=4 1719 B5R0.1 N#CCC(=O)O MCULE-3440765061 [0,0,1,0,0,0|2,0,1]=4 1720 B5R0.1 N#CCC(=O)[O-] MCULE-2598625909 [0,0,1,0,0,0|2,0,1]=4 1721 B5R0.1 N#CCC(=O)[O-] MCULE-3532110520 [0,0,1,0,0,0|2,0,1]=4 1722 B5R0.1 N=C(N)CCCl MCULE-2314996365 [0,0,1,0,0,0|3,0,0]=4 1723 B5R0.1 N=C(N)CCCl MCULE-3129838313 [0,0,1,0,0,0|3,0,0]=4 1724 B5R0.1 N=C(N)CCO MCULE-4567824707 [0,0,1,0,0,0|3,0,0]=4 1725 B5R0.1 N=C(N)CCO MCULE-7139693715 [0,0,1,0,0,0|3,0,0]=4 1726 B5R0.1 NC(=O)CCBr MCULE-3930714776 [0,0,1,0,0,0|2,0,0]=3 1727 B5R0.1 NC(=O)CCCl MCULE-8300320959 [0,0,1,0,0,0|2,0,0]=3 1728 B5R0.1 NC(=O)CCO MCULE-4026170350 [0,0,1,0,0,0|2,0,0]=3 1729 B5R0.1 NC(=O)CCS MCULE-7451827717 [0,0,1,0,0,0|2,0,0]=3 1730 B5R0.1 NC(=O)NCO MCULE-7403641101 [0,0,1,0,0,0|3,0,0]=4 1731 B5R0.1 NCCC(=O)Cl MCULE-1298355499 [0,0,1,0,0,0|2,0,0]=3 1732 B5R0.1 NCCC(=O)N MCULE-2899414135 [0,0,1,0,0,0|2,0,0]=3 1733 B5R0.1 NCCC(=O)N MCULE-6993286668 [0,0,1,0,0,0|2,0,0]=3 1734 B5R0.1 NCCC(=O)O MCULE-1344289084 [0,0,1,0,0,0|2,0,0]=3 1735 B5R0.1 NCCC(=O)O MCULE-2298605337 [0,0,1,0,0,0|2,0,0]=3 1736 B5R0.1 NCCC(=O)O MCULE-9375577631 [0,0,1,0,0,0|2,0,0]=3 1737 B5R0.1 NCCC(=O)[O-] MCULE-2492250086 [0,0,1,0,0,0|2,0,0]=3 1738 B5R0.1 NCCN(=O)=O MCULE-8137427440 [0,0,1,0,0,0|3,0,0]=4 1739 B5R0.1 NCCP(=O)O MCULE-7093964616 [0,0,1,0,0,0|3,0,0]=4 1740 B5R0.1 NCCS(=O)O MCULE-4372248641 [0,0,1,0,0,0|3,0,0]=4 1741 B5R0.1 NNCC(=O)N MCULE-2794619708 [0,0,1,0,0,0|3,0,0]=4 1742 B5R0.1 NNCC(=O)N MCULE-6773156087 [0,0,1,0,0,0|3,0,0]=4 1743 B5R0.1 NNCC(=O)O MCULE-4908184724 [0,0,1,0,0,0|3,0,0]=4 1744 B5R0.1 NNCC(=O)O MCULE-6315598774 [0,0,1,0,0,0|3,0,0]=4 1745 B5R0.1 NOCC(=O)O MCULE-4566186819 [0,0,1,0,0,0|3,0,0]=4 1746 B5R0.1 NOCC(=O)O MCULE-4824237418 [0,0,1,0,0,0|3,0,0]=4 1747 B5R0.1 NOCC(=O)O MCULE-8132180423 [0,0,1,0,0,0|3,0,0]=4 1748 B5R0.1 O=C(Cl)CCBr MCULE-4659506608 [0,0,1,0,0,0|2,0,0]=3 1749 B5R0.1 O=C(Cl)CCCl MCULE-3313924878 [0,0,1,0,0,0|2,0,0]=3 1750 B5R0.1 O=C(Cl)CCF MCULE-3316397790 [0,0,1,0,0,0|2,0,0]=3 1751 B5R0.1 O=C(Cl)OCCl MCULE-2130588147 [0,0,1,0,0,0|3,0,0]=4 1752 B5R0.1 O=C(O)CCBr MCULE-2816055853 [0,0,1,0,0,0|2,0,0]=3 1753 B5R0.1 O=C(O)CCCl MCULE-8511144183 [0,0,1,0,0,0|2,0,0]=3 1754 B5R0.1 O=C(O)CCF MCULE-4382025684 [0,0,1,0,0,0|2,0,0]=3 1755 B5R0.1 O=C(O)CCI MCULE-3371354708 [0,0,1,0,0,0|2,0,0]=3 1756 B5R0.1 O=C(O)CCO MCULE-3428604829 [0,0,1,0,0,0|2,0,0]=3 1757 B5R0.1 O=C(O)CCS MCULE-3211932163 [0,0,1,0,0,0|2,0,0]=3 1758 B5R0.1 O=C(O)CNO MCULE-4437067339 [0,0,1,0,0,0|3,0,0]=4 1759 B5R0.1 O=C([O-])CCO MCULE-4429611588 [0,0,1,0,0,0|2,0,0]=3 1760 B5R0.1 O=N(=O)CCO MCULE-2060841405 [0,0,1,0,0,0|3,0,0]=4 1761 B5R0.1 O=N(=O)CCS MCULE-4845430658 [0,0,1,0,0,0|3,0,0]=4 1762 B5R0.1 [C@@H](C)(O)CCC MCULE-9717120293 [0,0,1,0,0,0|0,0,2]=3 1763 B5R0.1 [C@@H](C)(O)CNC MCULE-2044067921 [0,0,1,0,0,0|1,0,2]=4 1764 B5R0.1 [C@H](C)(O)CCC MCULE-2689023898 [0,0,1,0,0,0|0,0,2]=3 1765 B5R0.2 BrCCCCBr MCULE-5088378536 [0,0,1,0,0,0|2,0,1]=4 1766 B5R0.2 C#CCCC=C MCULE-4858099861 [0,0,1,0,0,0|1,0,2]=4 1767 B5R0.2 C#CCCC=O MCULE-9994552907 [0,0,1,0,0,0|0,0,2]=3 1768 B5R0.2 C#CCCCBr MCULE-3834416844 [0,0,1,0,0,0|2,0,1]=4 1769 B5R0.2 C#CCCCC MCULE-5706969297 [0,0,1,0,0,0|1,0,1]=3 1770 B5R0.2 C#CCCCCl MCULE-3879115419 [0,0,1,0,0,0|2,0,1]=4 1771 B5R0.2 C#CCCCI MCULE-4063232871 [0,0,1,0,0,0|2,0,1]=4 1772 B5R0.2 C#CCCCN MCULE-3191305523 [0,0,1,0,0,0|2,0,1]=4 1773 B5R0.2 C#CCCCN MCULE-3259677872 [0,0,1,0,0,0|2,0,1]=4 1774 B5R0.2 C#CCCCO MCULE-6360852809 [0,0,1,0,0,0|2,0,1]=4 1775 B5R0.2 C#CCCNC MCULE-1590490287 [0,0,1,0,0,0|2,0,1]=4 1776 B5R0.2 C#CCCNC MCULE-4004733974 [0,0,1,0,0,0|2,0,1]=4 1777 B5R0.2 C#CCCNC MCULE-7566671614 [0,0,1,0,0,0|2,0,1]=4 1778 B5R0.2 C#CCCOC MCULE-7152168835 [0,0,1,0,0,0|2,0,1]=4 1779 B5R0.2 C#CCNCC MCULE-1258696824 [0,0,1,0,0,0|2,0,1]=4 1780 B5R0.2 C#CCNCC MCULE-3363103527 [0,0,1,0,0,0|2,0,1]=4 1781 B5R0.2 C#CCOCC MCULE-1055202735 [0,0,1,0,0,0|2,0,1]=4 1782 B5R0.2 C#CCSCC MCULE-5718021970 [0,0,1,0,0,0|2,0,1]=4 1783 B5R0.2 C/C=C/CCC MCULE-9851656818 [0,0,1,0,0,0|1,0,1]=3 1784 B5R0.2 C/C=C/CCO MCULE-3952855392 [0,0,1,0,0,0|2,0,1]=4 1785 B5R0.2 C/C=C/OCC MCULE-2891896400 [0,0,1,0,0,0|2,0,1]=4 1786 B5R0.2 C/C=C\CCC MCULE-1013657748 [0,0,1,0,0,0|1,0,1]=3 1787 B5R0.2 C=C/C=C/CC MCULE-5996202716 [0,0,1,0,0,0|1,0,2]=4 1788 B5R0.2 C=CC/C=C/C MCULE-8732875285 [0,0,1,0,0,0|1,0,2]=4 1789 B5R0.2 C=CCC=CC MCULE-8643449832 [0,0,1,0,0,0|1,0,2]=4 1790 B5R0.2 C=CCCC#N MCULE-8967750268 [0,0,1,0,0,0|2,0,1]=4 1791 B5R0.2 C=CCCC=C MCULE-2599309974 [0,0,1,0,0,0|1,0,2]=4 1792 B5R0.2 C=CCCC=O MCULE-7850336174 [0,0,1,0,0,0|0,0,2]=3 1793 B5R0.2 C=CCCCBr MCULE-5027518679 [0,0,1,0,0,0|2,0,0]=3 1794 B5R0.2 C=CCCCC MCULE-4750698031 [0,0,1,0,0,0|1,0,0]=2 1795 B5R0.2 C=CCCCCl MCULE-3877430809 [0,0,1,0,0,0|2,0,0]=3 1796 B5R0.2 C=CCCCI MCULE-8692831514 [0,0,1,0,0,0|2,0,0]=3 1797 B5R0.2 C=CCCCN MCULE-5787926547 [0,0,1,0,0,0|2,0,0]=3 1798 B5R0.2 C=CCCCN MCULE-7346989227 [0,0,1,0,0,0|2,0,0]=3 1799 B5R0.2 C=CCCCO MCULE-5946342321 [0,0,1,0,0,0|2,0,0]=3 1800 B5R0.2 C=CCCNC MCULE-2124263362 [0,0,1,0,0,0|2,0,0]=3 1801 B5R0.2 C=CCCNC MCULE-5024925990 [0,0,1,0,0,0|2,0,0]=3 1802 B5R0.2 C=CCCOC MCULE-4681354270 [0,0,1,0,0,0|2,0,0]=3 1803 B5R0.2 C=CCCON MCULE-3476228435 [0,0,1,0,0,0|3,0,0]=4 1804 B5R0.2 C=CCCON MCULE-9206052895 [0,0,1,0,0,0|3,0,0]=4 1805 B5R0.2 C=CCNC=O MCULE-1911798514 [0,0,1,0,0,0|1,0,2]=4 1806 B5R0.2 C=CCNCC MCULE-6987567673 [0,0,1,0,0,0|2,0,0]=3 1807 B5R0.2 C=CCNCC MCULE-8318544337 [0,0,1,0,0,0|2,0,0]=3 1808 B5R0.2 C=CCOC=O MCULE-4161785970 [0,0,1,0,0,0|1,0,2]=4 1809 B5R0.2 C=CCOCC MCULE-4363356618 [0,0,1,0,0,0|2,0,0]=3 1810 B5R0.2 C=CCOCCl MCULE-6656252526 [0,0,1,0,0,0|3,0,0]=4 1811 B5R0.2 C=CCONC MCULE-4537899476 [0,0,1,0,0,0|3,0,0]=4 1812 B5R0.2 C=CCONC MCULE-9645204142 [0,0,1,0,0,0|3,0,0]=4 1813 B5R0.2 C=CCSCC MCULE-3816911529 [0,0,1,0,0,0|2,0,0]=3 1814 B5R0.2 C=CCSSC MCULE-8417830164 [0,0,1,0,0,0|3,0,0]=4 1815 B5R0.2 C=COCCC MCULE-4423853666 [0,0,1,0,0,0|2,0,0]=3 1816 B5R0.2 C=COCCCl MCULE-7782311030 [0,0,1,0,0,0|3,0,0]=4 1817 B5R0.2 C=COCCN MCULE-8052872924 [0,0,1,0,0,0|3,0,0]=4 1818 B5R0.2 C=COCCN MCULE-8496820259 [0,0,1,0,0,0|3,0,0]=4 1819 B5R0.2 C=COCCO MCULE-9383372818 [0,0,1,0,0,0|3,0,0]=4 1820 B5R0.2 CC#CCC=O MCULE-6071390808 [0,0,1,0,0,0|0,0,2]=3 1821 B5R0.2 CC#CCCC MCULE-8179328151 [0,0,1,0,0,0|1,0,2]=4 1822 B5R0.2 CC/C=C/C=O MCULE-5102906061 [0,0,1,0,0,0|0,0,2]=3 1823 B5R0.2 CC=CCCBr MCULE-7329159278 [0,0,1,0,0,0|2,0,1]=4 1824 B5R0.2 CC=CCCC MCULE-8736231124 [0,0,1,0,0,0|1,0,1]=3 1825 B5R0.2 CC=CCCN MCULE-5129102475 [0,0,1,0,0,0|2,0,1]=4 1826 B5R0.2 CC=CCCN MCULE-8500001929 [0,0,1,0,0,0|2,0,1]=4 1827 B5R0.2 CC=CCCO MCULE-4302367089 [0,0,1,0,0,0|2,0,1]=4 1828 B5R0.2 CC=COCC MCULE-1473170404 [0,0,1,0,0,0|2,0,1]=4 1829 B5R0.2 CCC#CC=O MCULE-3889262436 [0,0,1,0,0,0|0,0,2]=3 1830 B5R0.2 CCC=CC=O MCULE-1318250395 [0,0,1,0,0,0|0,0,2]=3 1831 B5R0.2 CCCC#CI MCULE-5016901652 [0,0,1,0,0,0|1,0,2]=4 1832 B5R0.2 CCCC=NO MCULE-7364375780 [0,0,1,0,0,0|1,0,2]=4 1833 B5R0.2 CCCCC#N MCULE-4015236167 [0,0,1,0,0,0|1,0,1]=3 1834 B5R0.2 CCCCC=O MCULE-4736782822 [0,0,1,0,0,0|0,0,0]=1 1835 B5R0.2 CCCCCBr MCULE-8513521912 [0,0,1,0,0,0|1,0,1]=3 1836 B5R0.2 CCCCCC MCULE-3465692202 [0,0,1,0,0,0|1,0,1]=3 1837 B5R0.2 CCCCCCl MCULE-4412759460 [0,0,1,0,0,0|1,0,1]=3 1838 B5R0.2 CCCCCF MCULE-6399883281 [0,0,1,0,0,0|1,0,1]=3 1839 B5R0.2 CCCCCI MCULE-4590300793 [0,0,1,0,0,0|1,0,1]=3 1840 B5R0.2 CCCCCN MCULE-3371742982 [0,0,1,0,0,0|1,0,1]=3 1841 B5R0.2 CCCCCN MCULE-4371067300 [0,0,1,0,0,0|1,0,1]=3 1842 B5R0.2 CCCCCN MCULE-6547961798 [0,0,1,0,0,0|1,0,1]=3 1843 B5R0.2 CCCCCN MCULE-7483248760 [0,0,1,0,0,0|1,0,1]=3 1844 B5R0.2 CCCCCO MCULE-8714292632 [0,0,1,0,0,0|0,0,2]=3 1845 B5R0.2 CCCCCS MCULE-5476379340 [0,0,1,0,0,0|0,1,1]=3 1846 B5R0.2 CCCCNC MCULE-9321610906 [0,0,1,0,0,0|2,0,0]=3 1847 B5R0.2 CCCCNN MCULE-6681305566 [0,0,1,0,0,0|2,0,0]=3 1848 B5R0.2 CCCCNN MCULE-6890760890 [0,0,1,0,0,0|2,0,0]=3 1849 B5R0.2 CCCCNN MCULE-7362497327 [0,0,1,0,0,0|2,0,0]=3 1850 B5R0.2 CCCCNN MCULE-8463623644 [0,0,1,0,0,0|2,0,0]=3 1851 B5R0.2 CCCCNO MCULE-1911206569 [0,0,1,0,0,0|1,0,1]=3 1852 B5R0.2 CCCCNO MCULE-3820646216 [0,0,1,0,0,0|1,0,1]=3 1853 B5R0.2 CCCCOC MCULE-9814272675 [0,0,1,0,0,0|2,0,0]=3 1854 B5R0.2 CCCCON MCULE-7582349983 [0,0,1,0,0,0|2,0,0]=3 1855 B5R0.2 CCCCON MCULE-8175627798 [0,0,1,0,0,0|2,0,0]=3 1856 B5R0.2 CCCCSC MCULE-2799775567 [0,0,1,0,0,0|2,0,0]=3 1857 B5R0.2 CCCN=C=O MCULE-9014468293 [0,0,1,0,0,0|1,0,1]=3 1858 B5R0.2 CCCN=C=S MCULE-7947940355 [0,0,1,0,0,0|1,1,1]=4 1859 B5R0.2 CCCNC=O MCULE-6344556391 [0,0,1,0,0,0|1,0,0]=2 1860 B5R0.2 CCCNCC MCULE-7948828264 [0,0,1,0,0,0|2,0,1]=4 1861 B5R0.2 CCCNCC MCULE-9107549207 [0,0,1,0,0,0|2,0,1]=4 1862 B5R0.2 CCCOC=O MCULE-3133604529 [0,0,1,0,0,0|1,0,0]=2 1863 B5R0.2 CCCOCBr MCULE-3585683043 [0,0,1,0,0,0|2,0,1]=4 1864 B5R0.2 CCCOCC MCULE-9971916790 [0,0,1,0,0,0|2,0,1]=4 1865 B5R0.2 CCCOCCl MCULE-1932627202 [0,0,1,0,0,0|2,0,1]=4 1866 B5R0.2 CCCSC#N MCULE-9018157774 [0,0,1,0,0,0|2,0,1]=4 1867 B5R0.2 CCCSCC MCULE-4547385568 [0,0,1,0,0,0|2,0,1]=4 1868 B5R0.2 CCCSSC MCULE-3127072032 [0,0,1,0,0,0|3,0,0]=4 1869 B5R0.2 CCNCC#N MCULE-8279629720 [0,0,1,0,0,0|2,0,1]=4 1870 B5R0.2 CCNCCCl MCULE-2589770119 [0,0,1,0,0,0|2,0,1]=4 1871 B5R0.2 CCNCCCl MCULE-3098032672 [0,0,1,0,0,0|2,0,1]=4 1872 B5R0.2 CCNCCN MCULE-7854769899 [0,0,1,0,0,0|2,0,1]=4 1873 B5R0.2 CCNCCO MCULE-2537734730 [0,0,1,0,0,0|1,0,2]=4 1874 B5R0.2 CCNCCO MCULE-3738714907 [0,0,1,0,0,0|1,0,2]=4 1875 B5R0.2 CCO/C=C\Br MCULE-7396084973 [0,0,1,0,0,0|2,0,1]=4 1876 B5R0.2 CCOC=CBr MCULE-5241125671 [0,0,1,0,0,0|2,0,1]=4 1877 B5R0.2 CCOCC#N MCULE-6709940440 [0,0,1,0,0,0|2,0,1]=4 1878 B5R0.2 CCOCCBr MCULE-4818900555 [0,0,1,0,0,0|2,0,1]=4 1879 B5R0.2 CCOCCCl MCULE-1290576729 [0,0,1,0,0,0|2,0,1]=4 1880 B5R0.2 CCOCCI MCULE-1833092968 [0,0,1,0,0,0|2,0,1]=4 1881 B5R0.2 CCOCCN MCULE-1254431240 [0,0,1,0,0,0|2,0,1]=4 1882 B5R0.2 CCOCCN MCULE-4039110889 [0,0,1,0,0,0|2,0,1]=4 1883 B5R0.2 CCOCCN MCULE-4400456933 [0,0,1,0,0,0|2,0,1]=4 1884 B5R0.2 CCOCCO MCULE-4311513289 [0,0,1,0,0,0|1,0,2]=4 1885 B5R0.2 CCOCCS MCULE-3968740645 [0,0,1,0,0,0|1,1,1]=4 1886 B5R0.2 CCSCC#N MCULE-4093791055 [0,0,1,0,0,0|2,0,1]=4 1887 B5R0.2 CCSCC=O MCULE-8069035019 [0,0,1,0,0,0|1,0,0]=2 1888 B5R0.2 CCSCCBr MCULE-9449933342 [0,0,1,0,0,0|2,0,1]=4 1889 B5R0.2 CCSCCCl MCULE-4057847237 [0,0,1,0,0,0|2,0,1]=4 1890 B5R0.2 CCSCCN MCULE-3375644872 [0,0,1,0,0,0|2,0,1]=4 1891 B5R0.2 CCSCCN MCULE-4466279976 [0,0,1,0,0,0|2,0,1]=4 1892 B5R0.2 CCSCCO MCULE-3557086162 [0,0,1,0,0,0|1,0,2]=4 1893 B5R0.2 CCSCCS MCULE-4583054157 [0,0,1,0,0,0|1,1,1]=4 1894 B5R0.2 CNCCC#N MCULE-6686234290 [0,0,1,0,0,0|2,0,1]=4 1895 B5R0.2 CNCCCBr MCULE-3376600253 [0,0,1,0,0,0|2,0,1]=4 1896 B5R0.2 CNCCCBr MCULE-6212326106 [0,0,1,0,0,0|2,0,1]=4 1897 B5R0.2 CNCCCCl MCULE-1007719210 [0,0,1,0,0,0|2,0,1]=4 1898 B5R0.2 CNCCCCl MCULE-6146901643 [0,0,1,0,0,0|2,0,1]=4 1899 B5R0.2 CNCCCF MCULE-7647417887 [0,0,1,0,0,0|2,0,1]=4 1900 B5R0.2 CNCCCN MCULE-1736081896 [0,0,1,0,0,0|2,0,1]=4 1901 B5R0.2 CNCCCO MCULE-9530478547 [0,0,1,0,0,0|1,0,2]=4 1902 B5R0.2 CNCCNC MCULE-1378979868 [0,0,1,0,0,0|3,0,0]=4 1903 B5R0.2 CNCCNC MCULE-3281508478 [0,0,1,0,0,0|3,0,0]=4 1904 B5R0.2 CNCCOC MCULE-2857904484 [0,0,1,0,0,0|3,0,0]=4 1905 B5R0.2 CNCCOC MCULE-5342712496 [0,0,1,0,0,0|3,0,0]=4 1906 B5R0.2 CNCCSC MCULE-2812984399 [0,0,1,0,0,0|3,0,0]=4 1907 B5R0.2 CNCCSC MCULE-2942435951 [0,0,1,0,0,0|3,0,0]=4 1908 B5R0.2 COCCC#N MCULE-3009737584 [0,0,1,0,0,0|2,0,1]=4 1909 B5R0.2 COCCC=O MCULE-2812117208 [0,0,1,0,0,0|1,0,0]=2 1910 B5R0.2 COCCCBr MCULE-6489536401 [0,0,1,0,0,0|2,0,1]=4 1911 B5R0.2 COCCCCl MCULE-9192274624 [0,0,1,0,0,0|2,0,1]=4 1912 B5R0.2 COCCCF MCULE-5055725246 [0,0,1,0,0,0|2,0,1]=4 1913 B5R0.2 COCCCI MCULE-9111605439 [0,0,1,0,0,0|2,0,1]=4 1914 B5R0.2 COCCCN MCULE-1421362990 [0,0,1,0,0,0|2,0,1]=4 1915 B5R0.2 COCCCN MCULE-4783132205 [0,0,1,0,0,0|2,0,1]=4 1916 B5R0.2 COCCCO MCULE-4041418048 [0,0,1,0,0,0|1,0,2]=4 1917 B5R0.2 COCCCS MCULE-2371333731 [0,0,1,0,0,0|1,1,1]=4 1918 B5R0.2 COCCNN MCULE-2086510453 [0,0,1,0,0,0|3,0,0]=4 1919 B5R0.2 COCCNN MCULE-4830987822 [0,0,1,0,0,0|3,0,0]=4 1920 B5R0.2 COCCNN MCULE-8361975855 [0,0,1,0,0,0|3,0,0]=4 1921 B5R0.2 COCCOC MCULE-7572196731 [0,0,1,0,0,0|3,0,0]=4 1922 B5R0.2 COCCON MCULE-3507489398 [0,0,1,0,0,0|3,0,0]=4 1923 B5R0.2 COCCON MCULE-8506879697 [0,0,1,0,0,0|3,0,0]=4 1924 B5R0.2 COCCSC MCULE-5362054021 [0,0,1,0,0,0|3,0,0]=4 1925 B5R0.2 COCN=C=O MCULE-6951734265 [0,0,1,0,0,0|2,0,1]=4 1926 B5R0.2 CSCCC#N MCULE-5755086116 [0,0,1,0,0,0|2,0,1]=4 1927 B5R0.2 CSCCC=O MCULE-6273241704 [0,0,1,0,0,0|1,0,0]=2 1928 B5R0.2 CSCCCBr MCULE-8399851816 [0,0,1,0,0,0|2,0,1]=4 1929 B5R0.2 CSCCCCl MCULE-1829120476 [0,0,1,0,0,0|2,0,1]=4 1930 B5R0.2 CSCCCN MCULE-1030938424 [0,0,1,0,0,0|2,0,1]=4 1931 B5R0.2 CSCCCN MCULE-4664984921 [0,0,1,0,0,0|2,0,1]=4 1932 B5R0.2 CSCCCO MCULE-9232413185 [0,0,1,0,0,0|1,0,2]=4 1933 B5R0.2 CSCCCS MCULE-8405766359 [0,0,1,0,0,0|1,1,1]=4 1934 B5R0.2 CSCCON MCULE-9125601960 [0,0,1,0,0,0|3,0,0]=4 1935 B5R0.2 ClCCCCBr MCULE-7973194927 [0,0,1,0,0,0|2,0,1]=4 1936 B5R0.2 ClCCCCCl MCULE-4863501782 [0,0,1,0,0,0|2,0,1]=4 1937 B5R0.2 ClCCCCI MCULE-4303507089 [0,0,1,0,0,0|2,0,1]=4 1938 B5R0.2 FCCCCBr MCULE-8408956872 [0,0,1,0,0,0|2,0,1]=4 1939 B5R0.2 FCCCCF MCULE-1347438150 [0,0,1,0,0,0|2,0,1]=4 1940 B5R0.2 ICCCCI MCULE-1390457250 [0,0,1,0,0,0|2,0,1]=4 1941 B5R0.2 N#CCCC=O MCULE-9521735106 [0,0,1,0,0,0|1,0,1]=3 1942 B5R0.2 N#CCCCBr MCULE-2664469446 [0,0,1,0,0,0|2,0,1]=4 1943 B5R0.2 N#CCCCCl MCULE-3310172135 [0,0,1,0,0,0|2,0,1]=4 1944 B5R0.2 N#CCCCF MCULE-3514322336 [0,0,1,0,0,0|2,0,1]=4 1945 B5R0.2 N#CCCCI MCULE-7661529037 [0,0,1,0,0,0|2,0,1]=4 1946 B5R0.2 N#CCCCN MCULE-7159177087 [0,0,1,0,0,0|2,0,1]=4 1947 B5R0.2 N#CCCCN MCULE-8406710235 [0,0,1,0,0,0|2,0,1]=4 1948 B5R0.2 N#CCCCO MCULE-2108386837 [0,0,1,0,0,0|2,0,1]=4 1949 B5R0.2 N#CCOC=O MCULE-4453241991 [0,0,1,0,0,0|2,0,1]=4 1950 B5R0.2 N#N=NCC=O MCULE-8370335984 [0,0,1,0,0,0|3,0,0]=4 1951 B5R0.2 NCCCCBr MCULE-7095299053 [0,0,1,0,0,0|2,0,1]=4 1952 B5R0.2 NCCCCBr MCULE-7716027825 [0,0,1,0,0,0|2,0,1]=4 1953 B5R0.2 NCCCCCl MCULE-8484381726 [0,0,1,0,0,0|2,0,1]=4 1954 B5R0.2 NCCCCCl MCULE-9917306082 [0,0,1,0,0,0|2,0,1]=4 1955 B5R0.2 NCCCCF MCULE-4260727945 [0,0,1,0,0,0|2,0,1]=4 1956 B5R0.2 NCCCCF MCULE-7716720921 [0,0,1,0,0,0|2,0,1]=4 1957 B5R0.2 NCCCCN MCULE-3098044935 [0,0,1,0,0,0|2,0,1]=4 1958 B5R0.2 NCCCCN MCULE-7898833229 [0,0,1,0,0,0|2,0,1]=4 1959 B5R0.2 NCCCCN MCULE-8029479697 [0,0,1,0,0,0|2,0,1]=4 1960 B5R0.2 NCCCCN MCULE-8509656776 [0,0,1,0,0,0|2,0,1]=4 1961 B5R0.2 NCCCCO MCULE-7395674091 [0,0,1,0,0,0|1,0,2]=4 1962 B5R0.2 NCCCCS MCULE-4353910418 [0,0,1,0,0,0|1,1,1]=4 1963 B5R0.2 NCCCCS MCULE-9812416858 [0,0,1,0,0,0|1,1,1]=4 1964 B5R0.2 NCCCNN MCULE-7657257572 [0,0,1,0,0,0|3,0,0]=4 1965 B5R0.2 NCCCON MCULE-1071170242 [0,0,1,0,0,0|3,0,0]=4 1966 B5R0.2 NCCCON MCULE-7767315563 [0,0,1,0,0,0|3,0,0]=4 1967 B5R0.2 NNCCCO MCULE-5557482626 [0,0,1,0,0,0|3,0,0]=4 1968 B5R0.2 NNCCCO MCULE-7351853032 [0,0,1,0,0,0|3,0,0]=4 1969 B5R0.2 NNCCCO MCULE-7919314403 [0,0,1,0,0,0|3,0,0]=4 1970 B5R0.2 NOCCCO MCULE-1072312935 [0,0,1,0,0,0|3,0,0]=4 1971 B5R0.2 NOCCCO MCULE-3715520109 [0,0,1,0,0,0|3,0,0]=4 1972 B5R0.2 NOCCCS MCULE-2063976508 [0,0,1,0,0,0|3,0,0]=4 1973 B5R0.2 NOCCCS MCULE-3464018652 [0,0,1,0,0,0|3,0,0]=4 1974 B5R0.2 O=C=NCCBr MCULE-9707894644 [0,0,1,0,0,0|2,0,1]=4 1975 B5R0.2 O=C=NCCCl MCULE-8919918461 [0,0,1,0,0,0|2,0,1]=4 1976 B5R0.2 O=CCCC=O MCULE-3362810468 [0,0,1,0,0,0|1,0,1]=3 1977 B5R0.2 O=CCCC=O MCULE-3813951568 [0,0,1,0,0,0|1,0,1]=3 1978 B5R0.2 O=CCCCBr MCULE-7239613396 [0,0,1,0,0,0|1,0,0]=2 1979 B5R0.2 O=CCCCCl MCULE-3011225716 [0,0,1,0,0,0|1,0,0]=2 1980 B5R0.2 O=CCCCI MCULE-3153720790 [0,0,1,0,0,0|1,0,0]=2 1981 B5R0.2 O=CCCCO MCULE-8728420992 [0,0,1,0,0,0|1,0,0]=2 1982 B5R0.2 O=CNCCO MCULE-3688614090 [0,0,1,0,0,0|2,0,0]=3 1983 B5R0.2 O=COCCO MCULE-1922672843 [0,0,1,0,0,0|2,0,0]=3 1984 B5R0.2 OC=CCCBr MCULE-3964604828 [0,0,1,0,0,0|1,0,2]=4 1985 B5R0.2 OC=CCCBr MCULE-5728835735 [0,0,1,0,0,0|1,0,2]=4 1986 B5R0.2 OCCCCBr MCULE-9231591925 [0,0,1,0,0,0|1,0,2]=4 1987 B5R0.2 OCCCCCl MCULE-3507644812 [0,0,1,0,0,0|1,0,2]=4 1988 B5R0.2 OCCCCF MCULE-9242285588 [0,0,1,0,0,0|1,0,2]=4 1989 B5R0.2 OCCCCI MCULE-8723720522 [0,0,1,0,0,0|1,0,2]=4 1990 B5R0.2 OCCCCO MCULE-2010022287 [0,0,1,0,0,0|1,0,2]=4 1991 B5R0.2 OCCCCO MCULE-6551106098 [0,0,1,0,0,0|1,0,2]=4 1992 B5R0.2 OCCCCS MCULE-8169490949 [0,0,1,0,0,0|1,0,2]=4 1993 B5R0.2 SCCCCS MCULE-6695609899 [0,0,1,0,0,0|1,1,1]=4 1994 B5R0.3 C#CC(=O)CC MCULE-1563732373 [0,0,1,0,0,0|0,0,2]=3 1995 B5R0.3 C#CC(=O)NC MCULE-8852565705 [0,0,1,0,0,0|1,0,2]=4 1996 B5R0.3 C#CC(=O)OC MCULE-5108326717 [0,0,1,0,0,0|1,0,2]=4 1997 B5R0.3 C/C=C(/C)\CC MCULE-9789907985 [0,0,1,0,0,0|1,0,1]=3 1998 B5R0.3 C/C=C(\C)/CC MCULE-7119786881 [0,0,1,0,0,0|1,0,1]=3 1999 B5R0.3 C/N=C(\N)/SC MCULE-1114021101 [0,0,1,0,0,0|3,0,0]=4 2000 B5R0.3 C/N=C(\N)/SC MCULE-4249574209 [0,0,1,0,0,0|3,0,0]=4 2001 B5R0.3 C=C(C=O)CC MCULE-2875154067 [0,0,1,0,0,0|2,0,1]=4 2002 B5R0.3 C=C(CBr)CBr MCULE-2855078657 [0,0,1,0,0,0|3,0,0]=4 2003 B5R0.3 C=C(CC)CBr MCULE-1652422688 [0,0,1,0,0,0|2,0,0]=3 2004 B5R0.3 C=C(CC)CC MCULE-9174509622 [0,0,1,0,0,0|1,0,0]=2 2005 B5R0.3 C=C(CC)CN MCULE-2269385026 [0,0,1,0,0,0|2,0,0]=3 2006 B5R0.3 C=C(CC)CN MCULE-3033447984 [0,0,1,0,0,0|2,0,0]=3 2007 B5R0.3 C=C(CC)CO MCULE-8127766352 [0,0,1,0,0,0|2,0,0]=3 2008 B5R0.3 C=C(CCl)CCl MCULE-2574913289 [0,0,1,0,0,0|3,0,0]=4 2009 B5R0.3 C=C(CI)CI MCULE-7592017619 [0,0,1,0,0,0|3,0,0]=4 2010 B5R0.3 C=C(CN)CN MCULE-5063132725 [0,0,1,0,0,0|3,0,0]=4 2011 B5R0.3 C=C(CO)CBr MCULE-9563589949 [0,0,1,0,0,0|3,0,0]=4 2012 B5R0.3 C=C(CO)CO MCULE-2682601949 [0,0,1,0,0,0|3,0,0]=4 2013 B5R0.3 C=C(SC)SC MCULE-8497326619 [0,0,1,0,0,0|3,0,0]=4 2014 B5R0.3 C=CC(=O)CC MCULE-7277696617 [0,0,1,0,0,0|0,0,2]=3 2015 B5R0.3 C=CC(=O)NC MCULE-5619481947 [0,0,1,0,0,0|1,0,2]=4 2016 B5R0.3 C=CC(=O)OC MCULE-6010665978 [0,0,1,0,0,0|1,0,2]=4 2017 B5R0.3 CC/C(=N/O)/C MCULE-9139048973 [0,0,1,0,0,0|3,0,0]=4 2018 B5R0.3 CC/C(=N/O)/N MCULE-2794748611 [0,0,1,0,0,0|3,0,0]=4 2019 B5R0.3 CC/C(=N/O)/N MCULE-7162577220 [0,0,1,0,0,0|3,0,0]=4 2020 B5R0.3 CC=C(C)CC MCULE-5790494157 [0,0,1,0,0,0|1,0,1]=3 2021 B5R0.3 CC=C(C)CCl MCULE-2444762050 [0,0,1,0,0,0|2,0,1]=4 2022 B5R0.3 CCC(=N)OC MCULE-4123543795 [0,0,1,0,0,0|2,0,0]=3 2023 B5R0.3 CCC(=N)OC MCULE-5346320805 [0,0,1,0,0,0|2,0,0]=3 2024 B5R0.3 CCC(=NO)C MCULE-1859652505 [0,0,1,0,0,0|3,0,0]=4 2025 B5R0.3 CCC(=O)CBr MCULE-7825573294 [0,0,1,0,0,0|1,0,0]=2 2026 B5R0.3 CCC(=O)CC MCULE-8236549739 [0,0,1,0,0,0|0,0,0]=1 2027 B5R0.3 CCC(=O)CCl MCULE-9019890380 [0,0,1,0,0,0|1,0,0]=2 2028 B5R0.3 CCC(=O)CN MCULE-1863418812 [0,0,1,0,0,0|1,0,0]=2 2029 B5R0.3 CCC(=O)CN MCULE-5831164340 [0,0,1,0,0,0|1,0,0]=2 2030 B5R0.3 CCC(=O)CO MCULE-8674894820 [0,0,1,0,0,0|1,0,0]=2 2031 B5R0.3 CCC(=O)NC MCULE-5612060170 [0,0,1,0,0,0|1,0,0]=2 2032 B5R0.3 CCC(=O)NN MCULE-1803705917 [0,0,1,0,0,0|2,0,0]=3 2033 B5R0.3 CCC(=O)NO MCULE-1033164448 [0,0,1,0,0,0|2,0,0]=3 2034 B5R0.3 CCC(=O)OC MCULE-7384824725 [0,0,1,0,0,0|1,0,0]=2 2035 B5R0.3 CCC(=O)SC MCULE-9712192191 [0,0,1,0,0,0|1,0,0]=2 2036 B5R0.3 CCC(Br)CBr MCULE-5254958560 [0,0,1,0,0,0|2,0,1]=4 2037 B5R0.3 CCC(Br)CC MCULE-7435628721 [0,0,1,0,0,0|1,0,1]=3 2038 B5R0.3 CCC(Br)CO MCULE-7211805716 [0,0,1,0,0,0|2,0,1]=4 2039 B5R0.3 CCC(C)CBr MCULE-5451416952 [0,0,1,0,0,0|2,0,1]=4 2040 B5R0.3 CCC(C)CC MCULE-2542807917 [0,0,1,0,0,0|1,0,1]=3 2041 B5R0.3 CCC(C)CCl MCULE-7450386476 [0,0,1,0,0,0|2,0,1]=4 2042 B5R0.3 CCC(C)CI MCULE-5444509280 [0,0,1,0,0,0|2,0,1]=4 2043 B5R0.3 CCC(C)CN MCULE-2777327284 [0,0,1,0,0,0|2,0,1]=4 2044 B5R0.3 CCC(C)CN MCULE-7014901600 [0,0,1,0,0,0|2,0,1]=4 2045 B5R0.3 CCC(C)CO MCULE-6521026296 [0,0,1,0,0,0|2,0,1]=4 2046 B5R0.3 CCC(C)CS MCULE-7795095685 [0,0,1,0,0,0|2,0,1]=4 2047 B5R0.3 CCC(C)NC MCULE-2676584804 [0,0,1,0,0,0|2,0,1]=4 2048 B5R0.3 CCC(C)NC MCULE-6158046887 [0,0,1,0,0,0|2,0,1]=4 2049 B5R0.3 CCC(C)OC MCULE-7354431606 [0,0,1,0,0,0|2,0,1]=4 2050 B5R0.3 CCC(Cl)CCl MCULE-5122022797 [0,0,1,0,0,0|2,0,1]=4 2051 B5R0.3 CCC(Cl)CO MCULE-1756262629 [0,0,1,0,0,0|2,0,1]=4 2052 B5R0.3 CCC(F)CBr MCULE-3226052264 [0,0,1,0,0,0|2,0,1]=4 2053 B5R0.3 CCC(F)CN MCULE-1291385596 [0,0,1,0,0,0|2,0,1]=4 2054 B5R0.3 CCC(F)CN MCULE-7421331323 [0,0,1,0,0,0|2,0,1]=4 2055 B5R0.3 CCC(I)CC MCULE-1119844552 [0,0,1,0,0,0|1,0,1]=3 2056 B5R0.3 CCC(N)CBr MCULE-3567691924 [0,0,1,0,0,0|2,0,1]=4 2057 B5R0.3 CCC(N)CC MCULE-4261937519 [0,0,1,0,0,0|1,0,1]=3 2058 B5R0.3 CCC(N)CC MCULE-5899128891 [0,0,1,0,0,0|1,0,1]=3 2059 B5R0.3 CCC(N)CN MCULE-6911484065 [0,0,1,0,0,0|2,0,1]=4 2060 B5R0.3 CCC(N)CN MCULE-8376506697 [0,0,1,0,0,0|2,0,1]=4 2061 B5R0.3 CCC(N)CO MCULE-1135809021 [0,0,1,0,0,0|2,0,1]=4 2062 B5R0.3 CCC(N)CO MCULE-7588854111 [0,0,1,0,0,0|2,0,1]=4 2063 B5R0.3 CCC(O)CBr MCULE-4205031860 [0,0,1,0,0,0|1,0,2]=4 2064 B5R0.3 CCC(O)CC MCULE-5553645045 [0,0,1,0,0,0|0,0,2]=3 2065 B5R0.3 CCC(O)CCl MCULE-8359810208 [0,0,1,0,0,0|1,0,2]=4 2066 B5R0.3 CCC(O)CN MCULE-5197026448 [0,0,1,0,0,0|1,0,2]=4 2067 B5R0.3 CCC(O)CO MCULE-2488753438 [0,0,1,0,0,0|1,0,2]=4 2068 B5R0.3 CCC(O)CO MCULE-7297282094 [0,0,1,0,0,0|1,0,2]=4 2069 B5R0.3 CCC(S)CC MCULE-2556259434 [0,0,1,0,0,0|0,1,1]=3 2070 B5R0.3 CCC(S)CS MCULE-9332449950 [0,0,1,0,0,0|1,1,1]=4 2071 B5R0.3 CCC([NH3+])CBr MCULE-6971158198 [0,0,1,0,0,0|2,0,1]=4 2072 B5R0.3 CCN(C)CC MCULE-7207964917 [0,0,1,0,0,0|2,0,0]=3 2073 B5R0.3 CCN(N)CC MCULE-9853386945 [0,0,1,0,0,0|2,0,0]=3 2074 B5R0.3 CCN(N)CC MCULE-9962617398 [0,0,1,0,0,0|2,0,0]=3 2075 B5R0.3 CCN(O)CC MCULE-6022935768 [0,0,1,0,0,0|1,0,1]=3 2076 B5R0.3 CCP(=O)CC MCULE-2216184595 [0,0,1,0,0,0|1,0,0]=2 2077 B5R0.3 CCP(Cl)CC MCULE-4484529264 [0,0,1,0,0,0|2,0,0]=3 2078 B5R0.3 CCS(=O)CC MCULE-5102735179 [0,0,1,0,0,0|1,0,0]=2 2079 B5R0.3 CC[C@@H](C)CBr MCULE-5675886072 [0,0,1,0,0,0|2,0,1]=4 2080 B5R0.3 CC[C@@H](C)CN MCULE-7612408107 [0,0,1,0,0,0|2,0,1]=4 2081 B5R0.3 CC[C@@H](C)CO MCULE-6700783698 [0,0,1,0,0,0|2,0,1]=4 2082 B5R0.3 CC[C@@H](C)CO MCULE-8175790803 [0,0,1,0,0,0|2,0,1]=4 2083 B5R0.3 CC[C@@H](N)CO MCULE-3821348404 [0,0,1,0,0,0|2,0,1]=4 2084 B5R0.3 CC[C@@H](N)CO MCULE-7190248306 [0,0,1,0,0,0|2,0,1]=4 2085 B5R0.3 CC[C@@H](O)CN MCULE-2854535153 [0,0,1,0,0,0|1,0,2]=4 2086 B5R0.3 CC[C@@H](O)CN MCULE-8228547956 [0,0,1,0,0,0|1,0,2]=4 2087 B5R0.3 CC[C@@H](O)CO MCULE-3948477298 [0,0,1,0,0,0|1,0,2]=4 2088 B5R0.3 CC[C@@H](O)CO MCULE-5098109795 [0,0,1,0,0,0|1,0,2]=4 2089 B5R0.3 CC[C@H](C)CBr MCULE-3263714447 [0,0,1,0,0,0|2,0,1]=4 2090 B5R0.3 CC[C@H](C)CBr MCULE-3384648570 [0,0,1,0,0,0|2,0,1]=4 2091 B5R0.3 CC[C@H](C)CCl MCULE-6795758745 [0,0,1,0,0,0|2,0,1]=4 2092 B5R0.3 CC[C@H](C)CCl MCULE-8147276830 [0,0,1,0,0,0|2,0,1]=4 2093 B5R0.3 CC[C@H](C)CI MCULE-9690776923 [0,0,1,0,0,0|2,0,1]=4 2094 B5R0.3 CC[C@H](C)CN MCULE-1380819951 [0,0,1,0,0,0|2,0,1]=4 2095 B5R0.3 CC[C@H](C)CN MCULE-1396096112 [0,0,1,0,0,0|2,0,1]=4 2096 B5R0.3 CC[C@H](C)CN MCULE-2971933862 [0,0,1,0,0,0|2,0,1]=4 2097 B5R0.3 CC[C@H](C)CN MCULE-3698084674 [0,0,1,0,0,0|2,0,1]=4 2098 B5R0.3 CC[C@H](C)CO MCULE-1493424061 [0,0,1,0,0,0|2,0,1]=4 2099 B5R0.3 CC[C@H](C)CO MCULE-6879443668 [0,0,1,0,0,0|2,0,1]=4 2100 B5R0.3 CC[C@H](N)CF MCULE-3646304583 [0,0,1,0,0,0|2,0,1]=4 2101 B5R0.3 CC[C@H](N)CF MCULE-4493834638 [0,0,1,0,0,0|2,0,1]=4 2102 B5R0.3 CC[C@H](N)CO MCULE-5500083870 [0,0,1,0,0,0|2,0,1]=4 2103 B5R0.3 CC[C@H](N)CO MCULE-6312512384 [0,0,1,0,0,0|2,0,1]=4 2104 B5R0.3 CC[C@H](O)CN MCULE-4385930741 [0,0,1,0,0,0|1,0,2]=4 2105 B5R0.3 CC[C@H](O)CO MCULE-2194264642 [0,0,1,0,0,0|1,0,2]=4 2106 B5R0.3 CC[C@H](O)CO MCULE-5503575962 [0,0,1,0,0,0|1,0,2]=4 2107 B5R0.3 CNC(=N)CO MCULE-3239749882 [0,0,1,0,0,0|3,0,0]=4 2108 B5R0.3 CNC(=N)NC MCULE-7703075263 [0,0,1,0,0,0|3,0,0]=4 2109 B5R0.3 CNC(=O)CBr MCULE-1439209307 [0,0,1,0,0,0|2,0,0]=3 2110 B5R0.3 CNC(=O)CCl MCULE-1437904095 [0,0,1,0,0,0|2,0,0]=3 2111 B5R0.3 CNC(=O)CI MCULE-1687694185 [0,0,1,0,0,0|2,0,0]=3 2112 B5R0.3 CNC(=O)CN MCULE-1901033297 [0,0,1,0,0,0|2,0,0]=3 2113 B5R0.3 CNC(=O)CN MCULE-8532774234 [0,0,1,0,0,0|2,0,0]=3 2114 B5R0.3 CNC(=O)CO MCULE-5899226107 [0,0,1,0,0,0|2,0,0]=3 2115 B5R0.3 CNC(=O)CS MCULE-7032391129 [0,0,1,0,0,0|2,0,0]=3 2116 B5R0.3 CNC(=O)NC MCULE-5319497155 [0,0,1,0,0,0|2,0,0]=3 2117 B5R0.3 CNC(=O)NN MCULE-2093843774 [0,0,1,0,0,0|3,0,0]=4 2118 B5R0.3 CNC(=O)OC MCULE-1162861376 [0,0,1,0,0,0|2,0,0]=3 2119 B5R0.3 CNC(=S)NC MCULE-7998520647 [0,0,1,0,0,0|2,1,0]=4 2120 B5R0.3 COC(=N)CCl MCULE-2713131753 [0,0,1,0,0,0|3,0,0]=4 2121 B5R0.3 COC(=N)CCl MCULE-6471252676 [0,0,1,0,0,0|3,0,0]=4 2122 B5R0.3 COC(=O)C#N MCULE-8762838190 [0,0,1,0,0,0|2,0,1]=4 2123 B5R0.3 COC(=O)C=O MCULE-2685327079 [0,0,1,0,0,0|2,0,1]=4 2124 B5R0.3 COC(=O)CBr MCULE-2684954408 [0,0,1,0,0,0|2,0,0]=3 2125 B5R0.3 COC(=O)CCl MCULE-5886832940 [0,0,1,0,0,0|2,0,0]=3 2126 B5R0.3 COC(=O)CF MCULE-4367430175 [0,0,1,0,0,0|2,0,0]=3 2127 B5R0.3 COC(=O)CI MCULE-9545584156 [0,0,1,0,0,0|2,0,0]=3 2128 B5R0.3 COC(=O)CN MCULE-7462799100 [0,0,1,0,0,0|2,0,0]=3 2129 B5R0.3 COC(=O)CN MCULE-8887061469 [0,0,1,0,0,0|2,0,0]=3 2130 B5R0.3 COC(=O)CO MCULE-8734582763 [0,0,1,0,0,0|2,0,0]=3 2131 B5R0.3 COC(=O)CS MCULE-3020830180 [0,0,1,0,0,0|2,0,0]=3 2132 B5R0.3 COC(=O)NN MCULE-2637794839 [0,0,1,0,0,0|3,0,0]=4 2133 B5R0.3 COC(=O)OC MCULE-7488725621 [0,0,1,0,0,0|2,0,0]=3 2134 B5R0.3 COC(=O)SCl MCULE-1018411491 [0,0,1,0,0,0|3,0,0]=4 2135 B5R0.3 COC(=S)SC MCULE-7665194168 [0,0,1,0,0,0|2,1,0]=4 2136 B5R0.3 COS(=O)OC MCULE-9352053920 [0,0,1,0,0,0|3,0,0]=4 2137 B5R0.3 CSC(=O)SC MCULE-7167992573 [0,0,1,0,0,0|2,0,0]=3 2138 B5R0.3 CSC(=S)SC MCULE-5023087703 [0,0,1,0,0,0|2,1,0]=4 2139 B5R0.3 NCC(=O)CN MCULE-2420991481 [0,0,1,0,0,0|2,0,0]=3 2140 B5R0.3 NCC(=O)CN MCULE-8626789745 [0,0,1,0,0,0|2,0,0]=3 2141 B5R0.3 NCC(=O)NN MCULE-2318099199 [0,0,1,0,0,0|3,0,0]=4 2142 B5R0.3 NCC(=O)NN MCULE-3392354502 [0,0,1,0,0,0|3,0,0]=4 2143 B5R0.3 NCC(=O)NO MCULE-5417617455 [0,0,1,0,0,0|3,0,0]=4 2144 B5R0.3 NNC(=O)CCl MCULE-2158347473 [0,0,1,0,0,0|3,0,0]=4 2145 B5R0.3 NNC(=O)CCl MCULE-9762553206 [0,0,1,0,0,0|3,0,0]=4 2146 B5R0.3 NNC(=O)CO MCULE-8443636349 [0,0,1,0,0,0|3,0,0]=4 2147 B5R0.3 NNC(=O)CS MCULE-4913925166 [0,0,1,0,0,0|3,0,0]=4 2148 B5R0.3 O=C(CBr)CBr MCULE-5262523719 [0,0,1,0,0,0|2,0,0]=3 2149 B5R0.3 O=C(CCl)CCl MCULE-2048636813 [0,0,1,0,0,0|2,0,0]=3 2150 B5R0.3 O=C(CF)CF MCULE-8790300272 [0,0,1,0,0,0|2,0,0]=3 2151 B5R0.3 O=C(CO)CO MCULE-7188810449 [0,0,1,0,0,0|2,0,0]=3 2152 B5R0.3 O=CC(=O)CO MCULE-7273475675 [0,0,1,0,0,0|2,0,1]=4 2153 B5R0.3 P(=O)(OC)OC MCULE-7918891029 [0,0,1,0,0,0|3,0,0]=4 2154 B7R2.11 C1CC2CC1N2 MCULE-6529016485 [0,0,0,1,0,0|1,0,1]=3 2155 B7R2.11 C1CC2CC1N2 MCULE-7997985442 [0,0,0,1,0,0|1,0,1]=3 2156 B7R2.11 C1CN2CN1C2 MCULE-1423842949 [0,0,0,1,0,0|3,0,0]=4 2157 B7R2.11 C1NC2CC1C2 MCULE-3826765557 [0,0,0,1,0,0|2,0,1]=4 2158 B7R2.11 C1NC2CC1C2 MCULE-4168683722 [0,0,0,1,0,0|2,0,1]=4 2159 B7R2.13 C1CC2CC2C1 MCULE-4998824123 [0,0,0,1,0,0|1,0,1]=3 2160 B7R2.13 C1CC2CC2N1 MCULE-5625544754 [0,0,0,1,0,0|2,0,1]=4 2161 B7R2.13 C1CC2CC2N1 MCULE-6822939101 [0,0,0,1,0,0|2,0,1]=4 2162 B7R2.13 C1CC2NC2C1 MCULE-4807869634 [0,0,0,1,0,0|1,0,1]=3 2163 B7R2.13 C1CC2OC2C1 MCULE-9831160642 [0,0,0,1,0,0|0,0,2]=3 2164 B7R2.13 C1NCC2C1C2 MCULE-5688427614 [0,0,0,1,0,0|2,0,1]=4 2165 B7R2.13 C1NCC2C1C2 MCULE-7833686848 [0,0,0,1,0,0|2,0,1]=4 2166 B7R2.13 C1NCC2C1O2 MCULE-2427865207 [0,0,0,1,0,0|1,0,2]=4 2167 B7R2.13 C1NCC2C1O2 MCULE-9737269595 [0,0,0,1,0,0|1,0,2]=4 2168 B7R2.13 C1NC[C@H]2[C@@H]1C2 MCULE-2763696860 [0,0,0,1,0,0|2,0,1]=4 2169 B7R2.13 C1OCC2C1O2 MCULE-5569274990 [0,0,0,1,0,0|1,0,2]=4 2170 B5R1.2 BrC1=CCC1 MCULE-7839710306 [0,0,0,0,1,0|1,0,1]=3 2171 B5R1.2 BrC1CCC1 MCULE-3713567804 [0,0,0,0,1,0|1,0,1]=3 2172 B5R1.2 BrC1CNC1 MCULE-4959282437 [0,0,0,0,1,0|2,0,1]=4 2173 B5R1.2 BrC1CNC1 MCULE-5635086924 [0,0,0,0,1,0|2,0,1]=4 2174 B5R1.2 BrC1CNC1 MCULE-7561312043 [0,0,0,0,1,0|2,0,1]=4 2175 B5R1.2 BrC1COC1 MCULE-7527620035 [0,0,0,0,1,0|2,0,1]=4 2176 B5R1.2 C=C1CCC1 MCULE-8318650413 [0,0,0,0,1,0|1,0,0]=2 2177 B5R1.2 C=C1CNC1 MCULE-1391021267 [0,0,0,0,1,0|2,0,0]=3 2178 B5R1.2 C=C1CNC1 MCULE-7957953185 [0,0,0,0,1,0|2,0,0]=3 2179 B5R1.2 C=C1COC1 MCULE-1822645869 [0,0,0,0,1,0|2,0,0]=3 2180 B5R1.2 CC1CCN1 MCULE-7952714343 [0,0,0,0,1,0|2,0,1]=4 2181 B5R1.2 CC1CCN1 MCULE-9084374728 [0,0,0,0,1,0|2,0,1]=4 2182 B5R1.2 CC1CNC1 MCULE-3977066574 [0,0,0,0,1,0|2,0,1]=4 2183 B5R1.2 CC1CNC1 MCULE-7868611457 [0,0,0,0,1,0|2,0,1]=4 2184 B5R1.2 C[C@@H]1CCN1 MCULE-1326888606 [0,0,0,0,1,0|2,0,1]=4 2185 B5R1.2 C[C@@H]1CCN1 MCULE-4242598105 [0,0,0,0,1,0|2,0,1]=4 2186 B5R1.2 C[C@@H]1CCN1 MCULE-7982357684 [0,0,0,0,1,0|2,0,1]=4 2187 B5R1.2 C[C@@H]1CCN1 MCULE-9443505478 [0,0,0,0,1,0|2,0,1]=4 2188 B5R1.2 C[C@H]1CCN1 MCULE-3178162849 [0,0,0,0,1,0|2,0,1]=4 2189 B5R1.2 C[C@H]1CCN1 MCULE-4001397038 [0,0,0,0,1,0|2,0,1]=4 2190 B5R1.2 C[C@H]1CCN1 MCULE-4361200248 [0,0,0,0,1,0|2,0,1]=4 2191 B5R1.2 C[C@H]1CCN1 MCULE-6534579029 [0,0,0,0,1,0|2,0,1]=4 2192 B5R1.2 ClC1CCC1 MCULE-2602937313 [0,0,0,0,1,0|1,0,1]=3 2193 B5R1.2 ClC1CNC1 MCULE-2051705029 [0,0,0,0,1,0|2,0,1]=4 2194 B5R1.2 ClC1CNC1 MCULE-6678325694 [0,0,0,0,1,0|2,0,1]=4 2195 B5R1.2 ClC1COC1 MCULE-7266812470 [0,0,0,0,1,0|2,0,1]=4 2196 B5R1.2 FC1CNC1 MCULE-5746598794 [0,0,0,0,1,0|2,0,1]=4 2197 B5R1.2 FC1CNC1 MCULE-9427948721 [0,0,0,0,1,0|2,0,1]=4 2198 B5R1.2 FC1COC1 MCULE-7899811313 [0,0,0,0,1,0|2,0,1]=4 2199 B5R1.2 IC1CCC1 MCULE-3890796264 [0,0,0,0,1,0|1,0,1]=3 2200 B5R1.2 IC1CNC1 MCULE-5957681014 [0,0,0,0,1,0|2,0,1]=4 2201 B5R1.2 IC1CNC1 MCULE-7396587981 [0,0,0,0,1,0|2,0,1]=4 2202 B5R1.2 IC1COC1 MCULE-6736781201 [0,0,0,0,1,0|2,0,1]=4 2203 B5R1.2 NC1CCC1 MCULE-7511834789 [0,0,0,0,1,0|1,0,1]=3 2204 B5R1.2 NC1CCC1 MCULE-9118406840 [0,0,0,0,1,0|1,0,1]=3 2205 B5R1.2 NC1CNC1 MCULE-3069271350 [0,0,0,0,1,0|2,0,1]=4 2206 B5R1.2 NC1CNC1 MCULE-4785323807 [0,0,0,0,1,0|2,0,1]=4 2207 B5R1.2 NC1COC1 MCULE-3457998413 [0,0,0,0,1,0|2,0,1]=4 2208 B5R1.2 NC1COC1 MCULE-8439862131 [0,0,0,0,1,0|2,0,1]=4 2209 B5R1.2 NC1CSC1 MCULE-8155396913 [0,0,0,0,1,0|2,0,1]=4 2210 B5R1.2 NC1CSC1 MCULE-8463545676 [0,0,0,0,1,0|2,0,1]=4 2211 B5R1.2 NC1CSC1 MCULE-8920812656 [0,0,0,0,1,0|2,0,1]=4 2212 B5R1.2 NN1CCC1 MCULE-8176731673 [0,0,0,0,1,0|2,0,0]=3 2213 B5R1.2 NN1CCC1 MCULE-8382619719 [0,0,0,0,1,0|2,0,0]=3 2214 B5R1.2 O=C1CCC1 MCULE-4870967355 [0,0,0,0,1,0|0,0,0]=1 2215 B5R1.2 O=C1CCN1 MCULE-9053067221 [0,0,0,0,1,0|1,0,0]=2 2216 B5R1.2 O=C1CCO1 MCULE-1277069147 [0,0,0,0,1,0|1,0,0]=2 2217 B5R1.2 O=C1CNC1 MCULE-5171659870 [0,0,0,0,1,0|1,0,0]=2 2218 B5R1.2 O=C1CNC1 MCULE-8293494956 [0,0,0,0,1,0|1,0,0]=2 2219 B5R1.2 O=C1COC1 MCULE-6847248632 [0,0,0,0,1,0|1,0,0]=2 2220 B5R1.2 O=C1CSC1 MCULE-4436071261 [0,0,0,0,1,0|1,0,0]=2 2221 B5R1.2 OC1CCC1 MCULE-2856311430 [0,0,0,0,1,0|0,0,2]=3 2222 B5R1.2 OC1CNC1 MCULE-3596383447 [0,0,0,0,1,0|1,0,2]=4 2223 B5R1.2 OC1CNC1 MCULE-7913518128 [0,0,0,0,1,0|1,0,2]=4 2224 B5R1.2 OC1COC1 MCULE-2630355859 [0,0,0,0,1,0|1,0,2]=4 2225 B5R1.2 OC1CSC1 MCULE-6759275460 [0,0,0,0,1,0|1,0,2]=4 2226 B5R1.2 SC1CCC1 MCULE-1779239394 [0,0,0,0,1,0|0,1,1]=3 2227 B5R1.2 SC1CNC1 MCULE-5823473779 [0,0,0,0,1,0|1,1,1]=4 2228 B5R1.2 SC1CNC1 MCULE-9002536698 [0,0,0,0,1,0|1,1,1]=4 2229 B5R1.2 SC1COC1 MCULE-2175099379 [0,0,0,0,1,0|1,1,1]=4 2230 B7R1.3 BrC1=CCCCC1 MCULE-6137796305 [0,0,0,0,0,1|1,0,0]=2 2231 B7R1.3 BrC1=CCCNC1 MCULE-1016336040 [0,0,0,0,0,1|1,0,1]=3 2232 B7R1.3 BrC1=CCCNC1 MCULE-9845052592 [0,0,0,0,0,1|1,0,1]=3 2233 B7R1.3 BrC1=CCOCC1 MCULE-7609274912 [0,0,0,0,0,1|1,0,1]=3 2234 B7R1.3 BrC1=CCSCC1 MCULE-6964400494 [0,0,0,0,0,1|1,0,1]=3 2235 B7R1.3 BrC1=COCCC1 MCULE-7754503978 [0,0,0,0,0,1|1,0,1]=3 2236 B7R1.3 BrC1C=CCCC1 MCULE-1210573604 [0,0,0,0,0,1|1,0,2]=4 2237 B7R1.3 BrC1CCCCC1 MCULE-7879113781 [0,0,0,0,0,1|1,0,1]=3 2238 B7R1.3 BrC1CCCCN1 MCULE-3863852230 [0,0,0,0,0,1|1,0,1]=3 2239 B7R1.3 BrC1CCCCO1 MCULE-3659439382 [0,0,0,0,0,1|1,0,1]=3 2240 B7R1.3 BrC1CCCNC1 MCULE-5734359694 [0,0,0,0,0,1|1,0,1]=3 2241 B7R1.3 BrC1CCCNC1 MCULE-8772964999 [0,0,0,0,0,1|1,0,1]=3 2242 B7R1.3 BrC1CCCNC1 MCULE-9975168983 [0,0,0,0,0,1|1,0,1]=3 2243 B7R1.3 BrC1CCCOC1 MCULE-5781416415 [0,0,0,0,0,1|1,0,1]=3 2244 B7R1.3 BrC1CCNCC1 MCULE-2524082443 [0,0,0,0,0,1|1,0,1]=3 2245 B7R1.3 BrC1CCNCC1 MCULE-9389571955 [0,0,0,0,0,1|1,0,1]=3 2246 B7R1.3 BrC1CCNCC1 MCULE-9646097822 [0,0,0,0,0,1|1,0,1]=3 2247 B7R1.3 BrC1CCOCC1 MCULE-4896539126 [0,0,0,0,0,1|1,0,1]=3 2248 B7R1.3 BrC1CCSCC1 MCULE-1239956252 [0,0,0,0,0,1|1,0,1]=3 2249 B7R1.3 C1(CCCNC1)F MCULE-2873742972 [0,0,0,0,0,1|1,0,1]=3 2250 B7R1.3 C1(CCCNC1)F MCULE-8247715411 [0,0,0,0,0,1|1,0,1]=3 2251 B7R1.3 C1(CCCNC1)N MCULE-2184623611 [0,0,0,0,0,1|1,0,1]=3 2252 B7R1.3 C1(CCCNC1)N MCULE-6177601832 [0,0,0,0,0,1|1,0,1]=3 2253 B7R1.3 C1(CCCNC1)O MCULE-5944071030 [0,0,0,0,0,1|0,0,2]=3 2254 B7R1.3 C1(CCCNC1)O MCULE-9769032939 [0,0,0,0,0,1|0,0,2]=3 2255 B7R1.3 C1(CCCOC1)N MCULE-7160456966 [0,0,0,0,0,1|1,0,1]=3 2256 B7R1.3 C1(CCCOC1)N MCULE-9418657332 [0,0,0,0,0,1|1,0,1]=3 2257 B7R1.3 C1(CNCCN1)C MCULE-7759957935 [0,0,0,0,0,1|2,0,1]=4 2258 B7R1.3 C1(CNCCO1)C MCULE-2805380245 [0,0,0,0,0,1|2,0,1]=4 2259 B7R1.3 C1(CNCCO1)C MCULE-3532041523 [0,0,0,0,0,1|2,0,1]=4 2260 B7R1.3 C=C1CCCCC1 MCULE-9812236661 [0,0,0,0,0,1|1,0,0]=2 2261 B7R1.3 C=C1CCCCN1 MCULE-8375354748 [0,0,0,0,0,1|1,0,0]=2 2262 B7R1.3 C=C1CCCNC1 MCULE-2588575300 [0,0,0,0,0,1|1,0,0]=2 2263 B7R1.3 C=C1CCCNC1 MCULE-9758065019 [0,0,0,0,0,1|1,0,0]=2 2264 B7R1.3 C=C1CCCOC1 MCULE-5236529273 [0,0,0,0,0,1|1,0,0]=2 2265 B7R1.3 C=C1CCNCC1 MCULE-4460895436 [0,0,0,0,0,1|1,0,0]=2 2266 B7R1.3 C=C1CCNCC1 MCULE-6605411269 [0,0,0,0,0,1|1,0,0]=2 2267 B7R1.3 C=C1CCNCC1 MCULE-6729798105 [0,0,0,0,0,1|1,0,0]=2 2268 B7R1.3 C=C1CCOCC1 MCULE-2744722311 [0,0,0,0,0,1|1,0,0]=2 2269 B7R1.3 CB1OCCCO1 MCULE-5692862103 [0,0,0,0,0,1|3,0,0]=4 2270 B7R1.3 CC1=CC=CCC1 MCULE-3797800778 [0,0,0,0,0,1|1,0,2]=4 2271 B7R1.3 CC1=CCC=CC1 MCULE-8148706670 [0,0,0,0,0,1|1,0,2]=4 2272 B7R1.3 CC1=CCCC=C1 MCULE-6224653152 [0,0,0,0,0,1|1,0,2]=4 2273 B7R1.3 CC1=CCCCC1 MCULE-2795172496 [0,0,0,0,0,1|1,0,0]=2 2274 B7R1.3 CC1=CCCNC1 MCULE-8145216779 [0,0,0,0,0,1|1,0,1]=3 2275 B7R1.3 CC1=CCCNC1 MCULE-9021954061 [0,0,0,0,0,1|1,0,1]=3 2276 B7R1.3 CC1=CCNCC1 MCULE-1503915992 [0,0,0,0,0,1|1,0,1]=3 2277 B7R1.3 CC1=CCNCC1 MCULE-3349815065 [0,0,0,0,0,1|1,0,1]=3 2278 B7R1.3 CC1=NCCNC1 MCULE-2066788449 [0,0,0,0,0,1|2,0,0]=3 2279 B7R1.3 CC1C=CCCC1 MCULE-8057302830 [0,0,0,0,0,1|1,0,2]=4 2280 B7R1.3 CC1CC=CCC1 MCULE-6343106785 [0,0,0,0,0,1|1,0,2]=4 2281 B7R1.3 CC1CCCCC1 MCULE-3843525768 [0,0,0,0,0,1|1,0,1]=3 2282 B7R1.3 CC1CCCCN1 MCULE-1741870990 [0,0,0,0,0,1|1,0,1]=3 2283 B7R1.3 CC1CCCCN1 MCULE-4453126703 [0,0,0,0,0,1|1,0,1]=3 2284 B7R1.3 CC1CCCCN1 MCULE-6620063962 [0,0,0,0,0,1|1,0,1]=3 2285 B7R1.3 CC1CCCCN1 MCULE-6838766744 [0,0,0,0,0,1|1,0,1]=3 2286 B7R1.3 CC1CCCCN1 MCULE-9227931620 [0,0,0,0,0,1|1,0,1]=3 2287 B7R1.3 CC1CCCCO1 MCULE-4439683294 [0,0,0,0,0,1|1,0,1]=3 2288 B7R1.3 CC1CCCNC1 MCULE-3344207132 [0,0,0,0,0,1|1,0,1]=3 2289 B7R1.3 CC1CCCNC1 MCULE-5707832183 [0,0,0,0,0,1|1,0,1]=3 2290 B7R1.3 CC1CCCNC1 MCULE-7033850891 [0,0,0,0,0,1|1,0,1]=3 2291 B7R1.3 CC1CCCNC1 MCULE-7153943487 [0,0,0,0,0,1|1,0,1]=3 2292 B7R1.3 CC1CCNCC1 MCULE-5873723365 [0,0,0,0,0,1|1,0,1]=3 2293 B7R1.3 CC1CCNCC1 MCULE-6994675149 [0,0,0,0,0,1|1,0,1]=3 2294 B7R1.3 CC1CCNCC1 MCULE-9043030659 [0,0,0,0,0,1|1,0,1]=3 2295 B7R1.3 CC1CCOCC1 MCULE-8623581625 [0,0,0,0,0,1|1,0,1]=3 2296 B7R1.3 CC1CCOCN1 MCULE-5420262342 [0,0,0,0,0,1|2,0,1]=4 2297 B7R1.3 CC1CCOCO1 MCULE-5013590651 [0,0,0,0,0,1|2,0,1]=4 2298 B7R1.3 CC1CNCCN1 MCULE-2536395443 [0,0,0,0,0,1|2,0,1]=4 2299 B7R1.3 CC1CNCCN1 MCULE-6313957247 [0,0,0,0,0,1|2,0,1]=4 2300 B7R1.3 CC1CNCCO1 MCULE-3071497485 [0,0,0,0,0,1|2,0,1]=4 2301 B7R1.3 CC1CNCCO1 MCULE-7956728736 [0,0,0,0,0,1|2,0,1]=4 2302 B7R1.3 CC1CNCCS1 MCULE-7391261862 [0,0,0,0,0,1|2,0,1]=4 2303 B7R1.3 CC1COCCN1 MCULE-1305824409 [0,0,0,0,0,1|2,0,1]=4 2304 B7R1.3 CC1COCCN1 MCULE-4570632464 [0,0,0,0,0,1|2,0,1]=4 2305 B7R1.3 CC1COCCN1 MCULE-6275555682 [0,0,0,0,0,1|2,0,1]=4 2306 B7R1.3 CC1COCCN1 MCULE-8711024794 [0,0,0,0,0,1|2,0,1]=4 2307 B7R1.3 CC1CSCCN1 MCULE-2923436126 [0,0,0,0,0,1|2,0,1]=4 2308 B7R1.3 CC1NCCCO1 MCULE-2236660860 [0,0,0,0,0,1|2,0,1]=4 2309 B7R1.3 CC1SCCCS1 MCULE-8431698431 [0,0,0,0,0,1|2,0,1]=4 2310 B7R1.3 CN1CC=CCC1 MCULE-1566475259 [0,0,0,0,0,1|2,0,1]=4 2311 B7R1.3 CN1CC=CCC1 MCULE-7879022625 [0,0,0,0,0,1|2,0,1]=4 2312 B7R1.3 CN1CCCCC1 MCULE-3308944277 [0,0,0,0,0,1|2,0,0]=3 2313 B7R1.3 CN1CCCCO1 MCULE-4407617276 [0,0,0,0,0,1|2,0,0]=3 2314 B7R1.3 CN1CCCCO1 MCULE-6297284655 [0,0,0,0,0,1|2,0,0]=3 2315 B7R1.3 CN1CCNCC1 MCULE-5570228782 [0,0,0,0,0,1|2,0,0]=3 2316 B7R1.3 CN1CCNCC1 MCULE-7182634479 [0,0,0,0,0,1|2,0,0]=3 2317 B7R1.3 CN1CCOCC1 MCULE-1649171852 [0,0,0,0,0,1|2,0,0]=3 2318 B7R1.3 CN1CCSCC1 MCULE-9816739759 [0,0,0,0,0,1|2,0,0]=3 2319 B7R1.3 CN1CSCSC1 MCULE-8189192675 [0,0,0,0,0,1|3,0,0]=4 2320 B7R1.3 C[C@@H]1CCCCN1 MCULE-1372285636 [0,0,0,0,0,1|1,0,1]=3 2321 B7R1.3 C[C@@H]1CCCCN1 MCULE-1676908545 [0,0,0,0,0,1|1,0,1]=3 2322 B7R1.3 C[C@@H]1CCCCN1 MCULE-4298634468 [0,0,0,0,0,1|1,0,1]=3 2323 B7R1.3 C[C@@H]1CCCCN1 MCULE-6629826210 [0,0,0,0,0,1|1,0,1]=3 2324 B7R1.3 C[C@@H]1CCCNC1 MCULE-1079173995 [0,0,0,0,0,1|1,0,1]=3 2325 B7R1.3 C[C@@H]1CCCNC1 MCULE-1230145662 [0,0,0,0,0,1|1,0,1]=3 2326 B7R1.3 C[C@@H]1CCCNC1 MCULE-3423787676 [0,0,0,0,0,1|1,0,1]=3 2327 B7R1.3 C[C@@H]1CCCNC1 MCULE-9303264483 [0,0,0,0,0,1|1,0,1]=3 2328 B7R1.3 C[C@@H]1CNCCN1 MCULE-2959336973 [0,0,0,0,0,1|2,0,1]=4 2329 B7R1.3 C[C@@H]1CNCCN1 MCULE-3870060141 [0,0,0,0,0,1|2,0,1]=4 2330 B7R1.3 C[C@@H]1CNCCN1 MCULE-4214817913 [0,0,0,0,0,1|2,0,1]=4 2331 B7R1.3 C[C@@H]1CNCCN1 MCULE-4368092239 [0,0,0,0,0,1|2,0,1]=4 2332 B7R1.3 C[C@@H]1CNCCO1 MCULE-1787977539 [0,0,0,0,0,1|2,0,1]=4 2333 B7R1.3 C[C@@H]1CNCCO1 MCULE-2608004746 [0,0,0,0,0,1|2,0,1]=4 2334 B7R1.3 C[C@@H]1CNCCO1 MCULE-5447097956 [0,0,0,0,0,1|2,0,1]=4 2335 B7R1.3 C[C@@H]1CNCCO1 MCULE-9396954187 [0,0,0,0,0,1|2,0,1]=4 2336 B7R1.3 C[C@@H]1COCCN1 MCULE-2750151013 [0,0,0,0,0,1|2,0,1]=4 2337 B7R1.3 C[C@@H]1COCCN1 MCULE-4003273424 [0,0,0,0,0,1|2,0,1]=4 2338 B7R1.3 C[C@@H]1COCCN1 MCULE-4627627990 [0,0,0,0,0,1|2,0,1]=4 2339 B7R1.3 C[C@@H]1COCCN1 MCULE-8600287111 [0,0,0,0,0,1|2,0,1]=4 2340 B7R1.3 C[C@@H]1CSCCN1 MCULE-2613889704 [0,0,0,0,0,1|2,0,1]=4 2341 B7R1.3 C[C@H]1CCCCN1 MCULE-3586455704 [0,0,0,0,0,1|1,0,1]=3 2342 B7R1.3 C[C@H]1CCCCN1 MCULE-5638638213 [0,0,0,0,0,1|1,0,1]=3 2343 B7R1.3 C[C@H]1CCCCN1 MCULE-5867717461 [0,0,0,0,0,1|1,0,1]=3 2344 B7R1.3 C[C@H]1CCCCN1 MCULE-7106826493 [0,0,0,0,0,1|1,0,1]=3 2345 B7R1.3 C[C@H]1CCCNC1 MCULE-3372852932 [0,0,0,0,0,1|1,0,1]=3 2346 B7R1.3 C[C@H]1CCCNC1 MCULE-5146147676 [0,0,0,0,0,1|1,0,1]=3 2347 B7R1.3 C[C@H]1CCCNC1 MCULE-7894943546 [0,0,0,0,0,1|1,0,1]=3 2348 B7R1.3 C[C@H]1CCCNC1 MCULE-8016414984 [0,0,0,0,0,1|1,0,1]=3 2349 B7R1.3 C[C@H]1CNCCN1 MCULE-1403559972 [0,0,0,0,0,1|2,0,1]=4 2350 B7R1.3 C[C@H]1CNCCN1 MCULE-5769724060 [0,0,0,0,0,1|2,0,1]=4 2351 B7R1.3 C[C@H]1CNCCO1 MCULE-3158147539 [0,0,0,0,0,1|2,0,1]=4 2352 B7R1.3 C[C@H]1CNCCO1 MCULE-5193705878 [0,0,0,0,0,1|2,0,1]=4 2353 B7R1.3 C[C@H]1CNCCO1 MCULE-8337677707 [0,0,0,0,0,1|2,0,1]=4 2354 B7R1.3 C[C@H]1CNCCO1 MCULE-9425432414 [0,0,0,0,0,1|2,0,1]=4 2355 B7R1.3 C[C@H]1COCCN1 MCULE-1467834624 [0,0,0,0,0,1|2,0,1]=4 2356 B7R1.3 C[C@H]1COCCN1 MCULE-3486079226 [0,0,0,0,0,1|2,0,1]=4 2357 B7R1.3 C[C@H]1COCCN1 MCULE-5726525044 [0,0,0,0,0,1|2,0,1]=4 2358 B7R1.3 C[C@H]1COCCN1 MCULE-9977133603 [0,0,0,0,0,1|2,0,1]=4 2359 B7R1.3 C[C@H]1CSCCN1 MCULE-4076273874 [0,0,0,0,0,1|2,0,1]=4 2360 B7R1.3 ClC1=CCCCC1 MCULE-6882712527 [0,0,0,0,0,1|1,0,0]=2 2361 B7R1.3 ClC1=CCCNC1 MCULE-2132976242 [0,0,0,0,0,1|1,0,1]=3 2362 B7R1.3 ClC1=CCCNC1 MCULE-9013141821 [0,0,0,0,0,1|1,0,1]=3 2363 B7R1.3 ClC1C=CCCC1 MCULE-7233887185 [0,0,0,0,0,1|1,0,2]=4 2364 B7R1.3 ClC1CCCCC1 MCULE-9519865350 [0,0,0,0,0,1|1,0,1]=3 2365 B7R1.3 ClC1CCCCO1 MCULE-3251653488 [0,0,0,0,0,1|1,0,1]=3 2366 B7R1.3 ClC1CCCNC1 MCULE-3870722463 [0,0,0,0,0,1|1,0,1]=3 2367 B7R1.3 ClC1CCCNC1 MCULE-8461718443 [0,0,0,0,0,1|1,0,1]=3 2368 B7R1.3 ClC1CCCOC1 MCULE-5733907796 [0,0,0,0,0,1|1,0,1]=3 2369 B7R1.3 ClC1CCNCC1 MCULE-1320213535 [0,0,0,0,0,1|1,0,1]=3 2370 B7R1.3 ClC1CCNCC1 MCULE-3278149456 [0,0,0,0,0,1|1,0,1]=3 2371 B7R1.3 ClC1CCOCC1 MCULE-5672440693 [0,0,0,0,0,1|1,0,1]=3 2372 B7R1.3 ClN1CCOCC1 MCULE-2275187473 [0,0,0,0,0,1|2,0,0]=3 2373 B7R1.3 Cl[C@@H]1CCCNC1 MCULE-1513190720 [0,0,0,0,0,1|1,0,1]=3 2374 B7R1.3 Cl[C@@H]1CCCNC1 MCULE-4702442384 [0,0,0,0,0,1|1,0,1]=3 2375 B7R1.3 Cl[C@H]1CCCNC1 MCULE-1906196638 [0,0,0,0,0,1|1,0,1]=3 2376 B7R1.3 Cl[C@H]1CCCNC1 MCULE-5435721723 [0,0,0,0,0,1|1,0,1]=3 2377 B7R1.3 FC1=CCCNC1 MCULE-5131057553 [0,0,0,0,0,1|1,0,1]=3 2378 B7R1.3 FC1=CCCNC1 MCULE-8459145085 [0,0,0,0,0,1|1,0,1]=3 2379 B7R1.3 FC1=CCNCC1 MCULE-5573410633 [0,0,0,0,0,1|1,0,1]=3 2380 B7R1.3 FC1=CCNCC1 MCULE-9755070929 [0,0,0,0,0,1|1,0,1]=3 2381 B7R1.3 FC1CCCCC1 MCULE-4555555520 [0,0,0,0,0,1|1,0,1]=3 2382 B7R1.3 FC1CCCCO1 MCULE-8724227177 [0,0,0,0,0,1|1,0,1]=3 2383 B7R1.3 FC1CCCNC1 MCULE-1207637035 [0,0,0,0,0,1|1,0,1]=3 2384 B7R1.3 FC1CCCNC1 MCULE-8874983109 [0,0,0,0,0,1|1,0,1]=3 2385 B7R1.3 FC1CCCOC1 MCULE-9003204358 [0,0,0,0,0,1|1,0,1]=3 2386 B7R1.3 FC1CCNCC1 MCULE-1146732226 [0,0,0,0,0,1|1,0,1]=3 2387 B7R1.3 FC1CCNCC1 MCULE-9481825539 [0,0,0,0,0,1|1,0,1]=3 2388 B7R1.3 F[C@@H]1CCCNC1 MCULE-1015853975 [0,0,0,0,0,1|1,0,1]=3 2389 B7R1.3 F[C@@H]1CCCNC1 MCULE-2442101978 [0,0,0,0,0,1|1,0,1]=3 2390 B7R1.3 F[C@@H]1CCCNC1 MCULE-3088687742 [0,0,0,0,0,1|1,0,1]=3 2391 B7R1.3 F[C@@H]1CCCNC1 MCULE-3298158493 [0,0,0,0,0,1|1,0,1]=3 2392 B7R1.3 F[C@H]1CCCNC1 MCULE-5863769143 [0,0,0,0,0,1|1,0,1]=3 2393 B7R1.3 F[C@H]1CCCNC1 MCULE-9142728260 [0,0,0,0,0,1|1,0,1]=3 2394 B7R1.3 F[C@H]1CCCNC1 MCULE-9496728832 [0,0,0,0,0,1|1,0,1]=3 2395 B7R1.3 F[C@H]1CCCNC1 MCULE-9795686850 [0,0,0,0,0,1|1,0,1]=3 2396 B7R1.3 IC1CCCCC1 MCULE-4499971048 [0,0,0,0,0,1|1,0,1]=3 2397 B7R1.3 IC1CCNCC1 MCULE-1161879837 [0,0,0,0,0,1|1,0,1]=3 2398 B7R1.3 IC1CCNCC1 MCULE-3953687682 [0,0,0,0,0,1|1,0,1]=3 2399 B7R1.3 IC1CCOCC1 MCULE-7226892860 [0,0,0,0,0,1|1,0,1]=3 2400 B7R1.3 IC1CCSCC1 MCULE-6684613275 [0,0,0,0,0,1|1,0,1]=3 2401 B7R1.3 IN1CCOCC1 MCULE-2342142292 [0,0,0,0,0,1|2,0,0]=3 2402 B7R1.3 IN1CCOCC1 MCULE-6623188938 [0,0,0,0,0,1|2,0,0]=3 2403 B7R1.3 N=C1NCCCO1 MCULE-4713912893 [0,0,0,0,0,1|2,0,0]=3 2404 B7R1.3 N=C1NCCCS1 MCULE-5425383221 [0,0,0,0,0,1|2,0,0]=3 2405 B7R1.3 NC1=NCCCC1 MCULE-1020722938 [0,0,0,0,0,1|1,0,0]=2 2406 B7R1.3 NC1=NCCCC1 MCULE-9735306041 [0,0,0,0,0,1|1,0,0]=2 2407 B7R1.3 NC1=NCCCN1 MCULE-1407334516 [0,0,0,0,0,1|2,0,0]=3 2408 B7R1.3 NC1=NCCCN1 MCULE-1674112662 [0,0,0,0,0,1|2,0,0]=3 2409 B7R1.3 NC1=NCCCO1 MCULE-1909217779 [0,0,0,0,0,1|2,0,0]=3 2410 B7R1.3 NC1=NCCCS1 MCULE-2157831645 [0,0,0,0,0,1|2,0,0]=3 2411 B7R1.3 NC1=NCCCS1 MCULE-7522126566 [0,0,0,0,0,1|2,0,0]=3 2412 B7R1.3 NC1=NCCSC1 MCULE-4272591822 [0,0,0,0,0,1|2,0,0]=3 2413 B7R1.3 NC1C=CCCC1 MCULE-4482857573 [0,0,0,0,0,1|1,0,2]=4 2414 B7R1.3 NC1C=CCCC1 MCULE-5378769676 [0,0,0,0,0,1|1,0,2]=4 2415 B7R1.3 NC1CC=CCC1 MCULE-4040563231 [0,0,0,0,0,1|1,0,2]=4 2416 B7R1.3 NC1CC=CCC1 MCULE-9904098902 [0,0,0,0,0,1|1,0,2]=4 2417 B7R1.3 NC1CCCCC1 MCULE-1274688385 [0,0,0,0,0,1|1,0,1]=3 2418 B7R1.3 NC1CCCCC1 MCULE-6218418825 [0,0,0,0,0,1|1,0,1]=3 2419 B7R1.3 NC1CCCCC1 MCULE-7654331405 [0,0,0,0,0,1|1,0,1]=3 2420 B7R1.3 NC1CCCCC1 MCULE-9211684304 [0,0,0,0,0,1|1,0,1]=3 2421 B7R1.3 NC1CCCCN1 MCULE-8429969520 [0,0,0,0,0,1|1,0,1]=3 2422 B7R1.3 NC1CCCNC1 MCULE-2846077424 [0,0,0,0,0,1|1,0,1]=3 2423 B7R1.3 NC1CCCNC1 MCULE-6762552983 [0,0,0,0,0,1|1,0,1]=3 2424 B7R1.3 NC1CCCNC1 MCULE-8978449052 [0,0,0,0,0,1|1,0,1]=3 2425 B7R1.3 NC1CCCOC1 MCULE-3002610862 [0,0,0,0,0,1|1,0,1]=3 2426 B7R1.3 NC1CCCOC1 MCULE-8678558313 [0,0,0,0,0,1|1,0,1]=3 2427 B7R1.3 NC1CCCSC1 MCULE-5361360271 [0,0,0,0,0,1|1,0,1]=3 2428 B7R1.3 NC1CCCSC1 MCULE-5652416535 [0,0,0,0,0,1|1,0,1]=3 2429 B7R1.3 NC1CCNCC1 MCULE-4122223472 [0,0,0,0,0,1|1,0,1]=3 2430 B7R1.3 NC1CCNCC1 MCULE-4894618503 [0,0,0,0,0,1|1,0,1]=3 2431 B7R1.3 NC1CCOCC1 MCULE-4830730893 [0,0,0,0,0,1|1,0,1]=3 2432 B7R1.3 NC1CCOCC1 MCULE-6229850202 [0,0,0,0,0,1|1,0,1]=3 2433 B7R1.3 NC1CCOCC1 MCULE-7619874469 [0,0,0,0,0,1|1,0,1]=3 2434 B7R1.3 NC1CCSCC1 MCULE-1077822824 [0,0,0,0,0,1|1,0,1]=3 2435 B7R1.3 NC1CCSCC1 MCULE-7148332202 [0,0,0,0,0,1|1,0,1]=3 2436 B7R1.3 NN1CCCCC1 MCULE-2078041523 [0,0,0,0,0,1|2,0,0]=3 2437 B7R1.3 NN1CCCCC1 MCULE-3853977450 [0,0,0,0,0,1|2,0,0]=3 2438 B7R1.3 NN1CCNCC1 MCULE-4047900576 [0,0,0,0,0,1|2,0,0]=3 2439 B7R1.3 NN1CCNCC1 MCULE-5083416150 [0,0,0,0,0,1|2,0,0]=3 2440 B7R1.3 NN1CCNCC1 MCULE-7309844454 [0,0,0,0,0,1|2,0,0]=3 2441 B7R1.3 NN1CCOCC1 MCULE-8277539965 [0,0,0,0,0,1|2,0,0]=3 2442 B7R1.3 NN1CCSCC1 MCULE-9712464832 [0,0,0,0,0,1|2,0,0]=3 2443 B7R1.3 N[C@@H]1CC=CCC1 MCULE-7764023195 [0,0,0,0,0,1|1,0,2]=4 2444 B7R1.3 N[C@@H]1CC=CCC1 MCULE-7983408030 [0,0,0,0,0,1|1,0,2]=4 2445 B7R1.3 N[C@@H]1CCCNC1 MCULE-1539406556 [0,0,0,0,0,1|1,0,1]=3 2446 B7R1.3 N[C@@H]1CCCNC1 MCULE-3403472114 [0,0,0,0,0,1|1,0,1]=3 2447 B7R1.3 N[C@@H]1CCCNC1 MCULE-6313396868 [0,0,0,0,0,1|1,0,1]=3 2448 B7R1.3 N[C@@H]1CCCNC1 MCULE-8281902784 [0,0,0,0,0,1|1,0,1]=3 2449 B7R1.3 N[C@@H]1CCCOC1 MCULE-3329999118 [0,0,0,0,0,1|1,0,1]=3 2450 B7R1.3 N[C@@H]1CCCOC1 MCULE-5434456311 [0,0,0,0,0,1|1,0,1]=3 2451 B7R1.3 N[C@@H]1CCCOC1 MCULE-8416525332 [0,0,0,0,0,1|1,0,1]=3 2452 B7R1.3 N[C@@H]1CCCOC1 MCULE-9941756618 [0,0,0,0,0,1|1,0,1]=3 2453 B7R1.3 N[C@H]1CC=CCC1 MCULE-2054948922 [0,0,0,0,0,1|1,0,2]=4 2454 B7R1.3 N[C@H]1CC=CCC1 MCULE-6634059436 [0,0,0,0,0,1|1,0,2]=4 2455 B7R1.3 N[C@H]1CCCNC1 MCULE-1133561466 [0,0,0,0,0,1|1,0,1]=3 2456 B7R1.3 N[C@H]1CCCNC1 MCULE-3601314617 [0,0,0,0,0,1|1,0,1]=3 2457 B7R1.3 N[C@H]1CCCNC1 MCULE-4741120465 [0,0,0,0,0,1|1,0,1]=3 2458 B7R1.3 N[C@H]1CCCNC1 MCULE-5291619589 [0,0,0,0,0,1|1,0,1]=3 2459 B7R1.3 N[C@H]1CCCNC1 MCULE-8831721515 [0,0,0,0,0,1|1,0,1]=3 2460 B7R1.3 N[C@H]1CCCOC1 MCULE-1619050625 [0,0,0,0,0,1|1,0,1]=3 2461 B7R1.3 N[C@H]1CCCOC1 MCULE-4275969826 [0,0,0,0,0,1|1,0,1]=3 2462 B7R1.3 N[C@H]1CCCOC1 MCULE-4421099383 [0,0,0,0,0,1|1,0,1]=3 2463 B7R1.3 N[C@H]1CCCOC1 MCULE-9281030983 [0,0,0,0,0,1|1,0,1]=3 2464 B7R1.3 O=C1C=CCCC1 MCULE-5207755083 [0,0,0,0,0,1|0,0,1]=2 2465 B7R1.3 O=C1C=CCCN1 MCULE-9815380990 [0,0,0,0,0,1|0,0,2]=3 2466 B7R1.3 O=C1C=CCCO1 MCULE-2962791770 [0,0,0,0,0,1|0,0,2]=3 2467 B7R1.3 O=C1C=CCOC1 MCULE-4817981961 [0,0,0,0,0,1|0,0,2]=3 2468 B7R1.3 O=C1C=COCC1 MCULE-2954829305 [0,0,0,0,0,1|0,0,2]=3 2469 B7R1.3 O=C1C=COCN1 MCULE-7471476237 [0,0,0,0,0,1|1,0,2]=4 2470 B7R1.3 O=C1CC=CCN1 MCULE-7370958955 [0,0,0,0,0,1|0,0,2]=3 2471 B7R1.3 O=C1CC=CN=N1 MCULE-5717852017 [0,0,0,0,0,1|1,0,2]=4 2472 B7R1.3 O=C1CC=COC1 MCULE-3434064170 [0,0,0,0,0,1|0,0,2]=3 2473 B7R1.3 O=C1CCCCC1 MCULE-5664385838 [0,0,0,0,0,1|0,0,0]=1 2474 B7R1.3 O=C1CCCCN1 MCULE-9168245534 [0,0,0,0,0,1|0,0,0]=1 2475 B7R1.3 O=C1CCCCO1 MCULE-4682307363 [0,0,0,0,0,1|0,0,0]=1 2476 B7R1.3 O=C1CCCCS1 MCULE-5383777119 [0,0,0,0,0,1|0,0,0]=1 2477 B7R1.3 O=C1CCCNC1 MCULE-2774326662 [0,0,0,0,0,1|0,0,0]=1 2478 B7R1.3 O=C1CCCNC1 MCULE-8149766009 [0,0,0,0,0,1|0,0,0]=1 2479 B7R1.3 O=C1CCCOC1 MCULE-5268404224 [0,0,0,0,0,1|0,0,0]=1 2480 B7R1.3 O=C1CCCSC1 MCULE-1649390503 [0,0,0,0,0,1|0,0,0]=1 2481 B7R1.3 O=C1CCNCC1 MCULE-7526186270 [0,0,0,0,0,1|0,0,0]=1 2482 B7R1.3 O=C1CCNCC1 MCULE-9761063200 [0,0,0,0,0,1|0,0,0]=1 2483 B7R1.3 O=C1CCNCN1 MCULE-5793765281 [0,0,0,0,0,1|1,0,0]=2 2484 B7R1.3 O=C1CCOCC1 MCULE-6728095514 [0,0,0,0,0,1|0,0,0]=1 2485 B7R1.3 O=C1CCSCC1 MCULE-8638366518 [0,0,0,0,0,1|0,0,0]=1 2486 B7R1.3 O=C1CNCCN1 MCULE-5599978871 [0,0,0,0,0,1|1,0,0]=2 2487 B7R1.3 O=C1CNCCO1 MCULE-2634056082 [0,0,0,0,0,1|1,0,0]=2 2488 B7R1.3 O=C1CNCCO1 MCULE-6420255529 [0,0,0,0,0,1|1,0,0]=2 2489 B7R1.3 O=C1COCCN1 MCULE-8242898041 [0,0,0,0,0,1|1,0,0]=2 2490 B7R1.3 O=C1COCCO1 MCULE-5754504096 [0,0,0,0,0,1|1,0,0]=2 2491 B7R1.3 O=C1CSC=CN1 MCULE-7195428643 [0,0,0,0,0,1|1,0,2]=4 2492 B7R1.3 O=C1CSCCN1 MCULE-1492056440 [0,0,0,0,0,1|1,0,0]=2 2493 B7R1.3 O=C1CSCSC1 MCULE-8034252746 [0,0,0,0,0,1|1,0,0]=2 2494 B7R1.3 O=C1NCCCN1 MCULE-4876148406 [0,0,0,0,0,1|1,0,0]=2 2495 B7R1.3 O=C1NCCCO1 MCULE-9333383492 [0,0,0,0,0,1|1,0,0]=2 2496 B7R1.3 O=C1NNCCO1 MCULE-2913818828 [0,0,0,0,0,1|2,0,0]=3 2497 B7R1.3 O=C1OCCCO1 MCULE-7728322911 [0,0,0,0,0,1|1,0,0]=2 2498 B7R1.3 O=P1OCCCO1 MCULE-9154920312 [0,0,0,0,0,1|2,0,0]=3 2499 B7R1.3 O=S1CCCCC1 MCULE-1275253796 [0,0,0,0,0,1|1,0,0]=2 2500 B7R1.3 O=S1CCCSC1 MCULE-5552019770 [0,0,0,0,0,1|1,0,0]=2 2501 B7R1.3 O=S1CCNCC1 MCULE-1812570930 [0,0,0,0,0,1|1,0,0]=2 2502 B7R1.3 O=S1CCNCC1 MCULE-9878649050 [0,0,0,0,0,1|1,0,0]=2 2503 B7R1.3 O=S1CCOCC1 MCULE-4979531002 [0,0,0,0,0,1|1,0,0]=2 2504 B7R1.3 O=S1OCCCO1 MCULE-4755606100 [0,0,0,0,0,1|2,0,0]=3 2505 B7R1.3 OB1OCCCO1 MCULE-7976289917 [0,0,0,0,0,1|2,0,1]=4 2506 B7R1.3 OC1=CN=NCC1 MCULE-3904781537 [0,0,0,0,0,1|1,0,2]=4 2507 B7R1.3 OC1C=CCCC1 MCULE-3255466542 [0,0,0,0,0,1|0,0,3]=4 2508 B7R1.3 OC1CC=CCC1 MCULE-9472259407 [0,0,0,0,0,1|0,0,3]=4 2509 B7R1.3 OC1CCCCC1 MCULE-8217921343 [0,0,0,0,0,1|0,0,2]=3 2510 B7R1.3 OC1CCCCN1 MCULE-7168605870 [0,0,0,0,0,1|0,0,2]=3 2511 B7R1.3 OC1CCCCN1 MCULE-9833825308 [0,0,0,0,0,1|0,0,2]=3 2512 B7R1.3 OC1CCCCO1 MCULE-1415784498 [0,0,0,0,0,1|0,0,2]=3 2513 B7R1.3 OC1CCCNC1 MCULE-4557845355 [0,0,0,0,0,1|0,0,2]=3 2514 B7R1.3 OC1CCCNC1 MCULE-6040312691 [0,0,0,0,0,1|0,0,2]=3 2515 B7R1.3 OC1CCCOC1 MCULE-3820663957 [0,0,0,0,0,1|0,0,2]=3 2516 B7R1.3 OC1CCCOC1 MCULE-4349250540 [0,0,0,0,0,1|0,0,2]=3 2517 B7R1.3 OC1CCCSC1 MCULE-1448781710 [0,0,0,0,0,1|0,0,2]=3 2518 B7R1.3 OC1CCNCC1 MCULE-3572807775 [0,0,0,0,0,1|0,0,2]=3 2519 B7R1.3 OC1CCNCC1 MCULE-4216905638 [0,0,0,0,0,1|0,0,2]=3 2520 B7R1.3 OC1CCNCC1 MCULE-8298401309 [0,0,0,0,0,1|0,0,2]=3 2521 B7R1.3 OC1CCOCC1 MCULE-3789534226 [0,0,0,0,0,1|0,0,2]=3 2522 B7R1.3 OC1CCSCC1 MCULE-6056663037 [0,0,0,0,0,1|0,0,2]=3 2523 B7R1.3 OC1CNCCO1 MCULE-7048275202 [0,0,0,0,0,1|1,0,2]=4 2524 B7R1.3 OC1CNCCO1 MCULE-9716087824 [0,0,0,0,0,1|1,0,2]=4 2525 B7R1.3 OC1COCOC1 MCULE-1056094446 [0,0,0,0,0,1|1,0,2]=4 2526 B7R1.3 ON1CCCCC1 MCULE-5529301217 [0,0,0,0,0,1|1,0,1]=3 2527 B7R1.3 ON1CCOCC1 MCULE-9071295312 [0,0,0,0,0,1|1,0,1]=3 2528 B7R1.3 O[C@@H]1CCCNC1 MCULE-3395625072 [0,0,0,0,0,1|0,0,2]=3 2529 B7R1.3 O[C@@H]1CCCNC1 MCULE-5041834047 [0,0,0,0,0,1|0,0,2]=3 2530 B7R1.3 O[C@@H]1CCCNC1 MCULE-5939951996 [0,0,0,0,0,1|0,0,2]=3 2531 B7R1.3 O[C@@H]1CCCNC1 MCULE-8822637089 [0,0,0,0,0,1|0,0,2]=3 2532 B7R1.3 O[C@@H]1CCCOC1 MCULE-1439860824 [0,0,0,0,0,1|0,0,2]=3 2533 B7R1.3 O[C@@H]1CCCOC1 MCULE-5515107963 [0,0,0,0,0,1|0,0,2]=3 2534 B7R1.3 O[C@H]1C=CCCC1 MCULE-5543899109 [0,0,0,0,0,1|0,0,3]=4 2535 B7R1.3 O[C@H]1CCCNC1 MCULE-3813591488 [0,0,0,0,0,1|0,0,2]=3 2536 B7R1.3 O[C@H]1CCCNC1 MCULE-5223055424 [0,0,0,0,0,1|0,0,2]=3 2537 B7R1.3 O[C@H]1CCCNC1 MCULE-7646198322 [0,0,0,0,0,1|0,0,2]=3 2538 B7R1.3 O[C@H]1CCCNC1 MCULE-7875547684 [0,0,0,0,0,1|0,0,2]=3 2539 B7R1.3 O[C@H]1CCCOC1 MCULE-2228949296 [0,0,0,0,0,1|0,0,2]=3 2540 B7R1.3 O[C@H]1CCCOC1 MCULE-6500179909 [0,0,0,0,0,1|0,0,2]=3 2541 B7R1.3 S=C1CCCCC1 MCULE-6072375043 [0,0,0,0,0,1|0,1,0]=2 2542 B7R1.3 S=C1CCCCN1 MCULE-2004608075 [0,0,0,0,0,1|0,1,0]=2 2543 B7R1.3 S=C1COCCN1 MCULE-1743172522 [0,0,0,0,0,1|1,1,0]=3 2544 B7R1.3 S=C1NCCCN1 MCULE-6601711997 [0,0,0,0,0,1|1,1,0]=3 2545 B7R1.3 S=C1NCCCO1 MCULE-2364674450 [0,0,0,0,0,1|1,1,0]=3 2546 B7R1.3 S=C1NCCCS1 MCULE-8898215455 [0,0,0,0,0,1|1,1,0]=3 2547 B7R1.3 S=C1NCNCN1 MCULE-8557857293 [0,0,0,0,0,1|2,1,0]=4 2548 B7R1.3 SC1CCCCC1 MCULE-2644288416 [0,0,0,0,0,1|0,1,1]=3 2549 B7R1.3 SC1CCCNC1 MCULE-4464031027 [0,0,0,0,0,1|0,1,1]=3 2550 B7R1.3 SC1CCCNC1 MCULE-5566651293 [0,0,0,0,0,1|0,1,1]=3 2551 B7R1.3 SC1CCCOC1 MCULE-9540212924 [0,0,0,0,0,1|0,1,1]=3 2552 B7R1.3 SC1CCNCC1 MCULE-2780144586 [0,0,0,0,0,1|0,1,1]=3 2553 B7R1.3 SC1CCNCC1 MCULE-4297654743 [0,0,0,0,0,1|0,1,1]=3 2554 B7R1.3 SC1CCOCC1 MCULE-1287019115 [0,0,0,0,0,1|0,1,1]=3 2555 B7R1.3 SC1CCSCC1 MCULE-8741596394 [0,0,0,0,0,1|0,1,1]=3 2556 B7R1.3 SC1NCCCS1 MCULE-3586134698 [0,0,0,0,0,1|1,1,1]=4 2557 B7R1.3 S[C@H]1CCCNC1 MCULE-5377455102 [0,0,0,0,0,1|0,1,1]=3 2558 B7R1.3 S[C@H]1CCCNC1 MCULE-9668422285 [0,0,0,0,0,1|0,1,1]=3 2559 B7R1.3 [NH3+]C1CCCCC1 MCULE-7876724648 [0,0,0,0,0,1|1,0,1]=3 2560 B4R0.1 C#CC(=O)C MCULE-1296030711 [1,0,1,0,0,0|0,0,2]=4 2561 B4R0.1 C/C=C(/C)\Cl MCULE-6841426098 [1,0,1,0,0,0|1,0,1]=4 2562 B4R0.1 C/C=C(\C)/Br MCULE-3045523462 [1,0,1,0,0,0|1,0,1]=4 2563 B4R0.1 C/C=C(\C)/Cl MCULE-4683862502 [1,0,1,0,0,0|1,0,1]=4 2564 B4R0.1 C=C(Br)CC MCULE-6271946451 [1,0,1,0,0,0|1,0,1]=4 2565 B4R0.1 C=C(C)CBr MCULE-1361893863 [1,0,1,0,0,0|2,0,0]=4 2566 B4R0.1 C=C(C)CCl MCULE-5586406339 [1,0,1,0,0,0|2,0,0]=4 2567 B4R0.1 C=C(C)CI MCULE-3678124406 [1,0,1,0,0,0|2,0,0]=4 2568 B4R0.1 C=C(C)CN MCULE-1033495975 [1,0,1,0,0,0|2,0,0]=4 2569 B4R0.1 C=C(C)CN MCULE-8730181300 [1,0,1,0,0,0|2,0,0]=4 2570 B4R0.1 C=C(C)CO MCULE-8641288398 [1,0,1,0,0,0|2,0,0]=4 2571 B4R0.1 C=C(C)CS MCULE-5174170431 [1,0,1,0,0,0|2,0,0]=4 2572 B4R0.1 C=C(C)OC MCULE-7344104255 [1,0,1,0,0,0|2,0,0]=4 2573 B4R0.1 C=CC(=O)C MCULE-4924646293 [1,0,1,0,0,0|0,0,2]=4 2574 B4R0.1 CC(=O)C#N MCULE-6317771757 [1,0,1,0,0,0|1,0,1]=4 2575 B4R0.1 CC(=O)C=O MCULE-2718961814 [1,0,1,0,0,0|1,0,1]=4 2576 B4R0.1 CC(=O)CBr MCULE-7812920675 [1,0,1,0,0,0|1,0,0]=3 2577 B4R0.1 CC(=O)CCl MCULE-2501365933 [1,0,1,0,0,0|1,0,0]=3 2578 B4R0.1 CC(=O)CF MCULE-7417279999 [1,0,1,0,0,0|1,0,0]=3 2579 B4R0.1 CC(=O)CN MCULE-2715277783 [1,0,1,0,0,0|1,0,0]=3 2580 B4R0.1 CC(=O)CN MCULE-6004541862 [1,0,1,0,0,0|1,0,0]=3 2581 B4R0.1 CC(=O)CO MCULE-2989526028 [1,0,1,0,0,0|1,0,0]=3 2582 B4R0.1 CC(=O)CS MCULE-9736174016 [1,0,1,0,0,0|1,0,0]=3 2583 B4R0.1 CC(=O)NBr MCULE-6502070876 [1,0,1,0,0,0|2,0,0]=4 2584 B4R0.1 CC(=O)NN MCULE-9183467120 [1,0,1,0,0,0|2,0,0]=4 2585 B4R0.1 CC(=O)NO MCULE-2682231025 [1,0,1,0,0,0|2,0,0]=4 2586 B4R0.1 CC(=O)OO MCULE-6028338742 [1,0,1,0,0,0|2,0,0]=4 2587 B4R0.1 CC=C(C)Br MCULE-1371905211 [1,0,1,0,0,0|1,0,1]=4 2588 B4R0.1 CC=C(C)C MCULE-4230157245 [1,0,1,0,0,0|1,0,1]=4 2589 B4R0.1 CC=C(C)Cl MCULE-3844314543 [1,0,1,0,0,0|1,0,1]=4 2590 B4R0.1 CCC(=N)N MCULE-1856575742 [1,0,1,0,0,0|2,0,0]=4 2591 B4R0.1 CCC(=N)N MCULE-2534386807 [1,0,1,0,0,0|2,0,0]=4 2592 B4R0.1 CCC(=O)Br MCULE-7870678619 [1,0,1,0,0,0|1,0,0]=3 2593 B4R0.1 CCC(=O)C MCULE-8276670748 [1,0,1,0,0,0|0,0,0]=2 2594 B4R0.1 CCC(=O)Cl MCULE-3081874391 [1,0,1,0,0,0|1,0,0]=3 2595 B4R0.1 CCC(=O)F MCULE-8783887670 [1,0,1,0,0,0|1,0,0]=3 2596 B4R0.1 CCC(=O)N MCULE-3730796130 [1,0,1,0,0,0|1,0,0]=3 2597 B4R0.1 CCC(=O)O MCULE-2199051150 [1,0,1,0,0,0|1,0,0]=3 2598 B4R0.1 CCC(=O)O MCULE-9800054040 [1,0,1,0,0,0|1,0,0]=3 2599 B4R0.1 CCC(=O)S MCULE-3392119766 [1,0,1,0,0,0|1,0,0]=3 2600 B4R0.1 CCC(=O)[O-] MCULE-6321502767 [1,0,1,0,0,0|1,0,0]=3 2601 B4R0.1 CCC(=S)N MCULE-3921479699 [1,0,1,0,0,0|1,1,0]=4 2602 B4R0.1 CCC(C)Br MCULE-9661620259 [1,0,1,0,0,0|1,0,1]=4 2603 B4R0.1 CCC(C)C MCULE-5376105936 [1,0,1,0,0,0|1,0,1]=4 2604 B4R0.1 CCC(C)Cl MCULE-2954418486 [1,0,1,0,0,0|1,0,1]=4 2605 B4R0.1 CCC(C)I MCULE-5239699587 [1,0,1,0,0,0|1,0,1]=4 2606 B4R0.1 CCC(C)N MCULE-5041676035 [1,0,1,0,0,0|1,0,1]=4 2607 B4R0.1 CCC(C)N MCULE-5835091553 [1,0,1,0,0,0|1,0,1]=4 2608 B4R0.1 CCC(C)N MCULE-6631606230 [1,0,1,0,0,0|1,0,1]=4 2609 B4R0.1 CCC(C)N MCULE-8165681721 [1,0,1,0,0,0|1,0,1]=4 2610 B4R0.1 CCC(C)O MCULE-4099350806 [1,0,1,0,0,0|0,0,2]=4 2611 B4R0.1 CCC(C)O MCULE-5005120003 [1,0,1,0,0,0|0,0,2]=4 2612 B4R0.1 CCC(C)S MCULE-4988033753 [1,0,1,0,0,0|0,1,1]=4 2613 B4R0.1 CCN(=O)=O MCULE-6603591614 [1,0,1,0,0,0|2,0,0]=4 2614 B4R0.1 CCN(C)C MCULE-5825033552 [1,0,1,0,0,0|2,0,0]=4 2615 B4R0.1 CCN(C)N MCULE-2279492356 [1,0,1,0,0,0|2,0,0]=4 2616 B4R0.1 CCN(C)N MCULE-5660338703 [1,0,1,0,0,0|2,0,0]=4 2617 B4R0.1 CCN(C)N MCULE-9839987578 [1,0,1,0,0,0|2,0,0]=4 2618 B4R0.1 CCS(=O)C MCULE-4400935745 [1,0,1,0,0,0|1,0,0]=3 2619 B4R0.1 CCS(=O)O MCULE-9872932319 [1,0,1,0,0,0|2,0,0]=4 2620 B4R0.1 CCS(=O)[O-] MCULE-4386198822 [1,0,1,0,0,0|2,0,0]=4 2621 B4R0.1 CC[C@@H](C)N MCULE-2017255826 [1,0,1,0,0,0|1,0,1]=4 2622 B4R0.1 CC[C@@H](C)N MCULE-3555707512 [1,0,1,0,0,0|1,0,1]=4 2623 B4R0.1 CC[C@@H](C)N MCULE-6783735598 [1,0,1,0,0,0|1,0,1]=4 2624 B4R0.1 CC[C@@H](C)N MCULE-7004219201 [1,0,1,0,0,0|1,0,1]=4 2625 B4R0.1 CC[C@@H](C)O MCULE-2661481448 [1,0,1,0,0,0|0,0,2]=4 2626 B4R0.1 CC[C@@H](C)O MCULE-6785232833 [1,0,1,0,0,0|0,0,2]=4 2627 B4R0.1 CC[C@H](C)N MCULE-2450201533 [1,0,1,0,0,0|1,0,1]=4 2628 B4R0.1 CC[C@H](C)N MCULE-2998961427 [1,0,1,0,0,0|1,0,1]=4 2629 B4R0.1 CC[C@H](C)N MCULE-6692190471 [1,0,1,0,0,0|1,0,1]=4 2630 B4R0.1 CC[C@H](C)N MCULE-6904795465 [1,0,1,0,0,0|1,0,1]=4 2631 B4R0.1 CC[C@H](C)O MCULE-3700911573 [1,0,1,0,0,0|0,0,2]=4 2632 B4R0.1 CC[C@H](C)O MCULE-6063716138 [1,0,1,0,0,0|0,0,2]=4 2633 B4R0.1 CNC(=O)C MCULE-2612997941 [1,0,1,0,0,0|1,0,0]=3 2634 B4R0.1 CNC(=O)Cl MCULE-7743744606 [1,0,1,0,0,0|2,0,0]=4 2635 B4R0.1 CNC(=O)N MCULE-6422331704 [1,0,1,0,0,0|2,0,0]=4 2636 B4R0.1 CNC(=S)C MCULE-8699171591 [1,0,1,0,0,0|1,1,0]=4 2637 B4R0.1 COC(=N)C MCULE-2752794913 [1,0,1,0,0,0|2,0,0]=4 2638 B4R0.1 COC(=N)C MCULE-2904991083 [1,0,1,0,0,0|2,0,0]=4 2639 B4R0.1 COC(=O)C MCULE-7368066093 [1,0,1,0,0,0|1,0,0]=3 2640 B4R0.1 COC(=O)Cl MCULE-8022274771 [1,0,1,0,0,0|2,0,0]=4 2641 B4R0.1 COC(=O)N MCULE-4070607369 [1,0,1,0,0,0|2,0,0]=4 2642 B4R0.1 CSC(=O)C MCULE-7061634598 [1,0,1,0,0,0|1,0,0]=3 2643 B4R0.1 CSC(=S)C MCULE-4836153374 [1,0,1,0,0,0|1,1,0]=4 2644 B4R0.1 CSS(=O)C MCULE-6515592458 [1,0,1,0,0,0|2,0,0]=4 2645 B4R0.1 NC(=O)CBr MCULE-9306090536 [1,0,1,0,0,0|2,0,0]=4 2646 B4R0.1 NC(=O)CCl MCULE-3241549842 [1,0,1,0,0,0|2,0,0]=4 2647 B4R0.1 NC(=O)CF MCULE-3344212657 [1,0,1,0,0,0|2,0,0]=4 2648 B4R0.1 NC(=O)CI MCULE-4217973413 [1,0,1,0,0,0|2,0,0]=4 2649 B4R0.1 NC(=O)CO MCULE-2739878376 [1,0,1,0,0,0|2,0,0]=4 2650 B4R0.1 NC(=O)CS MCULE-2639305532 [1,0,1,0,0,0|2,0,0]=4 2651 B4R0.1 NCC(=O)N MCULE-1048848056 [1,0,1,0,0,0|2,0,0]=4 2652 B4R0.1 NCC(=O)N MCULE-2174395809 [1,0,1,0,0,0|2,0,0]=4 2653 B4R0.1 NCC(=O)N MCULE-6113166250 [1,0,1,0,0,0|2,0,0]=4 2654 B4R0.1 NCC(=O)O MCULE-2415764032 [1,0,1,0,0,0|2,0,0]=4 2655 B4R0.1 NCC(=O)O MCULE-3643110755 [1,0,1,0,0,0|2,0,0]=4 2656 B4R0.1 NCC(=O)O MCULE-4349255299 [1,0,1,0,0,0|2,0,0]=4 2657 B4R0.1 NCC(=O)O MCULE-9146223615 [1,0,1,0,0,0|2,0,0]=4 2658 B4R0.1 NCC(=O)O MCULE-9701991737 [1,0,1,0,0,0|2,0,0]=4 2659 B4R0.1 NCC(=O)S MCULE-9837799864 [1,0,1,0,0,0|2,0,0]=4 2660 B4R0.1 NCC(=O)[O-] MCULE-5975202378 [1,0,1,0,0,0|2,0,0]=4 2661 B4R0.1 O=C(Br)CBr MCULE-6031858200 [1,0,1,0,0,0|2,0,0]=4 2662 B4R0.1 O=C(Cl)CBr MCULE-7684029984 [1,0,1,0,0,0|2,0,0]=4 2663 B4R0.1 O=C(Cl)CCl MCULE-7076914635 [1,0,1,0,0,0|2,0,0]=4 2664 B4R0.1 O=C(Cl)CF MCULE-7182087882 [1,0,1,0,0,0|2,0,0]=4 2665 B4R0.1 O=C(Cl)CI MCULE-5719121455 [1,0,1,0,0,0|2,0,0]=4 2666 B4R0.1 O=C(O)CBr MCULE-1503716137 [1,0,1,0,0,0|2,0,0]=4 2667 B4R0.1 O=C(O)CCl MCULE-9228754880 [1,0,1,0,0,0|2,0,0]=4 2668 B4R0.1 O=C(O)CF MCULE-6584094437 [1,0,1,0,0,0|2,0,0]=4 2669 B4R0.1 O=C(O)CI MCULE-3146792857 [1,0,1,0,0,0|2,0,0]=4 2670 B4R0.1 O=C(O)CO MCULE-9792551388 [1,0,1,0,0,0|2,0,0]=4 2671 B4R0.1 O=C(O)CS MCULE-8097997001 [1,0,1,0,0,0|2,0,0]=4 2672 B4R0.1 O=C([O-])CF MCULE-8428965857 [1,0,1,0,0,0|2,0,0]=4 2673 B4R0.1 O=C([O-])CO MCULE-2780567509 [1,0,1,0,0,0|2,0,0]=4 2674 B4R0.1 O=C([O-])CS MCULE-3314809220 [1,0,1,0,0,0|2,0,0]=4 2675 B4R0.1 O=C([O-])CS MCULE-5989133747 [1,0,1,0,0,0|2,0,0]=4 2676 B4R0.1 [NH3+]C(C)CC MCULE-3066898055 [1,0,1,0,0,0|1,0,1]=4 2677 B4R0.2 BrCCCBr MCULE-6500110480 [1,0,1,0,0,0|2,0,0]=4 2678 B4R0.2 BrCCCI MCULE-6470610840 [1,0,1,0,0,0|2,0,0]=4 2679 B4R0.2 C#CCCC MCULE-1233806896 [1,0,1,0,0,0|0,0,2]=4 2680 B4R0.2 C/C=C/C=O MCULE-9924705308 [1,0,1,0,0,0|0,0,2]=4 2681 B4R0.2 C/C=C/CCl MCULE-9977493525 [1,0,1,0,0,0|1,0,1]=4 2682 B4R0.2 C/C=C/CO MCULE-2383161163 [1,0,1,0,0,0|1,0,1]=4 2683 B4R0.2 C/C=C/OC MCULE-3906920304 [1,0,1,0,0,0|1,0,1]=4 2684 B4R0.2 C/C=C\CO MCULE-5924662327 [1,0,1,0,0,0|1,0,1]=4 2685 B4R0.2 C=C=CCC MCULE-6123315571 [1,0,1,0,0,0|0,0,2]=4 2686 B4R0.2 C=CCCBr MCULE-2890129103 [1,0,1,0,0,0|1,0,1]=4 2687 B4R0.2 C=CCCC MCULE-8386546337 [1,0,1,0,0,0|0,0,1]=3 2688 B4R0.2 C=CCCCl MCULE-5903789900 [1,0,1,0,0,0|1,0,1]=4 2689 B4R0.2 C=CCCI MCULE-1055671394 [1,0,1,0,0,0|1,0,1]=4 2690 B4R0.2 C=CCCN MCULE-2471716627 [1,0,1,0,0,0|1,0,1]=4 2691 B4R0.2 C=CCCN MCULE-2881108697 [1,0,1,0,0,0|1,0,1]=4 2692 B4R0.2 C=CCCO MCULE-4582400839 [1,0,1,0,0,0|1,0,1]=4 2693 B4R0.2 C=CCNC MCULE-3335720336 [1,0,1,0,0,0|1,0,1]=4 2694 B4R0.2 C=CCOC MCULE-3321225771 [1,0,1,0,0,0|1,0,1]=4 2695 B4R0.2 C=CCSC MCULE-4452023915 [1,0,1,0,0,0|1,0,1]=4 2696 B4R0.2 C=COCC MCULE-2569047033 [1,0,1,0,0,0|1,0,1]=4 2697 B4R0.2 C=CSCC MCULE-8927374165 [1,0,1,0,0,0|1,0,1]=4 2698 B4R0.2 CC#CC=O MCULE-9270622693 [1,0,1,0,0,0|0,0,2]=4 2699 B4R0.2 CC#CCC MCULE-8848779220 [1,0,1,0,0,0|0,0,2]=4 2700 B4R0.2 CC=CC=O MCULE-2497362981 [1,0,1,0,0,0|0,0,2]=4 2701 B4R0.2 CC=CCBr MCULE-7855581866 [1,0,1,0,0,0|1,0,1]=4 2702 B4R0.2 CC=CCC MCULE-5931905453 [1,0,1,0,0,0|0,0,1]=3 2703 B4R0.2 CC=CCCl MCULE-3941962217 [1,0,1,0,0,0|1,0,1]=4 2704 B4R0.2 CC=CCO MCULE-7490725844 [1,0,1,0,0,0|1,0,1]=4 2705 B4R0.2 CC=COC MCULE-6712403535 [1,0,1,0,0,0|1,0,1]=4 2706 B4R0.2 CC=CSC MCULE-5921906156 [1,0,1,0,0,0|1,0,1]=4 2707 B4R0.2 CCC=CBr MCULE-4471551501 [1,0,1,0,0,0|1,0,1]=4 2708 B4R0.2 CCC=NO MCULE-9457280654 [1,0,1,0,0,0|2,0,0]=4 2709 B4R0.2 CCCC#N MCULE-8571076087 [1,0,1,0,0,0|1,0,1]=4 2710 B4R0.2 CCCC=O MCULE-8530391347 [1,0,1,0,0,0|0,0,0]=2 2711 B4R0.2 CCCCBr MCULE-3390217131 [1,0,1,0,0,0|1,0,0]=3 2712 B4R0.2 CCCCC MCULE-4643148765 [1,0,1,0,0,0|0,0,1]=3 2713 B4R0.2 CCCCCl MCULE-5329900290 [1,0,1,0,0,0|1,0,0]=3 2714 B4R0.2 CCCCF MCULE-7225760858 [1,0,1,0,0,0|1,0,0]=3 2715 B4R0.2 CCCCI MCULE-1160974720 [1,0,1,0,0,0|1,0,0]=3 2716 B4R0.2 CCCCN MCULE-1731874934 [1,0,1,0,0,0|1,0,0]=3 2717 B4R0.2 CCCCN MCULE-4233278050 [1,0,1,0,0,0|1,0,0]=3 2718 B4R0.2 CCCCN MCULE-5242069370 [1,0,1,0,0,0|1,0,0]=3 2719 B4R0.2 CCCCN MCULE-7343835253 [1,0,1,0,0,0|1,0,0]=3 2720 B4R0.2 CCCCO MCULE-1571156443 [1,0,1,0,0,0|0,0,1]=3 2721 B4R0.2 CCCCS MCULE-9441213933 [1,0,1,0,0,0|0,1,0]=3 2722 B4R0.2 CCCNC MCULE-2266616259 [1,0,1,0,0,0|1,0,0]=3 2723 B4R0.2 CCCNC MCULE-7722796872 [1,0,1,0,0,0|1,0,0]=3 2724 B4R0.2 CCCNN MCULE-4121438775 [1,0,1,0,0,0|2,0,0]=4 2725 B4R0.2 CCCNN MCULE-5875592228 [1,0,1,0,0,0|2,0,0]=4 2726 B4R0.2 CCCNN MCULE-9585694661 [1,0,1,0,0,0|2,0,0]=4 2727 B4R0.2 CCCOC MCULE-5854067718 [1,0,1,0,0,0|1,0,0]=3 2728 B4R0.2 CCCON MCULE-4800172637 [1,0,1,0,0,0|2,0,0]=4 2729 B4R0.2 CCCON MCULE-7988781002 [1,0,1,0,0,0|2,0,0]=4 2730 B4R0.2 CCCSC MCULE-8387041737 [1,0,1,0,0,0|1,0,0]=3 2731 B4R0.2 CCN=C=O MCULE-6522145601 [1,0,1,0,0,0|1,0,1]=4 2732 B4R0.2 CCNC=O MCULE-9309926274 [1,0,1,0,0,0|1,0,0]=3 2733 B4R0.2 CCNCC MCULE-3395060353 [1,0,1,0,0,0|1,0,0]=3 2734 B4R0.2 CCNCC MCULE-4374609736 [1,0,1,0,0,0|1,0,0]=3 2735 B4R0.2 CCNCC MCULE-4555901025 [1,0,1,0,0,0|1,0,0]=3 2736 B4R0.2 CCNCC MCULE-6895602113 [1,0,1,0,0,0|1,0,0]=3 2737 B4R0.2 CCNOC MCULE-4797714235 [1,0,1,0,0,0|2,0,0]=4 2738 B4R0.2 CCNOC MCULE-6486167423 [1,0,1,0,0,0|2,0,0]=4 2739 B4R0.2 CCOC=N MCULE-5321655909 [1,0,1,0,0,0|2,0,0]=4 2740 B4R0.2 CCOC=N MCULE-8158357614 [1,0,1,0,0,0|2,0,0]=4 2741 B4R0.2 CCOC=O MCULE-6245072161 [1,0,1,0,0,0|1,0,0]=3 2742 B4R0.2 CCOCBr MCULE-6644755987 [1,0,1,0,0,0|2,0,0]=4 2743 B4R0.2 CCOCC MCULE-5665709021 [1,0,1,0,0,0|1,0,0]=3 2744 B4R0.2 CCOCCl MCULE-5087992840 [1,0,1,0,0,0|2,0,0]=4 2745 B4R0.2 CCONC MCULE-5446312516 [1,0,1,0,0,0|2,0,0]=4 2746 B4R0.2 CCONC MCULE-7976027802 [1,0,1,0,0,0|2,0,0]=4 2747 B4R0.2 CCSCC MCULE-6480710239 [1,0,1,0,0,0|1,0,0]=3 2748 B4R0.2 CCSCCl MCULE-3890542152 [1,0,1,0,0,0|2,0,0]=4 2749 B4R0.2 CCSSC MCULE-9430585714 [1,0,1,0,0,0|2,0,0]=4 2750 B4R0.2 CC[NH2+]CC MCULE-9899430356 [1,0,1,0,0,0|1,0,0]=3 2751 B4R0.2 CNCCBr MCULE-3708780806 [1,0,1,0,0,0|2,0,0]=4 2752 B4R0.2 CNCCBr MCULE-6840755559 [1,0,1,0,0,0|2,0,0]=4 2753 B4R0.2 CNCCCl MCULE-1666345560 [1,0,1,0,0,0|2,0,0]=4 2754 B4R0.2 CNCCCl MCULE-8215813413 [1,0,1,0,0,0|2,0,0]=4 2755 B4R0.2 CNCCF MCULE-3719880423 [1,0,1,0,0,0|2,0,0]=4 2756 B4R0.2 CNCCF MCULE-3751701745 [1,0,1,0,0,0|2,0,0]=4 2757 B4R0.2 CNCCI MCULE-7026781832 [1,0,1,0,0,0|2,0,0]=4 2758 B4R0.2 CNCCI MCULE-8892686580 [1,0,1,0,0,0|2,0,0]=4 2759 B4R0.2 CNCCN MCULE-2881688448 [1,0,1,0,0,0|2,0,0]=4 2760 B4R0.2 CNCCN MCULE-7199403269 [1,0,1,0,0,0|2,0,0]=4 2761 B4R0.2 CNCCO MCULE-7051900771 [1,0,1,0,0,0|1,0,1]=4 2762 B4R0.2 CNCCO MCULE-7934732981 [1,0,1,0,0,0|1,0,1]=4 2763 B4R0.2 CNCCS MCULE-6430516369 [1,0,1,0,0,0|1,1,0]=4 2764 B4R0.2 COCC=O MCULE-9427361019 [1,0,1,0,0,0|1,0,0]=3 2765 B4R0.2 COCCBr MCULE-8316331262 [1,0,1,0,0,0|2,0,0]=4 2766 B4R0.2 COCCCl MCULE-8886627413 [1,0,1,0,0,0|2,0,0]=4 2767 B4R0.2 COCCI MCULE-9391124374 [1,0,1,0,0,0|2,0,0]=4 2768 B4R0.2 COCCN MCULE-5051556646 [1,0,1,0,0,0|2,0,0]=4 2769 B4R0.2 COCCN MCULE-7519068386 [1,0,1,0,0,0|2,0,0]=4 2770 B4R0.2 COCCO MCULE-4751927883 [1,0,1,0,0,0|1,0,1]=4 2771 B4R0.2 COCCS MCULE-7803276094 [1,0,1,0,0,0|1,1,0]=4 2772 B4R0.2 COCOC MCULE-8559076702 [1,0,1,0,0,0|2,0,0]=4 2773 B4R0.2 CSCCBr MCULE-1684461541 [1,0,1,0,0,0|2,0,0]=4 2774 B4R0.2 CSCCCl MCULE-8593103756 [1,0,1,0,0,0|2,0,0]=4 2775 B4R0.2 CSCCN MCULE-5168245255 [1,0,1,0,0,0|2,0,0]=4 2776 B4R0.2 CSCCN MCULE-6275285732 [1,0,1,0,0,0|2,0,0]=4 2777 B4R0.2 CSCCO MCULE-9706874325 [1,0,1,0,0,0|1,0,1]=4 2778 B4R0.2 CSCSC MCULE-5603964020 [1,0,1,0,0,0|2,0,0]=4 2779 B4R0.2 ClCCCBr MCULE-7937580875 [1,0,1,0,0,0|2,0,0]=4 2780 B4R0.2 ClCCCCl MCULE-6693270397 [1,0,1,0,0,0|2,0,0]=4 2781 B4R0.2 ClCCCI MCULE-1521526833 [1,0,1,0,0,0|2,0,0]=4 2782 B4R0.2 FCCCBr MCULE-5674735753 [1,0,1,0,0,0|2,0,0]=4 2783 B4R0.2 FCCCF MCULE-1803511350 [1,0,1,0,0,0|2,0,0]=4 2784 B4R0.2 FCCCI MCULE-9287814857 [1,0,1,0,0,0|2,0,0]=4 2785 B4R0.2 ICCCI MCULE-9849754168 [1,0,1,0,0,0|2,0,0]=4 2786 B4R0.2 NCCCBr MCULE-5485748003 [1,0,1,0,0,0|2,0,0]=4 2787 B4R0.2 NCCCBr MCULE-7072709972 [1,0,1,0,0,0|2,0,0]=4 2788 B4R0.2 NCCCCl MCULE-1324157004 [1,0,1,0,0,0|2,0,0]=4 2789 B4R0.2 NCCCCl MCULE-3667248190 [1,0,1,0,0,0|2,0,0]=4 2790 B4R0.2 NCCCF MCULE-5215746973 [1,0,1,0,0,0|2,0,0]=4 2791 B4R0.2 NCCCF MCULE-8077133369 [1,0,1,0,0,0|2,0,0]=4 2792 B4R0.2 NCCCI MCULE-3534892097 [1,0,1,0,0,0|2,0,0]=4 2793 B4R0.2 NCCCI MCULE-8010453546 [1,0,1,0,0,0|2,0,0]=4 2794 B4R0.2 NCCCN MCULE-4293255820 [1,0,1,0,0,0|2,0,0]=4 2795 B4R0.2 NCCCN MCULE-5041378433 [1,0,1,0,0,0|2,0,0]=4 2796 B4R0.2 NCCCN MCULE-6944452060 [1,0,1,0,0,0|2,0,0]=4 2797 B4R0.2 NCCCN MCULE-7375662153 [1,0,1,0,0,0|2,0,0]=4 2798 B4R0.2 NCCCN MCULE-8277465929 [1,0,1,0,0,0|2,0,0]=4 2799 B4R0.2 NCCCN MCULE-9929373126 [1,0,1,0,0,0|2,0,0]=4 2800 B4R0.2 NCCCO MCULE-2851278356 [1,0,1,0,0,0|1,0,1]=4 2801 B4R0.2 NCCCO MCULE-9698089092 [1,0,1,0,0,0|1,0,1]=4 2802 B4R0.2 NCCCS MCULE-3994478020 [1,0,1,0,0,0|1,1,0]=4 2803 B4R0.2 NCCCS MCULE-7730973866 [1,0,1,0,0,0|1,1,0]=4 2804 B4R0.2 O=CCCBr MCULE-4107157458 [1,0,1,0,0,0|1,0,0]=3 2805 B4R0.2 O=CCCCl MCULE-5863929313 [1,0,1,0,0,0|1,0,0]=3 2806 B4R0.2 O=CCCI MCULE-9771140462 [1,0,1,0,0,0|1,0,0]=3 2807 B4R0.2 O=CCCO MCULE-1685289763 [1,0,1,0,0,0|1,0,0]=3 2808 B4R0.2 OCCCBr MCULE-3450011527 [1,0,1,0,0,0|1,0,1]=4 2809 B4R0.2 OCCCCl MCULE-2319230957 [1,0,1,0,0,0|1,0,1]=4 2810 B4R0.2 OCCCF MCULE-2347934403 [1,0,1,0,0,0|1,0,1]=4 2811 B4R0.2 OCCCI MCULE-5200713967 [1,0,1,0,0,0|1,0,1]=4 2812 B4R0.2 OCCCO MCULE-5166824786 [1,0,1,0,0,0|1,0,1]=4 2813 B4R0.2 OCCCS MCULE-7930164048 [1,0,1,0,0,0|1,0,1]=4 2814 B4R0.2 PCCCP MCULE-6048146071 [1,0,1,0,0,0|2,0,0]=4 2815 B4R0.2 SCCCBr MCULE-4627341228 [1,0,1,0,0,0|1,1,0]=4 2816 B4R0.2 SCCCCl MCULE-6410389127 [1,0,1,0,0,0|1,1,0]=4 2817 B4R0.2 SCCCS MCULE-8220630729 [1,0,1,0,0,0|1,1,0]=4 2818 B4R0.2 [NH2+](CC)CC MCULE-1192179232 [1,0,1,0,0,0|1,0,0]=3 2819 B6R0.1 C#CC(=O)CCC MCULE-8990254228 [0,1,1,0,0,0|0,0,1]=3 2820 B6R0.1 C#CC(=O)NCC MCULE-3703208943 [0,1,1,0,0,0|1,0,1]=4 2821 B6R0.1 C#CC(=O)OCC MCULE-3783424133 [0,1,1,0,0,0|1,0,1]=4 2822 B6R0.1 C#CCC(=O)OC MCULE-8097491486 [0,1,1,0,0,0|0,0,2]=4 2823 B6R0.1 C(=C/C(=O)CC)\C MCULE-9250312874 [0,1,1,0,0,0|0,0,2]=4 2824 B6R0.1 C/C=C/C(=O)OC MCULE-8935178488 [0,1,1,0,0,0|0,0,2]=4 2825 B6R0.1 C=C(CC)CCO MCULE-5317656776 [0,1,1,0,0,0|2,0,0]=4 2826 B6R0.1 C=CC(=O)CCC MCULE-9373104880 [0,1,1,0,0,0|0,0,1]=3 2827 B6R0.1 C=CC(=O)COC MCULE-1933195578 [0,1,1,0,0,0|1,0,1]=4 2828 B6R0.1 C=CC(=O)NCC MCULE-3515057147 [0,1,1,0,0,0|1,0,1]=4 2829 B6R0.1 C=CC(=O)OCC MCULE-9281713240 [0,1,1,0,0,0|1,0,1]=4 2830 B6R0.1 C=CC(C)CCC MCULE-2692803387 [0,1,1,0,0,0|1,0,1]=4 2831 B6R0.1 C=CCC(=O)CN MCULE-3960819679 [0,1,1,0,0,0|0,0,2]=4 2832 B6R0.1 C=CCC(=O)CN MCULE-8089375331 [0,1,1,0,0,0|0,0,2]=4 2833 B6R0.1 C=CCC(=O)NC MCULE-4823208577 [0,1,1,0,0,0|0,0,2]=4 2834 B6R0.1 C=CCC(=O)OC MCULE-5546680906 [0,1,1,0,0,0|0,0,2]=4 2835 B6R0.1 CC#CC(=O)OC MCULE-6108678475 [0,1,1,0,0,0|0,0,2]=4 2836 B6R0.1 CC/C=C(\C)/C=O MCULE-6692882718 [0,1,1,0,0,0|0,0,1]=3 2837 B6R0.1 CC=CC(=O)CC MCULE-5948495959 [0,1,1,0,0,0|0,0,2]=4 2838 B6R0.1 CC=CC(=O)OC MCULE-1093700917 [0,1,1,0,0,0|0,0,2]=4 2839 B6R0.1 CCC(=O)CC#N MCULE-6150629588 [0,1,1,0,0,0|1,0,1]=4 2840 B6R0.1 CCC(=O)CNC MCULE-3030105640 [0,1,1,0,0,0|1,0,0]=3 2841 B6R0.1 CCC(=O)CNC MCULE-6945295017 [0,1,1,0,0,0|1,0,0]=3 2842 B6R0.1 CCC(=O)COC MCULE-1087802011 [0,1,1,0,0,0|1,0,0]=3 2843 B6R0.1 CCC(=O)CSC MCULE-3230433182 [0,1,1,0,0,0|1,0,0]=3 2844 B6R0.1 CCC(=O)NOC MCULE-4440074406 [0,1,1,0,0,0|2,0,0]=4 2845 B6R0.1 CCC(=O)OCCl MCULE-6975707373 [0,1,1,0,0,0|2,0,0]=4 2846 B6R0.1 CCC/C(=N/O)/N MCULE-1101103373 [0,1,1,0,0,0|1,0,1]=4 2847 B6R0.1 CCC/C(=N/O)/N MCULE-2970638438 [0,1,1,0,0,0|1,0,1]=4 2848 B6R0.1 CCC=C(C)C=O MCULE-1636090264 [0,1,1,0,0,0|0,0,1]=3 2849 B6R0.1 CCCC(=NO)C MCULE-6437787263 [0,1,1,0,0,0|0,0,1]=3 2850 B6R0.1 CCCC(=O)CBr MCULE-6276592955 [0,1,1,0,0,0|0,0,0]=2 2851 B6R0.1 CCCC(=O)CC MCULE-7121523805 [0,1,1,0,0,0|0,0,0]=2 2852 B6R0.1 CCCC(=O)CCl MCULE-3021809695 [0,1,1,0,0,0|0,0,0]=2 2853 B6R0.1 CCCC(=O)CN MCULE-4663263123 [0,1,1,0,0,0|0,0,0]=2 2854 B6R0.1 CCCC(=O)CN MCULE-6326368932 [0,1,1,0,0,0|0,0,0]=2 2855 B6R0.1 CCCC(=O)CO MCULE-6518249412 [0,1,1,0,0,0|0,0,0]=2 2856 B6R0.1 CCCC(=O)NC MCULE-5770149071 [0,1,1,0,0,0|0,0,0]=2 2857 B6R0.1 CCCC(=O)NN MCULE-3660167295 [0,1,1,0,0,0|1,0,0]=3 2858 B6R0.1 CCCC(=O)NO MCULE-8710375368 [0,1,1,0,0,0|1,0,0]=3 2859 B6R0.1 CCCC(=O)OC MCULE-1092030267 [0,1,1,0,0,0|0,0,0]=2 2860 B6R0.1 CCCC(=O)SC MCULE-1490654381 [0,1,1,0,0,0|0,0,0]=2 2861 B6R0.1 CCCC(=S)OC MCULE-8125476093 [0,1,1,0,0,0|0,1,0]=3 2862 B6R0.1 CCCC(Br)CC MCULE-9116433502 [0,1,1,0,0,0|1,0,1]=4 2863 B6R0.1 CCCC(C)C#N MCULE-2492294131 [0,1,1,0,0,0|1,0,1]=4 2864 B6R0.1 CCCC(C)C=O MCULE-9756444218 [0,1,1,0,0,0|0,0,1]=3 2865 B6R0.1 CCCC(C)CBr MCULE-3437352091 [0,1,1,0,0,0|1,0,1]=4 2866 B6R0.1 CCCC(C)CC MCULE-7082933967 [0,1,1,0,0,0|1,0,1]=4 2867 B6R0.1 CCCC(C)CCl MCULE-2381010454 [0,1,1,0,0,0|1,0,1]=4 2868 B6R0.1 CCCC(C)CN MCULE-9552289739 [0,1,1,0,0,0|1,0,1]=4 2869 B6R0.1 CCCC(C)CO MCULE-9777250826 [0,1,1,0,0,0|0,0,2]=4 2870 B6R0.1 CCCC(C)NC MCULE-1560121168 [0,1,1,0,0,0|1,0,1]=4 2871 B6R0.1 CCCC(C)NC MCULE-2169396338 [0,1,1,0,0,0|1,0,1]=4 2872 B6R0.1 CCCC(Cl)CC MCULE-1581617529 [0,1,1,0,0,0|1,0,1]=4 2873 B6R0.1 CCCC(Cl)CCl MCULE-9464139069 [0,1,1,0,0,0|1,0,1]=4 2874 B6R0.1 CCCC(N)CC MCULE-5349906741 [0,1,1,0,0,0|1,0,1]=4 2875 B6R0.1 CCCC(N)CC MCULE-7172418373 [0,1,1,0,0,0|1,0,1]=4 2876 B6R0.1 CCCC(N)CN MCULE-8606218569 [0,1,1,0,0,0|1,0,1]=4 2877 B6R0.1 CCCC(N)CO MCULE-3404967504 [0,1,1,0,0,0|1,0,1]=4 2878 B6R0.1 CCCC(N)CO MCULE-3802448518 [0,1,1,0,0,0|1,0,1]=4 2879 B6R0.1 CCCC(N)CO MCULE-4259078445 [0,1,1,0,0,0|1,0,1]=4 2880 B6R0.1 CCCC(N)CO MCULE-6425025734 [0,1,1,0,0,0|1,0,1]=4 2881 B6R0.1 CCCC(O)CBr MCULE-5186252424 [0,1,1,0,0,0|0,0,2]=4 2882 B6R0.1 CCCC(O)CC MCULE-9504041935 [0,1,1,0,0,0|0,0,2]=4 2883 B6R0.1 CCCC(O)CCl MCULE-4737360217 [0,1,1,0,0,0|0,0,2]=4 2884 B6R0.1 CCCC(O)CN MCULE-9402934997 [0,1,1,0,0,0|0,0,2]=4 2885 B6R0.1 CCCC(O)CO MCULE-5124107719 [0,1,1,0,0,0|0,0,2]=4 2886 B6R0.1 CCCC(S)CC MCULE-1322481338 [0,1,1,0,0,0|0,1,1]=4 2887 B6R0.1 CCC[C@@H](N)CF MCULE-4702552251 [0,1,1,0,0,0|1,0,1]=4 2888 B6R0.1 CCC[C@@H](N)CF MCULE-8118043624 [0,1,1,0,0,0|1,0,1]=4 2889 B6R0.1 CCC[C@@H](N)CO MCULE-3684308356 [0,1,1,0,0,0|1,0,1]=4 2890 B6R0.1 CCC[C@@H](N)CO MCULE-4573401915 [0,1,1,0,0,0|1,0,1]=4 2891 B6R0.1 CCC[C@@H](N)CO MCULE-5502830670 [0,1,1,0,0,0|1,0,1]=4 2892 B6R0.1 CCC[C@@H](O)CC MCULE-7377135785 [0,1,1,0,0,0|0,0,2]=4 2893 B6R0.1 CCC[C@H](N)CF MCULE-7192744944 [0,1,1,0,0,0|1,0,1]=4 2894 B6R0.1 CCC[C@H](N)CF MCULE-7441387613 [0,1,1,0,0,0|1,0,1]=4 2895 B6R0.1 CCC[C@H](N)CO MCULE-4293730307 [0,1,1,0,0,0|1,0,1]=4 2896 B6R0.1 CCC[C@H](N)CO MCULE-5185063577 [0,1,1,0,0,0|1,0,1]=4 2897 B6R0.1 CCC[C@H](N)CO MCULE-5836622975 [0,1,1,0,0,0|1,0,1]=4 2898 B6R0.1 CCC[C@H](N)CO MCULE-7340014196 [0,1,1,0,0,0|1,0,1]=4 2899 B6R0.1 CCC[C@H](O)CC MCULE-2229025348 [0,1,1,0,0,0|0,0,2]=4 2900 B6R0.1 CCNC(=O)CBr MCULE-5393521747 [0,1,1,0,0,0|1,0,0]=3 2901 B6R0.1 CCNC(=O)CC MCULE-8820594723 [0,1,1,0,0,0|1,0,0]=3 2902 B6R0.1 CCNC(=O)CCl MCULE-7288703153 [0,1,1,0,0,0|1,0,0]=3 2903 B6R0.1 CCNC(=O)CN MCULE-1913543460 [0,1,1,0,0,0|1,0,0]=3 2904 B6R0.1 CCNC(=O)CN MCULE-5473845751 [0,1,1,0,0,0|1,0,0]=3 2905 B6R0.1 CCNC(=O)CO MCULE-1386307800 [0,1,1,0,0,0|1,0,0]=3 2906 B6R0.1 CCNC(=O)NC MCULE-7197803115 [0,1,1,0,0,0|1,0,0]=3 2907 B6R0.1 CCNC(=O)NN MCULE-9055200574 [0,1,1,0,0,0|2,0,0]=4 2908 B6R0.1 CCNC(=O)NO MCULE-3264850022 [0,1,1,0,0,0|2,0,0]=4 2909 B6R0.1 CCNC(=O)OC MCULE-7110705188 [0,1,1,0,0,0|1,0,0]=3 2910 B6R0.1 CCO/C(=N/O)/C MCULE-2336241507 [0,1,1,0,0,0|1,0,1]=4 2911 B6R0.1 CCO/C(=N\O)/C MCULE-7101376522 [0,1,1,0,0,0|1,0,1]=4 2912 B6R0.1 CCOC(=N)CC MCULE-4645506860 [0,1,1,0,0,0|2,0,0]=4 2913 B6R0.1 CCOC(=N)CC MCULE-9526837631 [0,1,1,0,0,0|2,0,0]=4 2914 B6R0.1 CCOC(=N)CCl MCULE-6291047852 [0,1,1,0,0,0|2,0,0]=4 2915 B6R0.1 CCOC(=N)CCl MCULE-9207251975 [0,1,1,0,0,0|2,0,0]=4 2916 B6R0.1 CCOC(=NO)C MCULE-6964305821 [0,1,1,0,0,0|1,0,1]=4 2917 B6R0.1 CCOC(=O)C#N MCULE-4506452376 [0,1,1,0,0,0|1,0,1]=4 2918 B6R0.1 CCOC(=O)C=O MCULE-3433596669 [0,1,1,0,0,0|1,0,1]=4 2919 B6R0.1 CCOC(=O)CBr MCULE-1369687761 [0,1,1,0,0,0|1,0,0]=3 2920 B6R0.1 CCOC(=O)CC MCULE-1639864693 [0,1,1,0,0,0|1,0,0]=3 2921 B6R0.1 CCOC(=O)CCl MCULE-2200524105 [0,1,1,0,0,0|1,0,0]=3 2922 B6R0.1 CCOC(=O)CF MCULE-1926097423 [0,1,1,0,0,0|1,0,0]=3 2923 B6R0.1 CCOC(=O)CI MCULE-9898762324 [0,1,1,0,0,0|1,0,0]=3 2924 B6R0.1 CCOC(=O)CN MCULE-2185173056 [0,1,1,0,0,0|1,0,0]=3 2925 B6R0.1 CCOC(=O)CN MCULE-2628607025 [0,1,1,0,0,0|1,0,0]=3 2926 B6R0.1 CCOC(=O)CO MCULE-8121340151 [0,1,1,0,0,0|1,0,0]=3 2927 B6R0.1 CCOC(=O)CS MCULE-3354026239 [0,1,1,0,0,0|1,0,0]=3 2928 B6R0.1 CCOC(=O)NC MCULE-5506841198 [0,1,1,0,0,0|1,0,0]=3 2929 B6R0.1 CCOC(=O)NN MCULE-9872948119 [0,1,1,0,0,0|2,0,0]=4 2930 B6R0.1 CCOC(=O)NO MCULE-4701193610 [0,1,1,0,0,0|2,0,0]=4 2931 B6R0.1 CCOC(=O)OC MCULE-1185162684 [0,1,1,0,0,0|1,0,0]=3 2932 B6R0.1 CCOC(=S)SC MCULE-6959447720 [0,1,1,0,0,0|1,1,0]=4 2933 B6R0.1 CCOS(=O)CC MCULE-4858180441 [0,1,1,0,0,0|2,0,0]=4 2934 B6R0.1 CCS(=O)CCCl MCULE-1910591721 [0,1,1,0,0,0|2,0,0]=4 2935 B6R0.1 CCS(=O)CCN MCULE-7201812983 [0,1,1,0,0,0|2,0,0]=4 2936 B6R0.1 CCS(=O)CCN MCULE-7831905163 [0,1,1,0,0,0|2,0,0]=4 2937 B6R0.1 CCS(=O)CCO MCULE-8290368918 [0,1,1,0,0,0|2,0,0]=4 2938 B6R0.1 CCSC(=O)CC MCULE-6361738004 [0,1,1,0,0,0|1,0,0]=3 2939 B6R0.1 CN(C=O)CCO MCULE-3588371476 [0,1,1,0,0,0|2,0,0]=4 2940 B6R0.1 CN(CCO)N=O MCULE-3975606321 [0,1,1,0,0,0|2,0,0]=4 2941 B6R0.1 CNC(=O)CC#N MCULE-2970000161 [0,1,1,0,0,0|1,0,1]=4 2942 B6R0.1 CNC(=O)CCBr MCULE-9239224841 [0,1,1,0,0,0|1,0,0]=3 2943 B6R0.1 CNC(=O)CCCl MCULE-7130866366 [0,1,1,0,0,0|1,0,0]=3 2944 B6R0.1 CNC(=O)CCN MCULE-1374127264 [0,1,1,0,0,0|1,0,0]=3 2945 B6R0.1 CNC(=O)CCN MCULE-3948893656 [0,1,1,0,0,0|1,0,0]=3 2946 B6R0.1 CNC(=O)CCO MCULE-3222339741 [0,1,1,0,0,0|1,0,0]=3 2947 B6R0.1 CNC(=O)CCS MCULE-2385806944 [0,1,1,0,0,0|1,0,0]=3 2948 B6R0.1 CNC(=O)CON MCULE-6451598359 [0,1,1,0,0,0|2,0,0]=4 2949 B6R0.1 CNC(=O)CON MCULE-8743298594 [0,1,1,0,0,0|2,0,0]=4 2950 B6R0.1 CNCC(=O)NC MCULE-4579550577 [0,1,1,0,0,0|1,0,0]=3 2951 B6R0.1 CNCC(=O)NC MCULE-7833395637 [0,1,1,0,0,0|1,0,0]=3 2952 B6R0.1 CNCC(=O)NN MCULE-8639164023 [0,1,1,0,0,0|2,0,0]=4 2953 B6R0.1 CNCC(=O)OC MCULE-1667683926 [0,1,1,0,0,0|1,0,0]=3 2954 B6R0.1 CNCC(=O)OC MCULE-5530863658 [0,1,1,0,0,0|1,0,0]=3 2955 B6R0.1 CNNC(=O)OC MCULE-4763095719 [0,1,1,0,0,0|2,0,0]=4 2956 B6R0.1 COC(=N)CCCl MCULE-1997539408 [0,1,1,0,0,0|2,0,0]=4 2957 B6R0.1 COC(=N)CCCl MCULE-2235564076 [0,1,1,0,0,0|2,0,0]=4 2958 B6R0.1 COC(=N)CCO MCULE-1904978557 [0,1,1,0,0,0|2,0,0]=4 2959 B6R0.1 COC(=N)CCO MCULE-8146089973 [0,1,1,0,0,0|2,0,0]=4 2960 B6R0.1 COC(=O)CC#N MCULE-2699345092 [0,1,1,0,0,0|1,0,1]=4 2961 B6R0.1 COC(=O)CC=O MCULE-6624474559 [0,1,1,0,0,0|1,0,1]=4 2962 B6R0.1 COC(=O)CCBr MCULE-3565567444 [0,1,1,0,0,0|1,0,0]=3 2963 B6R0.1 COC(=O)CCCl MCULE-5034007224 [0,1,1,0,0,0|1,0,0]=3 2964 B6R0.1 COC(=O)CCI MCULE-5984806612 [0,1,1,0,0,0|1,0,0]=3 2965 B6R0.1 COC(=O)CCN MCULE-2306060188 [0,1,1,0,0,0|1,0,0]=3 2966 B6R0.1 COC(=O)CCN MCULE-8245275833 [0,1,1,0,0,0|1,0,0]=3 2967 B6R0.1 COC(=O)CCO MCULE-8538834260 [0,1,1,0,0,0|1,0,0]=3 2968 B6R0.1 COC(=O)CCS MCULE-1695345183 [0,1,1,0,0,0|1,0,0]=3 2969 B6R0.1 COC(=O)CNN MCULE-3287579794 [0,1,1,0,0,0|2,0,0]=4 2970 B6R0.1 COC(=O)CNN MCULE-3838874166 [0,1,1,0,0,0|2,0,0]=4 2971 B6R0.1 COC(=O)CON MCULE-4799038238 [0,1,1,0,0,0|2,0,0]=4 2972 B6R0.1 COC(=O)CSC MCULE-6735536033 [0,1,1,0,0,0|1,0,0]=3 2973 B6R0.1 COC(=O)OCCl MCULE-7856529986 [0,1,1,0,0,0|2,0,0]=4 2974 B6R0.1 COC(=O)OCF MCULE-4705008675 [0,1,1,0,0,0|2,0,0]=4 2975 B6R0.1 COC(=O)OCI MCULE-8692720175 [0,1,1,0,0,0|2,0,0]=4 2976 B6R0.1 COCC(=N)OC MCULE-2350779439 [0,1,1,0,0,0|2,0,0]=4 2977 B6R0.1 COCC(=N)OC MCULE-7810421458 [0,1,1,0,0,0|2,0,0]=4 2978 B6R0.1 COCC(=O)CCl MCULE-7542636020 [0,1,1,0,0,0|1,0,0]=3 2979 B6R0.1 COCC(=O)NN MCULE-4127487886 [0,1,1,0,0,0|2,0,0]=4 2980 B6R0.1 COCC(=O)OC MCULE-8337685268 [0,1,1,0,0,0|1,0,0]=3 2981 B6R0.1 COCC(C)C=O MCULE-7679332713 [0,1,1,0,0,0|1,0,1]=4 2982 B6R0.1 CONC(=O)OC MCULE-9304532248 [0,1,1,0,0,0|2,0,0]=4 2983 B6R0.1 CSCC(=O)NN MCULE-8151954663 [0,1,1,0,0,0|2,0,0]=4 2984 B6R0.1 NCCC(=O)CN MCULE-3906468943 [0,1,1,0,0,0|1,0,0]=3 2985 B6R0.1 NCCC(=O)CN MCULE-9593243702 [0,1,1,0,0,0|1,0,0]=3 2986 B6R0.1 NNC(=O)CCO MCULE-6184351353 [0,1,1,0,0,0|2,0,0]=4 2987 B6R0.1 NNC(=O)CCS MCULE-9322963076 [0,1,1,0,0,0|2,0,0]=4 2988 B6R0.1 O=C(CCCl)NO MCULE-5569658108 [0,1,1,0,0,0|2,0,0]=4 2989 B6R0.1 O=C(CCl)CCCl MCULE-6460902474 [0,1,1,0,0,0|1,0,0]=3 2990 B6R0.1 O=C(CCl)NCO MCULE-9960585064 [0,1,1,0,0,0|2,0,0]=4 2991 B6R0.2 C=C(C)CC(=O)C MCULE-3534735279 [0,1,1,0,0,0|0,0,1]=3 2992 B6R0.2 C=C(C)CC(=O)O MCULE-5404023928 [0,1,1,0,0,0|1,0,1]=4 2993 B6R0.2 C=C(C)CC(C)C MCULE-5553118538 [0,1,1,0,0,0|1,0,0]=3 2994 B6R0.2 C=C(C)C[C@@H](C)O MCULE-8518319636 [0,1,1,0,0,0|1,0,0]=3 2995 B6R0.2 C=C(C)C[C@H](C)O MCULE-7139115019 [0,1,1,0,0,0|1,0,0]=3 2996 B6R0.2 C=C(C)OC(=O)C MCULE-9345377025 [0,1,1,0,0,0|1,0,1]=4 2997 B6R0.2 CC(=CC(C)C)C MCULE-5460531772 [0,1,1,0,0,0|1,0,1]=4 2998 B6R0.2 CC(=CC(C)O)C MCULE-5270694894 [0,1,1,0,0,0|1,0,1]=4 2999 B6R0.2 CC(=N)CC(=O)C MCULE-4678643052 [0,1,1,0,0,0|0,0,1]=3 3000 B6R0.2 CC(=NC(C)C)C MCULE-4174313497 [0,1,1,0,0,0|2,0,0]=4 3001 B6R0.2 CC(=O)/C=C(/C)\N MCULE-1235186190 [0,1,1,0,0,0|0,0,2]=4 3002 B6R0.2 CC(=O)/C=C(/C)\[O-] MCULE-3445340105 [0,1,1,0,0,0|0,0,2]=4 3003 B6R0.2 CC(=O)/C=C(/C)\[O-] MCULE-7833799417 [0,1,1,0,0,0|0,0,2]=4 3004 B6R0.2 CC(=O)/C=C(\C)/N MCULE-6412393370 [0,1,1,0,0,0|0,0,2]=4 3005 B6R0.2 CC(=O)C=C(C)C MCULE-4922478422 [0,1,1,0,0,0|0,0,2]=4 3006 B6R0.2 CC(=O)C=C(C)N MCULE-2247743178 [0,1,1,0,0,0|0,0,2]=4 3007 B6R0.2 CC(=O)C=C(C)O MCULE-7345258397 [0,1,1,0,0,0|0,0,2]=4 3008 B6R0.2 CC(=O)C=C(C)[O-] MCULE-7733093724 [0,1,1,0,0,0|0,0,2]=4 3009 B6R0.2 CC(=O)CC(=O)C MCULE-6481204381 [0,1,1,0,0,0|0,0,1]=3 3010 B6R0.2 CC(=O)CC(=O)N MCULE-1618058771 [0,1,1,0,0,0|1,0,1]=4 3011 B6R0.2 CC(=O)CC(=O)O MCULE-2601276539 [0,1,1,0,0,0|1,0,1]=4 3012 B6R0.2 CC(=O)CC(=O)[O-] MCULE-6317885864 [0,1,1,0,0,0|1,0,1]=4 3013 B6R0.2 CC(=O)CC(=O)[O-] MCULE-8448177875 [0,1,1,0,0,0|1,0,1]=4 3014 B6R0.2 CC(=O)CC(C)C MCULE-2172909634 [0,1,1,0,0,0|0,0,0]=2 3015 B6R0.2 CC(=O)CC(C)N MCULE-1028280795 [0,1,1,0,0,0|0,0,0]=2 3016 B6R0.2 CC(=O)CC(C)N MCULE-7911343070 [0,1,1,0,0,0|0,0,0]=2 3017 B6R0.2 CC(=O)CC(C)O MCULE-5175367575 [0,1,1,0,0,0|0,0,0]=2 3018 B6R0.2 CC(=O)CN(=O)=O MCULE-3153232896 [0,1,1,0,0,0|2,0,0]=4 3019 B6R0.2 CC(=O)CN(C)C MCULE-8561521241 [0,1,1,0,0,0|1,0,0]=3 3020 B6R0.2 CC(=O)C[C@@H](C)N MCULE-1260669737 [0,1,1,0,0,0|0,0,0]=2 3021 B6R0.2 CC(=O)C[C@@H](C)N MCULE-6556661125 [0,1,1,0,0,0|0,0,0]=2 3022 B6R0.2 CC(=O)NC(=O)C MCULE-3040534108 [0,1,1,0,0,0|1,0,1]=4 3023 B6R0.2 CC(=O)NC(C)C MCULE-2095134698 [0,1,1,0,0,0|1,0,0]=3 3024 B6R0.2 CC(=O)NN(C)C MCULE-3444969121 [0,1,1,0,0,0|2,0,0]=4 3025 B6R0.2 CC(=O)NN(C)C MCULE-5383938091 [0,1,1,0,0,0|2,0,0]=4 3026 B6R0.2 CC(=O)OC(=O)C MCULE-9184217748 [0,1,1,0,0,0|1,0,1]=4 3027 B6R0.2 CC(=O)OC(C)Br MCULE-6494616843 [0,1,1,0,0,0|1,0,0]=3 3028 B6R0.2 CC(=O)OC(C)C MCULE-6152257819 [0,1,1,0,0,0|1,0,0]=3 3029 B6R0.2 CC(=O)OC(C)Cl MCULE-3738479003 [0,1,1,0,0,0|1,0,0]=3 3030 B6R0.2 CC(=O)SC(=O)C MCULE-5749449964 [0,1,1,0,0,0|1,0,1]=4 3031 B6R0.2 CC(=O)[CH-]C(=O)C MCULE-4855074933 [0,1,1,0,0,0|0,0,2]=4 3032 B6R0.2 CC(=O)[CH-]C(=O)C MCULE-6905854247 [0,1,1,0,0,0|0,0,2]=4 3033 B6R0.2 CC(Br)CC(=O)O MCULE-3353526571 [0,1,1,0,0,0|1,0,0]=3 3034 B6R0.2 CC(Br)CC(=S)N MCULE-3013222937 [0,1,1,0,0,0|1,1,0]=4 3035 B6R0.2 CC(Br)CC(C)Br MCULE-1139583334 [0,1,1,0,0,0|1,0,1]=4 3036 B6R0.2 CC(C)CC(=N)N MCULE-1578322850 [0,1,1,0,0,0|2,0,0]=4 3037 B6R0.2 CC(C)CC(=N)N MCULE-1643115412 [0,1,1,0,0,0|2,0,0]=4 3038 B6R0.2 CC(C)CC(=N)N MCULE-9650824038 [0,1,1,0,0,0|2,0,0]=4 3039 B6R0.2 CC(C)CC(=O)Cl MCULE-8821231794 [0,1,1,0,0,0|1,0,0]=3 3040 B6R0.2 CC(C)CC(=O)N MCULE-7790849976 [0,1,1,0,0,0|1,0,0]=3 3041 B6R0.2 CC(C)CC(=O)O MCULE-5805071360 [0,1,1,0,0,0|1,0,0]=3 3042 B6R0.2 CC(C)CC(=S)N MCULE-7704222819 [0,1,1,0,0,0|1,1,0]=4 3043 B6R0.2 CC(C)CC(C)Br MCULE-1549882864 [0,1,1,0,0,0|1,0,1]=4 3044 B6R0.2 CC(C)CC(C)C MCULE-1646863110 [0,1,1,0,0,0|1,0,1]=4 3045 B6R0.2 CC(C)CC(C)I MCULE-6965017338 [0,1,1,0,0,0|1,0,1]=4 3046 B6R0.2 CC(C)CC(C)N MCULE-1144229692 [0,1,1,0,0,0|1,0,1]=4 3047 B6R0.2 CC(C)CC(C)N MCULE-5992377656 [0,1,1,0,0,0|1,0,1]=4 3048 B6R0.2 CC(C)CC(C)O MCULE-9223768698 [0,1,1,0,0,0|0,0,2]=4 3049 B6R0.2 CC(C)CN(=O)=O MCULE-1357840093 [0,1,1,0,0,0|2,0,0]=4 3050 B6R0.2 CC(C)CS(=O)[O-] MCULE-3716652382 [0,1,1,0,0,0|2,0,0]=4 3051 B6R0.2 CC(C)CS(=O)[O-] MCULE-7111094918 [0,1,1,0,0,0|2,0,0]=4 3052 B6R0.2 CC(C)C[C@@H](C)N MCULE-5902933285 [0,1,1,0,0,0|1,0,1]=4 3053 B6R0.2 CC(C)C[C@@H](C)N MCULE-7208228535 [0,1,1,0,0,0|1,0,1]=4 3054 B6R0.2 CC(C)C[C@@H](C)O MCULE-3150675602 [0,1,1,0,0,0|0,0,2]=4 3055 B6R0.2 CC(C)C[C@@H](C)O MCULE-4011042896 [0,1,1,0,0,0|0,0,2]=4 3056 B6R0.2 CC(C)NC(=O)N MCULE-2725741897 [0,1,1,0,0,0|2,0,0]=4 3057 B6R0.2 CC(C)OC(=O)Cl MCULE-3303340398 [0,1,1,0,0,0|2,0,0]=4 3058 B6R0.2 CC(C)OC(=O)N MCULE-9996500963 [0,1,1,0,0,0|2,0,0]=4 3059 B6R0.2 CC(C)SC(=O)Cl MCULE-9803882280 [0,1,1,0,0,0|2,0,0]=4 3060 B6R0.2 CC(Cl)CC(=O)Cl MCULE-3323045052 [0,1,1,0,0,0|1,0,0]=3 3061 B6R0.2 CC(Cl)CC(=O)O MCULE-1436146199 [0,1,1,0,0,0|1,0,0]=3 3062 B6R0.2 CC(Cl)CN(C)C MCULE-6738916847 [0,1,1,0,0,0|2,0,0]=4 3063 B6R0.2 CC(Cl)CN(C)C MCULE-7074789151 [0,1,1,0,0,0|2,0,0]=4 3064 B6R0.2 CC(Cl)OC(=O)Cl MCULE-8020850544 [0,1,1,0,0,0|2,0,0]=4 3065 B6R0.2 CC(F)CC(=O)O MCULE-9214258715 [0,1,1,0,0,0|1,0,0]=3 3066 B6R0.2 CC(N)CC(=O)N MCULE-8604112274 [0,1,1,0,0,0|1,0,0]=3 3067 B6R0.2 CC(N)CC(=O)N MCULE-8651032460 [0,1,1,0,0,0|1,0,0]=3 3068 B6R0.2 CC(N)CC(=O)O MCULE-2960589915 [0,1,1,0,0,0|1,0,0]=3 3069 B6R0.2 CC(N)CC(=O)O MCULE-5772407106 [0,1,1,0,0,0|1,0,0]=3 3070 B6R0.2 CC(N)CC(=O)O MCULE-7818257350 [0,1,1,0,0,0|1,0,0]=3 3071 B6R0.2 CC(N)CC(=O)O MCULE-7847644131 [0,1,1,0,0,0|1,0,0]=3 3072 B6R0.2 CC(N)CC(C)O MCULE-7772080010 [0,1,1,0,0,0|0,0,2]=4 3073 B6R0.2 CC(N)CN(C)C MCULE-4834268309 [0,1,1,0,0,0|2,0,0]=4 3074 B6R0.2 CC(N)CN(C)C MCULE-9601630435 [0,1,1,0,0,0|2,0,0]=4 3075 B6R0.2 CC(N)CS(=O)C MCULE-1278482312 [0,1,1,0,0,0|1,0,0]=3 3076 B6R0.2 CC(O)CC(=O)N MCULE-7442557911 [0,1,1,0,0,0|1,0,0]=3 3077 B6R0.2 CC(O)CC(=O)O MCULE-3566732882 [0,1,1,0,0,0|1,0,0]=3 3078 B6R0.2 CC(O)CC(=O)O MCULE-6537877725 [0,1,1,0,0,0|1,0,0]=3 3079 B6R0.2 CC(O)CC(=O)[O-] MCULE-1109368801 [0,1,1,0,0,0|1,0,0]=3 3080 B6R0.2 CC(O)CC(=O)[O-] MCULE-5681138302 [0,1,1,0,0,0|1,0,0]=3 3081 B6R0.2 CC(O)CC(C)O MCULE-1652556328 [0,1,1,0,0,0|0,0,2]=4 3082 B6R0.2 CC(O)CN(=O)=O MCULE-1592317283 [0,1,1,0,0,0|2,0,0]=4 3083 B6R0.2 CC(O)CN(C)C MCULE-6531222530 [0,1,1,0,0,0|2,0,0]=4 3084 B6R0.2 CC(O)CN(C)C MCULE-7127620454 [0,1,1,0,0,0|2,0,0]=4 3085 B6R0.2 CC(O)CN(C)N MCULE-6197492770 [0,1,1,0,0,0|2,0,0]=4 3086 B6R0.2 CC(O)CS(=O)C MCULE-2365161952 [0,1,1,0,0,0|1,0,0]=3 3087 B6R0.2 CN(C)CC(=O)Cl MCULE-2168217529 [0,1,1,0,0,0|2,0,0]=4 3088 B6R0.2 CN(C)CC(=O)Cl MCULE-6810056185 [0,1,1,0,0,0|2,0,0]=4 3089 B6R0.2 CN(C)CC(=O)N MCULE-3894706713 [0,1,1,0,0,0|2,0,0]=4 3090 B6R0.2 CN(C)CC(=O)O MCULE-2303978039 [0,1,1,0,0,0|2,0,0]=4 3091 B6R0.2 CN(C)CC(=O)O MCULE-3368936600 [0,1,1,0,0,0|2,0,0]=4 3092 B6R0.2 CN(C)CC(=O)[O-] MCULE-3077067854 [0,1,1,0,0,0|2,0,0]=4 3093 B6R0.2 C[C@@H](N)CC(=O)O MCULE-2652696372 [0,1,1,0,0,0|1,0,0]=3 3094 B6R0.2 C[C@@H](N)CC(=O)O MCULE-7054489636 [0,1,1,0,0,0|1,0,0]=3 3095 B6R0.2 C[C@@H](N)CC(=O)O MCULE-7621851215 [0,1,1,0,0,0|1,0,0]=3 3096 B6R0.2 C[C@@H](N)CC(=O)O MCULE-8671397640 [0,1,1,0,0,0|1,0,0]=3 3097 B6R0.2 C[C@@H](N)CN(C)C MCULE-2034828409 [0,1,1,0,0,0|2,0,0]=4 3098 B6R0.2 C[C@@H](N)CN(C)C MCULE-2147556460 [0,1,1,0,0,0|2,0,0]=4 3099 B6R0.2 C[C@@H](N)CN(C)C MCULE-6097836560 [0,1,1,0,0,0|2,0,0]=4 3100 B6R0.2 C[C@@H](O)CC(=O)O MCULE-2545577683 [0,1,1,0,0,0|1,0,0]=3 3101 B6R0.2 C[C@@H](O)CC(=O)O MCULE-4159227891 [0,1,1,0,0,0|1,0,0]=3 3102 B6R0.2 C[C@@H](O)CC(=O)[O-] MCULE-7081161048 [0,1,1,0,0,0|1,0,0]=3 3103 B6R0.2 C[C@@H](O)CC(=O)[O-] MCULE-7886150665 [0,1,1,0,0,0|1,0,0]=3 3104 B6R0.2 C[C@@H](O)CN(C)C MCULE-3114172439 [0,1,1,0,0,0|2,0,0]=4 3105 B6R0.2 C[C@@H](O)CN(C)C MCULE-9927679143 [0,1,1,0,0,0|2,0,0]=4 3106 B6R0.2 C[C@@H](O)C[C@@H](C)O MCULE-3504626196 [0,1,1,0,0,0|0,0,2]=4 3107 B6R0.2 C[C@@H](O)C[C@@H](C)O MCULE-4671148975 [0,1,1,0,0,0|0,0,2]=4 3108 B6R0.2 C[C@@H](O)C[C@@H](C)O MCULE-8345849773 [0,1,1,0,0,0|0,0,2]=4 3109 B6R0.2 C[C@H](Br)CC(=O)O MCULE-1601745040 [0,1,1,0,0,0|1,0,0]=3 3110 B6R0.2 C[C@H](Br)CC(=O)O MCULE-2894930407 [0,1,1,0,0,0|1,0,0]=3 3111 B6R0.2 C[C@H](N)CC(=O)O MCULE-2656839691 [0,1,1,0,0,0|1,0,0]=3 3112 B6R0.2 C[C@H](N)CC(=O)O MCULE-4695512293 [0,1,1,0,0,0|1,0,0]=3 3113 B6R0.2 C[C@H](N)CC(=O)O MCULE-5288044169 [0,1,1,0,0,0|1,0,0]=3 3114 B6R0.2 C[C@H](N)CC(=O)O MCULE-6641912058 [0,1,1,0,0,0|1,0,0]=3 3115 B6R0.2 C[C@H](N)CN(C)C MCULE-2526118342 [0,1,1,0,0,0|2,0,0]=4 3116 B6R0.2 C[C@H](N)CN(C)C MCULE-3902055308 [0,1,1,0,0,0|2,0,0]=4 3117 B6R0.2 C[C@H](N)CN(C)C MCULE-4292583182 [0,1,1,0,0,0|2,0,0]=4 3118 B6R0.2 C[C@H](O)CC(=O)O MCULE-2857686566 [0,1,1,0,0,0|1,0,0]=3 3119 B6R0.2 C[C@H](O)CC(=O)O MCULE-3362266278 [0,1,1,0,0,0|1,0,0]=3 3120 B6R0.2 C[C@H](O)CC(=O)[O-] MCULE-3624690550 [0,1,1,0,0,0|1,0,0]=3 3121 B6R0.2 C[C@H](O)CC(=O)[O-] MCULE-5550257128 [0,1,1,0,0,0|1,0,0]=3 3122 B6R0.2 C[C@H](O)CN(C)C MCULE-4542650002 [0,1,1,0,0,0|2,0,0]=4 3123 B6R0.2 C[C@H](O)CN(C)C MCULE-4717676519 [0,1,1,0,0,0|2,0,0]=4 3124 B6R0.2 C[C@H](O)C[C@H](C)O MCULE-1267135444 [0,1,1,0,0,0|0,0,2]=4 3125 B6R0.2 C[C@H](O)C[C@H](C)O MCULE-5878966333 [0,1,1,0,0,0|0,0,2]=4 3126 B6R0.2 C[S+](C)CC(=O)[O-] MCULE-1975585935 [0,1,1,0,0,0|2,0,0]=4 3127 B6R0.2 C[S+](C)CC(=O)[O-] MCULE-7679949306 [0,1,1,0,0,0|2,0,0]=4 3128 B6R0.2 NC(F)CC(=O)O MCULE-1563194776 [0,1,1,0,0,0|2,0,0]=4 3129 B6R0.2 NC(F)CC(=O)O MCULE-1655564430 [0,1,1,0,0,0|2,0,0]=4 3130 B6R0.2 O=C(O)CC(F)F MCULE-9388620099 [0,1,1,0,0,0|2,0,0]=4 3131 B6R0.3 C(C)(OC)C(=O)O MCULE-4852209230 [0,1,1,0,0,0|2,0,0]=4 3132 B6R0.3 C(N)(CO)C(=O)N MCULE-5512645571 [0,1,1,0,0,0|2,0,0]=4 3133 B6R0.3 C(N)(CO)C(=O)N MCULE-5852943337 [0,1,1,0,0,0|2,0,0]=4 3134 B6R0.3 C=C(C)C(C)CC MCULE-3736079313 [0,1,1,0,0,0|1,0,0]=3 3135 B6R0.3 C=C(CC)C(=O)O MCULE-7335567367 [0,1,1,0,0,0|1,0,1]=4 3136 B6R0.3 CC(=O)C(=O)CBr MCULE-8560925164 [0,1,1,0,0,0|1,0,1]=4 3137 B6R0.3 CC(=O)C(=O)CCl MCULE-2778551811 [0,1,1,0,0,0|1,0,1]=4 3138 B6R0.3 CC(=O)C(Br)C=O MCULE-6904531970 [0,1,1,0,0,0|1,0,1]=4 3139 B6R0.3 CC(=O)C(C)C#N MCULE-3849364002 [0,1,1,0,0,0|1,0,1]=4 3140 B6R0.3 CC(=O)C(C)C=O MCULE-7133682970 [0,1,1,0,0,0|1,0,1]=4 3141 B6R0.3 CC(=O)C(C)CO MCULE-9026658672 [0,1,1,0,0,0|1,0,0]=3 3142 B6R0.3 CC(=O)C(Cl)C#N MCULE-7984925847 [0,1,1,0,0,0|1,0,1]=4 3143 B6R0.3 CC(=O)C(N)CO MCULE-4063057020 [0,1,1,0,0,0|1,0,0]=3 3144 B6R0.3 CC(=O)[C@@H](N)CO MCULE-9046372356 [0,1,1,0,0,0|1,0,0]=3 3145 B6R0.3 CC(CBr)C(=O)O MCULE-1430003780 [0,1,1,0,0,0|2,0,0]=4 3146 B6R0.3 CC(CF)C(=O)O MCULE-7390028409 [0,1,1,0,0,0|2,0,0]=4 3147 B6R0.3 CC(CN)C(=O)O MCULE-5485986433 [0,1,1,0,0,0|2,0,0]=4 3148 B6R0.3 CC(CN)C(=O)O MCULE-5638884438 [0,1,1,0,0,0|2,0,0]=4 3149 B6R0.3 CC(CN)S(=O)C MCULE-9048112625 [0,1,1,0,0,0|2,0,0]=4 3150 B6R0.3 CC(CO)C(=O)O MCULE-2772009804 [0,1,1,0,0,0|2,0,0]=4 3151 B6R0.3 CC(CO)C(=O)[O-] MCULE-6956620176 [0,1,1,0,0,0|2,0,0]=4 3152 B6R0.3 CC(CS)C(=O)O MCULE-9982386135 [0,1,1,0,0,0|2,0,0]=4 3153 B6R0.3 CC=C(C)C(=O)C MCULE-8950290711 [0,1,1,0,0,0|0,0,2]=4 3154 B6R0.3 CCC(=C(C)C)C MCULE-7258057243 [0,1,1,0,0,0|1,0,1]=4 3155 B6R0.3 CCC(=O)C(=O)C MCULE-3065014067 [0,1,1,0,0,0|0,0,1]=3 3156 B6R0.3 CCC(=O)C(=O)O MCULE-8360398438 [0,1,1,0,0,0|1,0,1]=4 3157 B6R0.3 CCC(=O)C(=O)[O-] MCULE-7571698792 [0,1,1,0,0,0|1,0,1]=4 3158 B6R0.3 CCC(Br)C(=O)Br MCULE-2627972929 [0,1,1,0,0,0|1,0,0]=3 3159 B6R0.3 CCC(Br)C(=O)C MCULE-7759811805 [0,1,1,0,0,0|0,0,0]=2 3160 B6R0.3 CCC(Br)C(=O)Cl MCULE-1448867234 [0,1,1,0,0,0|1,0,0]=3 3161 B6R0.3 CCC(Br)C(=O)N MCULE-5823441392 [0,1,1,0,0,0|1,0,0]=3 3162 B6R0.3 CCC(Br)C(=O)O MCULE-4214463814 [0,1,1,0,0,0|1,0,0]=3 3163 B6R0.3 CCC(C)C(=N)N MCULE-4070060089 [0,1,1,0,0,0|2,0,0]=4 3164 B6R0.3 CCC(C)C(=N)N MCULE-7020524406 [0,1,1,0,0,0|2,0,0]=4 3165 B6R0.3 CCC(C)C(=O)C MCULE-5294244024 [0,1,1,0,0,0|0,0,0]=2 3166 B6R0.3 CCC(C)C(=O)Cl MCULE-3594098886 [0,1,1,0,0,0|1,0,0]=3 3167 B6R0.3 CCC(C)C(=O)N MCULE-9298244547 [0,1,1,0,0,0|1,0,0]=3 3168 B6R0.3 CCC(C)C(=O)O MCULE-5615925204 [0,1,1,0,0,0|1,0,0]=3 3169 B6R0.3 CCC(C)C(=O)O MCULE-7434436828 [0,1,1,0,0,0|1,0,0]=3 3170 B6R0.3 CCC(C)C(=S)N MCULE-9682279721 [0,1,1,0,0,0|1,1,0]=4 3171 B6R0.3 CCC(C)C(C)Br MCULE-5368409335 [0,1,1,0,0,0|1,0,1]=4 3172 B6R0.3 CCC(C)C(C)C MCULE-9189749509 [0,1,1,0,0,0|1,0,1]=4 3173 B6R0.3 CCC(C)C(C)Cl MCULE-2663176330 [0,1,1,0,0,0|1,0,1]=4 3174 B6R0.3 CCC(C)C(C)N MCULE-1056466337 [0,1,1,0,0,0|1,0,1]=4 3175 B6R0.3 CCC(C)C(C)N MCULE-1503543126 [0,1,1,0,0,0|1,0,1]=4 3176 B6R0.3 CCC(C)C(C)O MCULE-8290655999 [0,1,1,0,0,0|0,0,2]=4 3177 B6R0.3 CCC(Cl)C(=O)Cl MCULE-6260726168 [0,1,1,0,0,0|1,0,0]=3 3178 B6R0.3 CCC(Cl)C(=O)N MCULE-7941338456 [0,1,1,0,0,0|1,0,0]=3 3179 B6R0.3 CCC(Cl)C(=O)O MCULE-6325944516 [0,1,1,0,0,0|1,0,0]=3 3180 B6R0.3 CCC(F)C(=O)O MCULE-3947852767 [0,1,1,0,0,0|1,0,0]=3 3181 B6R0.3 CCC(N)C(=O)N MCULE-2662930657 [0,1,1,0,0,0|1,0,0]=3 3182 B6R0.3 CCC(N)C(=O)N MCULE-5136248706 [0,1,1,0,0,0|1,0,0]=3 3183 B6R0.3 CCC(N)C(=O)N MCULE-8876361903 [0,1,1,0,0,0|1,0,0]=3 3184 B6R0.3 CCC(N)C(=O)N MCULE-9704177556 [0,1,1,0,0,0|1,0,0]=3 3185 B6R0.3 CCC(N)C(=O)O MCULE-2132009026 [0,1,1,0,0,0|1,0,0]=3 3186 B6R0.3 CCC(N)C(=O)O MCULE-7397078475 [0,1,1,0,0,0|1,0,0]=3 3187 B6R0.3 CCC(N)C(=O)O MCULE-8052711911 [0,1,1,0,0,0|1,0,0]=3 3188 B6R0.3 CCC(N)C(=O)O MCULE-9815187967 [0,1,1,0,0,0|1,0,0]=3 3189 B6R0.3 CCC(N)C(C)C MCULE-3624338196 [0,1,1,0,0,0|1,0,1]=4 3190 B6R0.3 CCC(N)C(C)C MCULE-4491326477 [0,1,1,0,0,0|1,0,1]=4 3191 B6R0.3 CCC(N)C(C)O MCULE-2752432664 [0,1,1,0,0,0|0,0,2]=4 3192 B6R0.3 CCC(N)C(C)O MCULE-6087590428 [0,1,1,0,0,0|0,0,2]=4 3193 B6R0.3 CCC(O)C(=O)N MCULE-4290959224 [0,1,1,0,0,0|1,0,0]=3 3194 B6R0.3 CCC(O)C(=O)O MCULE-1958918710 [0,1,1,0,0,0|1,0,0]=3 3195 B6R0.3 CCC(O)C(=O)O MCULE-2006594131 [0,1,1,0,0,0|1,0,0]=3 3196 B6R0.3 CCC(O)C(=O)[O-] MCULE-5297669254 [0,1,1,0,0,0|1,0,0]=3 3197 B6R0.3 CCC(O)C(=O)[O-] MCULE-5740032698 [0,1,1,0,0,0|1,0,0]=3 3198 B6R0.3 CCC(O)C(C)C MCULE-1130775455 [0,1,1,0,0,0|1,0,1]=4 3199 B6R0.3 CCC(O)C(C)N MCULE-4027170059 [0,1,1,0,0,0|1,0,1]=4 3200 B6R0.3 CCC(O)C(C)O MCULE-1468922095 [0,1,1,0,0,0|0,0,2]=4 3201 B6R0.3 CCC(S)C(=O)C MCULE-4243782106 [0,1,1,0,0,0|0,0,0]=2 3202 B6R0.3 CCC(S)C(=O)O MCULE-9887370695 [0,1,1,0,0,0|1,0,0]=3 3203 B6R0.3 CCN(C)C(=O)C MCULE-6881823095 [0,1,1,0,0,0|1,0,0]=3 3204 B6R0.3 CCN(C)C(=O)Cl MCULE-3697487267 [0,1,1,0,0,0|2,0,0]=4 3205 B6R0.3 CCN(N)C(=O)N MCULE-8674876262 [0,1,1,0,0,0|2,0,0]=4 3206 B6R0.3 CCN(O)C(=O)C MCULE-8547381969 [0,1,1,0,0,0|1,0,0]=3 3207 B6R0.3 CC[C@@H](Br)C(=O)O MCULE-3890418201 [0,1,1,0,0,0|1,0,0]=3 3208 B6R0.3 CC[C@@H](Br)C(=O)O MCULE-5910145154 [0,1,1,0,0,0|1,0,0]=3 3209 B6R0.3 CC[C@@H](C)C(=O)N MCULE-3083676357 [0,1,1,0,0,0|1,0,0]=3 3210 B6R0.3 CC[C@@H](C)C(=O)N MCULE-4584753474 [0,1,1,0,0,0|1,0,0]=3 3211 B6R0.3 CC[C@@H](C)C(=O)O MCULE-4225604875 [0,1,1,0,0,0|1,0,0]=3 3212 B6R0.3 CC[C@@H](C)C(=O)O MCULE-6581991788 [0,1,1,0,0,0|1,0,0]=3 3213 B6R0.3 CC[C@@H](Cl)C(=O)O MCULE-2496023102 [0,1,1,0,0,0|1,0,0]=3 3214 B6R0.3 CC[C@@H](Cl)C(=O)O MCULE-9719915588 [0,1,1,0,0,0|1,0,0]=3 3215 B6R0.3 CC[C@@H](N)C(=O)N MCULE-2790345262 [0,1,1,0,0,0|1,0,0]=3 3216 B6R0.3 CC[C@@H](N)C(=O)N MCULE-3501293124 [0,1,1,0,0,0|1,0,0]=3 3217 B6R0.3 CC[C@@H](N)C(=O)N MCULE-4913204798 [0,1,1,0,0,0|1,0,0]=3 3218 B6R0.3 CC[C@@H](N)C(=O)N MCULE-5005994513 [0,1,1,0,0,0|1,0,0]=3 3219 B6R0.3 CC[C@@H](N)C(=O)O MCULE-3824768448 [0,1,1,0,0,0|1,0,0]=3 3220 B6R0.3 CC[C@@H](N)C(=O)O MCULE-7078248621 [0,1,1,0,0,0|1,0,0]=3 3221 B6R0.3 CC[C@@H](N)C(=O)O MCULE-8856363896 [0,1,1,0,0,0|1,0,0]=3 3222 B6R0.3 CC[C@@H](N)C(=O)O MCULE-9662763952 [0,1,1,0,0,0|1,0,0]=3 3223 B6R0.3 CC[C@@H](N)[C@H](C)O MCULE-8294520512 [0,1,1,0,0,0|0,0,2]=4 3224 B6R0.3 CC[C@@H](N)[C@H](C)O MCULE-9521001934 [0,1,1,0,0,0|0,0,2]=4 3225 B6R0.3 CC[C@@H](O)C(=O)O MCULE-8118182602 [0,1,1,0,0,0|1,0,0]=3 3226 B6R0.3 CC[C@@H](O)C(=O)O MCULE-9744322272 [0,1,1,0,0,0|1,0,0]=3 3227 B6R0.3 CC[C@@H](O)C(C)C MCULE-3684327261 [0,1,1,0,0,0|1,0,1]=4 3228 B6R0.3 CC[C@H](Br)C(=O)O MCULE-2859668715 [0,1,1,0,0,0|1,0,0]=3 3229 B6R0.3 CC[C@H](Br)C(=O)O MCULE-9989821197 [0,1,1,0,0,0|1,0,0]=3 3230 B6R0.3 CC[C@H](C)C(=O)O MCULE-5170193492 [0,1,1,0,0,0|1,0,0]=3 3231 B6R0.3 CC[C@H](C)C(=O)O MCULE-6595467867 [0,1,1,0,0,0|1,0,0]=3 3232 B6R0.3 CC[C@H](Cl)C(=O)O MCULE-8870390851 [0,1,1,0,0,0|1,0,0]=3 3233 B6R0.3 CC[C@H](N)C(=O)N MCULE-1934671300 [0,1,1,0,0,0|1,0,0]=3 3234 B6R0.3 CC[C@H](N)C(=O)N MCULE-3034729287 [0,1,1,0,0,0|1,0,0]=3 3235 B6R0.3 CC[C@H](N)C(=O)N MCULE-6902117665 [0,1,1,0,0,0|1,0,0]=3 3236 B6R0.3 CC[C@H](N)C(=O)N MCULE-9419812665 [0,1,1,0,0,0|1,0,0]=3 3237 B6R0.3 CC[C@H](N)C(=O)O MCULE-3597025691 [0,1,1,0,0,0|1,0,0]=3 3238 B6R0.3 CC[C@H](N)C(=O)O MCULE-5445914617 [0,1,1,0,0,0|1,0,0]=3 3239 B6R0.3 CC[C@H](N)C(=O)O MCULE-7781302707 [0,1,1,0,0,0|1,0,0]=3 3240 B6R0.3 CC[C@H](N)C(=O)O MCULE-8446392822 [0,1,1,0,0,0|1,0,0]=3 3241 B6R0.3 CC[C@H](N)C(=[Se])O MCULE-2161876558 [0,1,1,0,0,0|1,0,1]=4 3242 B6R0.3 CC[C@H](N)C(=[Se])O MCULE-6045953433 [0,1,1,0,0,0|1,0,1]=4 3243 B6R0.3 CC[C@H](N)C(C)C MCULE-3200638239 [0,1,1,0,0,0|1,0,1]=4 3244 B6R0.3 CC[C@H](N)C(C)C MCULE-4973720203 [0,1,1,0,0,0|1,0,1]=4 3245 B6R0.3 CC[C@H](N)[C@@H](C)O MCULE-1930738992 [0,1,1,0,0,0|0,0,2]=4 3246 B6R0.3 CC[C@H](N)[C@@H](C)O MCULE-4226147180 [0,1,1,0,0,0|0,0,2]=4 3247 B6R0.3 CC[C@H](N)[C@@H](C)O MCULE-7445496718 [0,1,1,0,0,0|0,0,2]=4 3248 B6R0.3 CC[C@H](N)[C@@H](C)O MCULE-9770959398 [0,1,1,0,0,0|0,0,2]=4 3249 B6R0.3 CC[C@H](N)[C@H](C)O MCULE-3878355824 [0,1,1,0,0,0|0,0,2]=4 3250 B6R0.3 CC[C@H](N)[C@H](C)O MCULE-4791160457 [0,1,1,0,0,0|0,0,2]=4 3251 B6R0.3 CC[C@H](O)C(=O)O MCULE-4284991317 [0,1,1,0,0,0|1,0,0]=3 3252 B6R0.3 CC[C@H](O)C(=O)O MCULE-6782147427 [0,1,1,0,0,0|1,0,0]=3 3253 B6R0.3 CC[C@H](O)C(=O)[O-] MCULE-6073275709 [0,1,1,0,0,0|1,0,0]=3 3254 B6R0.3 CC[C@H](O)C(C)C MCULE-9659963395 [0,1,1,0,0,0|1,0,1]=4 3255 B6R0.3 CNC(C)C(=O)N MCULE-1426280147 [0,1,1,0,0,0|2,0,0]=4 3256 B6R0.3 CNC(C)C(=O)N MCULE-2344663168 [0,1,1,0,0,0|2,0,0]=4 3257 B6R0.3 CNC(C)C(=O)O MCULE-4088114502 [0,1,1,0,0,0|2,0,0]=4 3258 B6R0.3 CNC(C)C(=O)O MCULE-7300169560 [0,1,1,0,0,0|2,0,0]=4 3259 B6R0.3 CNC(C)C(=O)O MCULE-8623956615 [0,1,1,0,0,0|2,0,0]=4 3260 B6R0.3 CN[C@@H](C)C(=O)N MCULE-3316985921 [0,1,1,0,0,0|2,0,0]=4 3261 B6R0.3 CN[C@@H](C)C(=O)O MCULE-2079366664 [0,1,1,0,0,0|2,0,0]=4 3262 B6R0.3 CN[C@@H](C)C(=O)O MCULE-4072364377 [0,1,1,0,0,0|2,0,0]=4 3263 B6R0.3 CN[C@@H](C)C(=O)O MCULE-4518259073 [0,1,1,0,0,0|2,0,0]=4 3264 B6R0.3 CN[C@@H](C)C(=O)O MCULE-8200069325 [0,1,1,0,0,0|2,0,0]=4 3265 B6R0.3 CN[C@H](C)C(=O)O MCULE-2777429698 [0,1,1,0,0,0|2,0,0]=4 3266 B6R0.3 CN[C@H](C)C(=O)O MCULE-7282734154 [0,1,1,0,0,0|2,0,0]=4 3267 B6R0.3 CN[C@H](C)C(=O)O MCULE-9709122579 [0,1,1,0,0,0|2,0,0]=4 3268 B6R0.3 COC(=O)C(=O)C MCULE-5423483210 [0,1,1,0,0,0|1,0,1]=4 3269 B6R0.3 COC(Br)C(=O)C MCULE-1220922171 [0,1,1,0,0,0|1,0,0]=3 3270 B6R0.3 COC(Br)C(=O)O MCULE-9018983840 [0,1,1,0,0,0|2,0,0]=4 3271 B6R0.3 COC(C)C(=O)C MCULE-8058502137 [0,1,1,0,0,0|1,0,0]=3 3272 B6R0.3 COC(C)C(=O)N MCULE-5955494048 [0,1,1,0,0,0|2,0,0]=4 3273 B6R0.3 COC(C)C(=O)O MCULE-8913745653 [0,1,1,0,0,0|2,0,0]=4 3274 B6R0.3 CON(C)C(=O)C MCULE-8559238750 [0,1,1,0,0,0|2,0,0]=4 3275 B6R0.3 CO[C@@H](C)C(=O)Cl MCULE-9335923061 [0,1,1,0,0,0|2,0,0]=4 3276 B6R0.3 CO[C@@H](C)C(=O)O MCULE-7456458246 [0,1,1,0,0,0|2,0,0]=4 3277 B6R0.3 CO[C@@H](C)C(=O)O MCULE-8108977564 [0,1,1,0,0,0|2,0,0]=4 3278 B6R0.3 CO[C@H](C)C(=O)O MCULE-3078851913 [0,1,1,0,0,0|2,0,0]=4 3279 B6R0.3 CO[C@H](C)C(=O)O MCULE-5370950850 [0,1,1,0,0,0|2,0,0]=4 3280 B6R0.3 CSC(C)C(=O)C MCULE-8567808254 [0,1,1,0,0,0|1,0,0]=3 3281 B6R0.3 CSC(C)C(=O)O MCULE-8062487948 [0,1,1,0,0,0|2,0,0]=4 3282 B6R0.3 C[C@@H](CN)C(=O)O MCULE-4438181090 [0,1,1,0,0,0|2,0,0]=4 3283 B6R0.3 C[C@@H](CN)C(=O)O MCULE-4599481344 [0,1,1,0,0,0|2,0,0]=4 3284 B6R0.3 C[C@@H](CN)C(=O)O MCULE-5826933618 [0,1,1,0,0,0|2,0,0]=4 3285 B6R0.3 C[C@@H](CN)C(=O)O MCULE-5914856504 [0,1,1,0,0,0|2,0,0]=4 3286 B6R0.3 C[C@@H](CO)C(=O)O MCULE-1381224499 [0,1,1,0,0,0|2,0,0]=4 3287 B6R0.3 C[C@@H](CO)C(=O)O MCULE-4599417419 [0,1,1,0,0,0|2,0,0]=4 3288 B6R0.3 C[C@H](CN)C(=O)O MCULE-3703540023 [0,1,1,0,0,0|2,0,0]=4 3289 B6R0.3 C[C@H](CN)C(=O)O MCULE-5714771083 [0,1,1,0,0,0|2,0,0]=4 3290 B6R0.3 C[C@H](CN)C(=O)O MCULE-9009901306 [0,1,1,0,0,0|2,0,0]=4 3291 B6R0.3 C[C@H](CN)C(=O)O MCULE-9217365463 [0,1,1,0,0,0|2,0,0]=4 3292 B6R0.3 C[C@H](CO)C(=O)O MCULE-7012562122 [0,1,1,0,0,0|2,0,0]=4 3293 B6R0.3 C[C@H](CO)C(=O)O MCULE-9702865885 [0,1,1,0,0,0|2,0,0]=4 3294 B6R0.3 C[C@H](CO)C(=O)[O-] MCULE-5733737039 [0,1,1,0,0,0|2,0,0]=4 3295 B6R0.3 NC(=O)C(Br)CBr MCULE-3438242131 [0,1,1,0,0,0|2,0,0]=4 3296 B6R0.3 NC(=O)C(Cl)CCl MCULE-9549750186 [0,1,1,0,0,0|2,0,0]=4 3297 B6R0.3 NC(=O)C(N)CO MCULE-4842751232 [0,1,1,0,0,0|2,0,0]=4 3298 B6R0.3 NC(=O)C(N)CO MCULE-6854366147 [0,1,1,0,0,0|2,0,0]=4 3299 B6R0.3 NC(=O)C(N)CS MCULE-3144051628 [0,1,1,0,0,0|2,0,0]=4 3300 B6R0.3 NC(=O)C(N)CS MCULE-7739536595 [0,1,1,0,0,0|2,0,0]=4 3301 B6R0.3 NC(=O)[C@@H](N)CO MCULE-2185844038 [0,1,1,0,0,0|2,0,0]=4 3302 B6R0.3 NC(=O)[C@@H](N)CO MCULE-3623516041 [0,1,1,0,0,0|2,0,0]=4 3303 B6R0.3 NC(=O)[C@@H](N)CO MCULE-6218638108 [0,1,1,0,0,0|2,0,0]=4 3304 B6R0.3 NC(=O)[C@@H](N)CS MCULE-9790378691 [0,1,1,0,0,0|2,0,0]=4 3305 B6R0.3 NC(=O)[C@H](N)CO MCULE-2061645482 [0,1,1,0,0,0|2,0,0]=4 3306 B6R0.3 NC(=O)[C@H](N)CO MCULE-5920366137 [0,1,1,0,0,0|2,0,0]=4 3307 B6R0.3 NC(=O)[C@H](N)CO MCULE-7612340519 [0,1,1,0,0,0|2,0,0]=4 3308 B6R0.3 NC(=O)[C@H](N)CO MCULE-7734326153 [0,1,1,0,0,0|2,0,0]=4 3309 B6R0.3 NC(CCl)C(=O)O MCULE-1601405489 [0,1,1,0,0,0|2,0,0]=4 3310 B6R0.3 NC(CCl)C(=O)O MCULE-3020306643 [0,1,1,0,0,0|2,0,0]=4 3311 B6R0.3 NC(CCl)C(=O)O MCULE-5440349631 [0,1,1,0,0,0|2,0,0]=4 3312 B6R0.3 NC(CF)C(=O)O MCULE-3274339636 [0,1,1,0,0,0|2,0,0]=4 3313 B6R0.3 NC(CO)C(=O)O MCULE-2425237422 [0,1,1,0,0,0|2,0,0]=4 3314 B6R0.3 NC(CO)C(=O)O MCULE-6460387318 [0,1,1,0,0,0|2,0,0]=4 3315 B6R0.3 NC(CS)C(=O)O MCULE-1666411258 [0,1,1,0,0,0|2,0,0]=4 3316 B6R0.3 NC(CS)C(=O)O MCULE-2938329352 [0,1,1,0,0,0|2,0,0]=4 3317 B6R0.3 NC(CS)C(=O)O MCULE-7203902929 [0,1,1,0,0,0|2,0,0]=4 3318 B6R0.3 NC(CS)C(=O)O MCULE-7790846545 [0,1,1,0,0,0|2,0,0]=4 3319 B6R0.3 NCC(Br)C(=O)O MCULE-2289205408 [0,1,1,0,0,0|2,0,0]=4 3320 B6R0.3 NCC(Br)C(=O)O MCULE-9361399143 [0,1,1,0,0,0|2,0,0]=4 3321 B6R0.3 NCC(F)C(=O)O MCULE-5666887061 [0,1,1,0,0,0|2,0,0]=4 3322 B6R0.3 NCC(F)C(=O)O MCULE-6134707533 [0,1,1,0,0,0|2,0,0]=4 3323 B6R0.3 NCC(N)C(=O)O MCULE-1867799207 [0,1,1,0,0,0|2,0,0]=4 3324 B6R0.3 NCC(N)C(=O)O MCULE-4853376364 [0,1,1,0,0,0|2,0,0]=4 3325 B6R0.3 NCC(N)C(=O)O MCULE-7636331821 [0,1,1,0,0,0|2,0,0]=4 3326 B6R0.3 NCC(N)C(=O)O MCULE-7735444546 [0,1,1,0,0,0|2,0,0]=4 3327 B6R0.3 NCC(N)C(=O)O MCULE-9197553017 [0,1,1,0,0,0|2,0,0]=4 3328 B6R0.3 NCC(O)C(=O)N MCULE-1543465850 [0,1,1,0,0,0|2,0,0]=4 3329 B6R0.3 NCC(O)C(=O)N MCULE-9574499203 [0,1,1,0,0,0|2,0,0]=4 3330 B6R0.3 NCC(O)C(=O)O MCULE-2137675488 [0,1,1,0,0,0|2,0,0]=4 3331 B6R0.3 NCC(O)C(=O)O MCULE-3348306437 [0,1,1,0,0,0|2,0,0]=4 3332 B6R0.3 NC[C@@H](F)C(=O)O MCULE-3544959183 [0,1,1,0,0,0|2,0,0]=4 3333 B6R0.3 NC[C@@H](F)C(=O)O MCULE-4122418685 [0,1,1,0,0,0|2,0,0]=4 3334 B6R0.3 NC[C@@H](F)C(=O)O MCULE-8592364466 [0,1,1,0,0,0|2,0,0]=4 3335 B6R0.3 NC[C@@H](F)C(=O)O MCULE-9106826144 [0,1,1,0,0,0|2,0,0]=4 3336 B6R0.3 NC[C@@H](N)C(=O)O MCULE-5363126654 [0,1,1,0,0,0|2,0,0]=4 3337 B6R0.3 NC[C@@H](N)C(=O)O MCULE-8998345978 [0,1,1,0,0,0|2,0,0]=4 3338 B6R0.3 NC[C@@H](N)C(=O)O MCULE-9125384126 [0,1,1,0,0,0|2,0,0]=4 3339 B6R0.3 NC[C@@H](O)C(=O)O MCULE-5922773276 [0,1,1,0,0,0|2,0,0]=4 3340 B6R0.3 NC[C@@H](O)C(=O)O MCULE-8921832932 [0,1,1,0,0,0|2,0,0]=4 3341 B6R0.3 NC[C@H](F)C(=O)O MCULE-2695037152 [0,1,1,0,0,0|2,0,0]=4 3342 B6R0.3 NC[C@H](F)C(=O)O MCULE-4323150722 [0,1,1,0,0,0|2,0,0]=4 3343 B6R0.3 NC[C@H](F)C(=O)O MCULE-6701791437 [0,1,1,0,0,0|2,0,0]=4 3344 B6R0.3 NC[C@H](F)C(=O)O MCULE-7674783008 [0,1,1,0,0,0|2,0,0]=4 3345 B6R0.3 NC[C@H](N)C(=O)O MCULE-1389567062 [0,1,1,0,0,0|2,0,0]=4 3346 B6R0.3 NC[C@H](N)C(=O)O MCULE-1833064192 [0,1,1,0,0,0|2,0,0]=4 3347 B6R0.3 NC[C@H](N)C(=O)O MCULE-2347369254 [0,1,1,0,0,0|2,0,0]=4 3348 B6R0.3 NC[C@H](N)C(=O)O MCULE-2781423323 [0,1,1,0,0,0|2,0,0]=4 3349 B6R0.3 NC[C@H](N)C(=O)O MCULE-6498458695 [0,1,1,0,0,0|2,0,0]=4 3350 B6R0.3 NC[C@H](N)C(=O)O MCULE-8313668715 [0,1,1,0,0,0|2,0,0]=4 3351 B6R0.3 NC[C@H](O)C(=O)O MCULE-5854124012 [0,1,1,0,0,0|2,0,0]=4 3352 B6R0.3 NC[C@H](O)C(=O)O MCULE-7536593166 [0,1,1,0,0,0|2,0,0]=4 3353 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-2896868744 [0,1,1,0,0,0|2,0,0]=4 3354 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-5799339909 [0,1,1,0,0,0|2,0,0]=4 3355 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-7445121230 [0,1,1,0,0,0|2,0,0]=4 3356 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-9137000163 [0,1,1,0,0,0|2,0,0]=4 3357 B6R0.3 N[C@@H](CO)C(=O)O MCULE-4580794842 [0,1,1,0,0,0|2,0,0]=4 3358 B6R0.3 N[C@@H](CO)C(=O)O MCULE-5604658333 [0,1,1,0,0,0|2,0,0]=4 3359 B6R0.3 N[C@@H](CO)C(=O)O MCULE-5884286841 [0,1,1,0,0,0|2,0,0]=4 3360 B6R0.3 N[C@@H](CO)C(=O)O MCULE-6118038121 [0,1,1,0,0,0|2,0,0]=4 3361 B6R0.3 N[C@@H](CS)C(=O)O MCULE-1896679526 [0,1,1,0,0,0|2,0,0]=4 3362 B6R0.3 N[C@@H](CS)C(=O)O MCULE-2206038012 [0,1,1,0,0,0|2,0,0]=4 3363 B6R0.3 N[C@@H](CS)C(=O)O MCULE-6337217524 [0,1,1,0,0,0|2,0,0]=4 3364 B6R0.3 N[C@@H](CS)C(=O)O MCULE-9685479191 [0,1,1,0,0,0|2,0,0]=4 3365 B6R0.3 N[C@H](CCl)C(=O)O MCULE-2647266636 [0,1,1,0,0,0|2,0,0]=4 3366 B6R0.3 N[C@H](CCl)C(=O)O MCULE-7797369596 [0,1,1,0,0,0|2,0,0]=4 3367 B6R0.3 N[C@H](CCl)C(=O)O MCULE-8133148482 [0,1,1,0,0,0|2,0,0]=4 3368 B6R0.3 N[C@H](CCl)C(=O)O MCULE-9324545858 [0,1,1,0,0,0|2,0,0]=4 3369 B6R0.3 N[C@H](CF)C(=O)O MCULE-4766495272 [0,1,1,0,0,0|2,0,0]=4 3370 B6R0.3 N[C@H](CF)C(=O)O MCULE-7679315401 [0,1,1,0,0,0|2,0,0]=4 3371 B6R0.3 N[C@H](CO)C(=O)O MCULE-3271603208 [0,1,1,0,0,0|2,0,0]=4 3372 B6R0.3 N[C@H](CO)C(=O)O MCULE-8560981570 [0,1,1,0,0,0|2,0,0]=4 3373 B6R0.3 N[C@H](CS)C(=O)O MCULE-2137827959 [0,1,1,0,0,0|2,0,0]=4 3374 B6R0.3 N[C@H](CS)C(=O)O MCULE-4521387126 [0,1,1,0,0,0|2,0,0]=4 3375 B6R0.3 N[C@H](CS)C(=O)O MCULE-7201506202 [0,1,1,0,0,0|2,0,0]=4 3376 B6R0.3 N[C@H](CS)C(=O)O MCULE-9147562606 [0,1,1,0,0,0|2,0,0]=4 3377 B6R0.3 O=C(Cl)C(Br)CBr MCULE-8490174834 [0,1,1,0,0,0|2,0,0]=4 3378 B6R0.3 O=C(Cl)C(Cl)CCl MCULE-5571003994 [0,1,1,0,0,0|2,0,0]=4 3379 B6R0.3 O=C(O)C(Br)CBr MCULE-9991448725 [0,1,1,0,0,0|2,0,0]=4 3380 B6R0.3 O=C(O)C(Br)CF MCULE-6577995297 [0,1,1,0,0,0|2,0,0]=4 3381 B6R0.3 O=C(O)C(Br)CO MCULE-9060407295 [0,1,1,0,0,0|2,0,0]=4 3382 B6R0.3 O=C(O)C(Cl)CCl MCULE-4757238565 [0,1,1,0,0,0|2,0,0]=4 3383 B6R0.3 O=C(O)C(Cl)CO MCULE-3671026398 [0,1,1,0,0,0|2,0,0]=4 3384 B6R0.3 O=C(O)C(F)CF MCULE-4323199927 [0,1,1,0,0,0|2,0,0]=4 3385 B6R0.3 O=C(O)C(O)CBr MCULE-2600199692 [0,1,1,0,0,0|2,0,0]=4 3386 B6R0.3 O=C(O)C(O)CCl MCULE-6346810624 [0,1,1,0,0,0|2,0,0]=4 3387 B6R0.3 O=C(O)C(O)CO MCULE-3634533503 [0,1,1,0,0,0|2,0,0]=4 3388 B6R0.3 O=C(O)[C@@H](Br)CO MCULE-4486884639 [0,1,1,0,0,0|2,0,0]=4 3389 B6R0.3 O=C(O)[C@@H](Br)CO MCULE-8586594526 [0,1,1,0,0,0|2,0,0]=4 3390 B6R0.3 O=C(O)[C@@H](O)CCl MCULE-4927034524 [0,1,1,0,0,0|2,0,0]=4 3391 B6R0.3 O=C(O)[C@@H](O)CO MCULE-4917119993 [0,1,1,0,0,0|2,0,0]=4 3392 B6R0.3 O=C(O)[C@@H](O)CO MCULE-7996851129 [0,1,1,0,0,0|2,0,0]=4 3393 B6R0.3 O=C(O)[C@H](Br)CO MCULE-3770944978 [0,1,1,0,0,0|2,0,0]=4 3394 B6R0.3 O=C(O)[C@H](Br)CO MCULE-6926119866 [0,1,1,0,0,0|2,0,0]=4 3395 B6R0.3 O=C(O)[C@H](O)CF MCULE-4453713074 [0,1,1,0,0,0|2,0,0]=4 3396 B6R0.3 O=C([O-])[C@@H](O)CO MCULE-4498291090 [0,1,1,0,0,0|2,0,0]=4 3397 B6R0.3 [C@@H](N)(CN)C(=O)O MCULE-2844054083 [0,1,1,0,0,0|2,0,0]=4 3398 B6R0.3 [C@H](C)(NC)C(=O)O MCULE-3677465746 [0,1,1,0,0,0|2,0,0]=4 3399 B6R0.3 [C@H](N)(CO)C(=O)N MCULE-2792784400 [0,1,1,0,0,0|2,0,0]=4 3400 B6R0.3 [C@H](S)(CC)C(=O)O MCULE-4267293279 [0,1,1,0,0,0|1,0,0]=3 3401 B6R0.3 [SeH]C[C@H](N)C(=O)O MCULE-8205075370 [0,1,1,0,0,0|2,0,0]=4 3402 B6R0.4 C#CCCC(=O)C MCULE-8723638688 [0,1,1,0,0,0|0,0,1]=3 3403 B6R0.4 C#CCCC(=O)Cl MCULE-5720262741 [0,1,1,0,0,0|1,0,1]=4 3404 B6R0.4 C#CCCC(=O)N MCULE-4490482235 [0,1,1,0,0,0|1,0,1]=4 3405 B6R0.4 C#CCCC(=O)O MCULE-6669146060 [0,1,1,0,0,0|1,0,1]=4 3406 B6R0.4 C#CCCC(=O)[O-] MCULE-2972869840 [0,1,1,0,0,0|1,0,1]=4 3407 B6R0.4 C#CCNC(=O)C MCULE-1159984782 [0,1,1,0,0,0|0,0,2]=4 3408 B6R0.4 C#CCOC(=O)C MCULE-5002994323 [0,1,1,0,0,0|0,0,2]=4 3409 B6R0.4 C/C=C/CC(=O)Cl MCULE-5377125313 [0,1,1,0,0,0|1,0,1]=4 3410 B6R0.4 C/C=C/CC(=O)N MCULE-1942934157 [0,1,1,0,0,0|1,0,1]=4 3411 B6R0.4 C/C=C/CC(=O)O MCULE-4626577048 [0,1,1,0,0,0|1,0,1]=4 3412 B6R0.4 C=C(C)CCC#N MCULE-9953519474 [0,1,1,0,0,0|1,0,1]=4 3413 B6R0.4 C=C(C)CCCBr MCULE-5063918467 [0,1,1,0,0,0|1,0,0]=3 3414 B6R0.4 C=C(C)CCCC MCULE-1010177756 [0,1,1,0,0,0|1,0,0]=3 3415 B6R0.4 C=C(C)CCCO MCULE-4629274490 [0,1,1,0,0,0|1,0,0]=3 3416 B6R0.4 C=C(C)CNCC MCULE-2237759977 [0,1,1,0,0,0|1,0,0]=3 3417 B6R0.4 C=C(Cl)CCCCl MCULE-5713882356 [0,1,1,0,0,0|1,0,1]=4 3418 B6R0.4 C=C(F)CCCO MCULE-1688645687 [0,1,1,0,0,0|1,0,1]=4 3419 B6R0.4 C=CCCC(=C)C MCULE-2323382963 [0,1,1,0,0,0|1,0,1]=4 3420 B6R0.4 C=CCCC(=O)C MCULE-9598399930 [0,1,1,0,0,0|0,0,1]=3 3421 B6R0.4 C=CCCC(=O)Cl MCULE-7378353157 [0,1,1,0,0,0|1,0,1]=4 3422 B6R0.4 C=CCCC(=O)N MCULE-7202462484 [0,1,1,0,0,0|1,0,1]=4 3423 B6R0.4 C=CCCC(=O)O MCULE-6221951425 [0,1,1,0,0,0|1,0,1]=4 3424 B6R0.4 C=CCNC(=O)C MCULE-7903624915 [0,1,1,0,0,0|0,0,2]=4 3425 B6R0.4 C=CCOC(=O)C MCULE-9991130828 [0,1,1,0,0,0|0,0,2]=4 3426 B6R0.4 CC#CCC(=O)O MCULE-8576178825 [0,1,1,0,0,0|1,0,1]=4 3427 B6R0.4 CC(=CCCBr)C MCULE-9403575147 [0,1,1,0,0,0|1,0,1]=4 3428 B6R0.4 CC(=CCCN)C MCULE-9185531904 [0,1,1,0,0,0|1,0,1]=4 3429 B6R0.4 CC(=CCCO)C MCULE-2493404466 [0,1,1,0,0,0|1,0,1]=4 3430 B6R0.4 CC(=CCCO)C MCULE-8497528596 [0,1,1,0,0,0|1,0,1]=4 3431 B6R0.4 CC(=O)CCC#N MCULE-6810756363 [0,1,1,0,0,0|0,0,1]=3 3432 B6R0.4 CC(=O)CCC=O MCULE-4767690464 [0,1,1,0,0,0|0,0,1]=3 3433 B6R0.4 CC(=O)CCCBr MCULE-7143092097 [0,1,1,0,0,0|0,0,0]=2 3434 B6R0.4 CC(=O)CCCCl MCULE-7158553745 [0,1,1,0,0,0|0,0,0]=2 3435 B6R0.4 CC(=O)CCCO MCULE-1335342150 [0,1,1,0,0,0|0,0,0]=2 3436 B6R0.4 CC(=O)CSC#N MCULE-5774397655 [0,1,1,0,0,0|1,0,1]=4 3437 B6R0.4 CC(=O)NCC#N MCULE-2345227602 [0,1,1,0,0,0|1,0,1]=4 3438 B6R0.4 CC(=O)NCCCl MCULE-7865062188 [0,1,1,0,0,0|1,0,0]=3 3439 B6R0.4 CC(=O)NCCN MCULE-2230084818 [0,1,1,0,0,0|1,0,0]=3 3440 B6R0.4 CC(=O)NCCO MCULE-5968518415 [0,1,1,0,0,0|1,0,0]=3 3441 B6R0.4 CC(=O)NCCS MCULE-3345813615 [0,1,1,0,0,0|1,0,0]=3 3442 B6R0.4 CC(=O)OCC#N MCULE-4866082576 [0,1,1,0,0,0|1,0,1]=4 3443 B6R0.4 CC(=O)OCCBr MCULE-3760449773 [0,1,1,0,0,0|1,0,0]=3 3444 B6R0.4 CC(=O)OCCCl MCULE-4570139017 [0,1,1,0,0,0|1,0,0]=3 3445 B6R0.4 CC(=O)OCCN MCULE-4530529900 [0,1,1,0,0,0|1,0,0]=3 3446 B6R0.4 CC(=O)OCCN MCULE-6854340494 [0,1,1,0,0,0|1,0,0]=3 3447 B6R0.4 CC(=O)OCCO MCULE-1251660436 [0,1,1,0,0,0|1,0,0]=3 3448 B6R0.4 CC(=O)SCC#N MCULE-5864559051 [0,1,1,0,0,0|1,0,1]=4 3449 B6R0.4 CC(=O)SCCBr MCULE-1786480878 [0,1,1,0,0,0|1,0,0]=3 3450 B6R0.4 CC(=O)SCCN MCULE-3819903256 [0,1,1,0,0,0|1,0,0]=3 3451 B6R0.4 CC(=O)SCCN MCULE-4872130470 [0,1,1,0,0,0|1,0,0]=3 3452 B6R0.4 CC(=O)SCCN MCULE-7084821345 [0,1,1,0,0,0|1,0,0]=3 3453 B6R0.4 CC(Br)CCCBr MCULE-8808667049 [0,1,1,0,0,0|1,0,1]=4 3454 B6R0.4 CC(C)CCCBr MCULE-2045625937 [0,1,1,0,0,0|1,0,1]=4 3455 B6R0.4 CC(C)CCCCl MCULE-4841628592 [0,1,1,0,0,0|1,0,1]=4 3456 B6R0.4 CC(C)CCCI MCULE-4035616717 [0,1,1,0,0,0|1,0,1]=4 3457 B6R0.4 CC(C)CCCN MCULE-2232715676 [0,1,1,0,0,0|1,0,1]=4 3458 B6R0.4 CC(C)CCCN MCULE-7121372197 [0,1,1,0,0,0|1,0,1]=4 3459 B6R0.4 CC(C)CCCO MCULE-5797993948 [0,1,1,0,0,0|1,0,1]=4 3460 B6R0.4 CC(C)CCCS MCULE-8417191578 [0,1,1,0,0,0|1,0,1]=4 3461 B6R0.4 CC(Cl)CCCCl MCULE-9382073752 [0,1,1,0,0,0|1,0,1]=4 3462 B6R0.4 CC(Cl)CCCO MCULE-2554250532 [0,1,1,0,0,0|1,0,1]=4 3463 B6R0.4 CC(N)CCCN MCULE-4857113826 [0,1,1,0,0,0|1,0,1]=4 3464 B6R0.4 CC(N)CCCN MCULE-4899798325 [0,1,1,0,0,0|1,0,1]=4 3465 B6R0.4 CC(N)CCCO MCULE-6629535696 [0,1,1,0,0,0|1,0,1]=4 3466 B6R0.4 CC(O)CCCBr MCULE-5477662754 [0,1,1,0,0,0|0,0,2]=4 3467 B6R0.4 CC(O)CCCCl MCULE-6993728810 [0,1,1,0,0,0|0,0,2]=4 3468 B6R0.4 CC(O)CCCN MCULE-3754805134 [0,1,1,0,0,0|0,0,2]=4 3469 B6R0.4 CC(O)CCCO MCULE-6580326052 [0,1,1,0,0,0|0,0,2]=4 3470 B6R0.4 CC/C=C/C(=O)Cl MCULE-8929214872 [0,1,1,0,0,0|1,0,1]=4 3471 B6R0.4 CC/C=C/C(=O)O MCULE-4888215476 [0,1,1,0,0,0|1,0,1]=4 3472 B6R0.4 CC=CCC(=O)O MCULE-9174714653 [0,1,1,0,0,0|1,0,1]=4 3473 B6R0.4 CCC#CC(=O)C MCULE-7788224704 [0,1,1,0,0,0|0,0,1]=3 3474 B6R0.4 CCC#CC(=O)O MCULE-1053283381 [0,1,1,0,0,0|1,0,1]=4 3475 B6R0.4 CCC=CC(=O)C MCULE-2986269826 [0,1,1,0,0,0|0,0,1]=3 3476 B6R0.4 CCC=CC(=O)Cl MCULE-5159865849 [0,1,1,0,0,0|1,0,1]=4 3477 B6R0.4 CCC=CC(=O)O MCULE-3920494238 [0,1,1,0,0,0|1,0,1]=4 3478 B6R0.4 CCCC=C(C)C MCULE-2110588796 [0,1,1,0,0,0|1,0,0]=3 3479 B6R0.4 CCCCC(=N)N MCULE-3271993509 [0,1,1,0,0,0|2,0,0]=4 3480 B6R0.4 CCCCC(=N)N MCULE-3935017760 [0,1,1,0,0,0|2,0,0]=4 3481 B6R0.4 CCCCC(=O)Br MCULE-2980405081 [0,1,1,0,0,0|1,0,0]=3 3482 B6R0.4 CCCCC(=O)C MCULE-3554390184 [0,1,1,0,0,0|0,0,0]=2 3483 B6R0.4 CCCCC(=O)Cl MCULE-3875407102 [0,1,1,0,0,0|1,0,0]=3 3484 B6R0.4 CCCCC(=O)N MCULE-6419483436 [0,1,1,0,0,0|1,0,0]=3 3485 B6R0.4 CCCCC(=O)O MCULE-2333640078 [0,1,1,0,0,0|1,0,0]=3 3486 B6R0.4 CCCCC(=O)[O-] MCULE-4817107962 [0,1,1,0,0,0|1,0,0]=3 3487 B6R0.4 CCCCC(=S)N MCULE-8236760762 [0,1,1,0,0,0|1,1,0]=4 3488 B6R0.4 CCCCC(C)Br MCULE-3252474574 [0,1,1,0,0,0|1,0,1]=4 3489 B6R0.4 CCCCC(C)C MCULE-7568461039 [0,1,1,0,0,0|1,0,1]=4 3490 B6R0.4 CCCCC(C)Cl MCULE-4825682003 [0,1,1,0,0,0|1,0,1]=4 3491 B6R0.4 CCCCC(C)N MCULE-5349371506 [0,1,1,0,0,0|1,0,1]=4 3492 B6R0.4 CCCCC(C)N MCULE-6696490028 [0,1,1,0,0,0|1,0,1]=4 3493 B6R0.4 CCCCC(C)O MCULE-6558228722 [0,1,1,0,0,0|0,0,2]=4 3494 B6R0.4 CCCCC(C)S MCULE-4791681848 [0,1,1,0,0,0|0,1,1]=4 3495 B6R0.4 CCCCN(=O)=O MCULE-7679767771 [0,1,1,0,0,0|2,0,0]=4 3496 B6R0.4 CCCCN(C)C MCULE-7202077639 [0,1,1,0,0,0|2,0,0]=4 3497 B6R0.4 CCCCN(C)N MCULE-7927159797 [0,1,1,0,0,0|2,0,0]=4 3498 B6R0.4 CCCCS(=O)[O-] MCULE-4347348762 [0,1,1,0,0,0|2,0,0]=4 3499 B6R0.4 CCCCS(=O)[O-] MCULE-8153578421 [0,1,1,0,0,0|2,0,0]=4 3500 B6R0.4 CCCC[C@@H](C)N MCULE-2673058676 [0,1,1,0,0,0|1,0,1]=4 3501 B6R0.4 CCCC[C@@H](C)N MCULE-7666196055 [0,1,1,0,0,0|1,0,1]=4 3502 B6R0.4 CCCC[C@@H](C)O MCULE-3149375333 [0,1,1,0,0,0|0,0,2]=4 3503 B6R0.4 CCCC[C@@H](C)O MCULE-5463481348 [0,1,1,0,0,0|0,0,2]=4 3504 B6R0.4 CCCC[C@H](C)N MCULE-6212068145 [0,1,1,0,0,0|1,0,1]=4 3505 B6R0.4 CCCC[C@H](C)N MCULE-7818513999 [0,1,1,0,0,0|1,0,1]=4 3506 B6R0.4 CCCC[C@H](C)O MCULE-1658952902 [0,1,1,0,0,0|0,0,2]=4 3507 B6R0.4 CCCC[C@H](C)O MCULE-7987243522 [0,1,1,0,0,0|0,0,2]=4 3508 B6R0.4 CCCNC(=N)N MCULE-6381843991 [0,1,1,0,0,0|2,0,0]=4 3509 B6R0.4 CCCNC(=N)N MCULE-8286774592 [0,1,1,0,0,0|2,0,0]=4 3510 B6R0.4 CCCNC(=O)C MCULE-5899703886 [0,1,1,0,0,0|0,0,0]=2 3511 B6R0.4 CCCNC(=O)Cl MCULE-2937184966 [0,1,1,0,0,0|1,0,0]=3 3512 B6R0.4 CCCNC(=O)N MCULE-8528844765 [0,1,1,0,0,0|1,0,0]=3 3513 B6R0.4 CCCNC(=S)N MCULE-3142756488 [0,1,1,0,0,0|1,1,0]=4 3514 B6R0.4 CCCNC(C)C MCULE-7475023734 [0,1,1,0,0,0|1,0,1]=4 3515 B6R0.4 CCCOC(=O)C MCULE-7327042566 [0,1,1,0,0,0|0,0,0]=2 3516 B6R0.4 CCCOC(=O)Cl MCULE-1312686139 [0,1,1,0,0,0|1,0,0]=3 3517 B6R0.4 CCCOC(=O)N MCULE-2760622567 [0,1,1,0,0,0|1,0,0]=3 3518 B6R0.4 CCCOC(=S)[S-] MCULE-9126934993 [0,1,1,0,0,0|1,1,0]=4 3519 B6R0.4 CCCOC(=S)[S-] MCULE-9566804941 [0,1,1,0,0,0|1,1,0]=4 3520 B6R0.4 CCCON(=O)=O MCULE-3372904250 [0,1,1,0,0,0|2,0,0]=4 3521 B6R0.4 CCCSC(=N)N MCULE-4777505658 [0,1,1,0,0,0|2,0,0]=4 3522 B6R0.4 CCCSC(=N)N MCULE-8873393921 [0,1,1,0,0,0|2,0,0]=4 3523 B6R0.4 CCCSC(=O)C MCULE-4329646671 [0,1,1,0,0,0|0,0,0]=2 3524 B6R0.4 CCCSC(=O)Cl MCULE-5971141999 [0,1,1,0,0,0|1,0,0]=3 3525 B6R0.4 CCCSC(=[NH2+])N MCULE-6759252204 [0,1,1,0,0,0|2,0,0]=4 3526 B6R0.4 CCCSC(C)C MCULE-2233656285 [0,1,1,0,0,0|1,0,1]=4 3527 B6R0.4 CCNCC(=O)C MCULE-5799315547 [0,1,1,0,0,0|0,0,0]=2 3528 B6R0.4 CCNCC(=O)C MCULE-9258294157 [0,1,1,0,0,0|0,0,0]=2 3529 B6R0.4 CCNCC(=O)N MCULE-1787248899 [0,1,1,0,0,0|1,0,0]=3 3530 B6R0.4 CCNCC(=O)N MCULE-3821700273 [0,1,1,0,0,0|1,0,0]=3 3531 B6R0.4 CCNCC(=O)O MCULE-5989480216 [0,1,1,0,0,0|1,0,0]=3 3532 B6R0.4 CCNCC(=O)O MCULE-8087863397 [0,1,1,0,0,0|1,0,0]=3 3533 B6R0.4 CCNCC(C)C MCULE-1625905125 [0,1,1,0,0,0|1,0,1]=4 3534 B6R0.4 CCNCC(C)C MCULE-3527739859 [0,1,1,0,0,0|1,0,1]=4 3535 B6R0.4 CCNCC(C)O MCULE-5078068369 [0,1,1,0,0,0|0,0,2]=4 3536 B6R0.4 CCNC[C@@H](C)O MCULE-4291219061 [0,1,1,0,0,0|0,0,2]=4 3537 B6R0.4 CCNC[C@@H](C)O MCULE-8603386701 [0,1,1,0,0,0|0,0,2]=4 3538 B6R0.4 CCNC[C@H](C)O MCULE-7173470231 [0,1,1,0,0,0|0,0,2]=4 3539 B6R0.4 CCNC[C@H](C)O MCULE-9651301254 [0,1,1,0,0,0|0,0,2]=4 3540 B6R0.4 CCOCC(=N)N MCULE-3232806707 [0,1,1,0,0,0|2,0,0]=4 3541 B6R0.4 CCOCC(=N)N MCULE-4996987536 [0,1,1,0,0,0|2,0,0]=4 3542 B6R0.4 CCOCC(=O)C MCULE-2825677443 [0,1,1,0,0,0|0,0,0]=2 3543 B6R0.4 CCOCC(=O)Cl MCULE-2172268229 [0,1,1,0,0,0|1,0,0]=3 3544 B6R0.4 CCOCC(=O)O MCULE-1726530898 [0,1,1,0,0,0|1,0,0]=3 3545 B6R0.4 CCOCC(=S)N MCULE-7064672670 [0,1,1,0,0,0|1,1,0]=4 3546 B6R0.4 CCOCC(C)C MCULE-7986128672 [0,1,1,0,0,0|1,0,1]=4 3547 B6R0.4 CCOCC(C)N MCULE-8540668261 [0,1,1,0,0,0|1,0,1]=4 3548 B6R0.4 CCOCC(C)N MCULE-8720228996 [0,1,1,0,0,0|1,0,1]=4 3549 B6R0.4 CCOCC(C)O MCULE-6224339526 [0,1,1,0,0,0|0,0,2]=4 3550 B6R0.4 CCOC[C@@H](C)N MCULE-7053460047 [0,1,1,0,0,0|1,0,1]=4 3551 B6R0.4 CCOC[C@@H](C)N MCULE-9865800502 [0,1,1,0,0,0|1,0,1]=4 3552 B6R0.4 CCOC[C@@H](C)O MCULE-9075407512 [0,1,1,0,0,0|0,0,2]=4 3553 B6R0.4 CCOC[C@H](C)N MCULE-2897416804 [0,1,1,0,0,0|1,0,1]=4 3554 B6R0.4 CCOC[C@H](C)N MCULE-6799267946 [0,1,1,0,0,0|1,0,1]=4 3555 B6R0.4 CCSCC(=O)C MCULE-9872082780 [0,1,1,0,0,0|0,0,0]=2 3556 B6R0.4 CCSCC(=O)O MCULE-7471335718 [0,1,1,0,0,0|1,0,0]=3 3557 B6R0.4 CCSCC(C)N MCULE-3399255190 [0,1,1,0,0,0|1,0,1]=4 3558 B6R0.4 CN(C)CCCBr MCULE-2862944726 [0,1,1,0,0,0|2,0,0]=4 3559 B6R0.4 CN(C)CCCBr MCULE-4596026048 [0,1,1,0,0,0|2,0,0]=4 3560 B6R0.4 CN(C)CCCBr MCULE-7515880350 [0,1,1,0,0,0|2,0,0]=4 3561 B6R0.4 CN(C)CCCCl MCULE-1347366200 [0,1,1,0,0,0|2,0,0]=4 3562 B6R0.4 CN(C)CCCCl MCULE-3767329555 [0,1,1,0,0,0|2,0,0]=4 3563 B6R0.4 CN(C)CCCI MCULE-2134226049 [0,1,1,0,0,0|2,0,0]=4 3564 B6R0.4 CN(C)CCCI MCULE-2999516061 [0,1,1,0,0,0|2,0,0]=4 3565 B6R0.4 CN(C)CCCN MCULE-3882436382 [0,1,1,0,0,0|2,0,0]=4 3566 B6R0.4 CN(C)CCCN MCULE-4415270662 [0,1,1,0,0,0|2,0,0]=4 3567 B6R0.4 CN(C)CCCN MCULE-4624916051 [0,1,1,0,0,0|2,0,0]=4 3568 B6R0.4 CN(C)CCCN MCULE-4749435878 [0,1,1,0,0,0|2,0,0]=4 3569 B6R0.4 CN(C)CCCN MCULE-9301668058 [0,1,1,0,0,0|2,0,0]=4 3570 B6R0.4 CN(C)CCCO MCULE-7408728427 [0,1,1,0,0,0|2,0,0]=4 3571 B6R0.4 CN(C)CCCS MCULE-7945161812 [0,1,1,0,0,0|2,0,0]=4 3572 B6R0.4 CNCCC(=O)N MCULE-1118876220 [0,1,1,0,0,0|1,0,0]=3 3573 B6R0.4 CNCCC(=O)N MCULE-6679713144 [0,1,1,0,0,0|1,0,0]=3 3574 B6R0.4 CNCCC(=O)O MCULE-3627988097 [0,1,1,0,0,0|1,0,0]=3 3575 B6R0.4 CNCCC(=O)O MCULE-9858204248 [0,1,1,0,0,0|1,0,0]=3 3576 B6R0.4 CNCCC(C)C MCULE-3679914556 [0,1,1,0,0,0|1,0,1]=4 3577 B6R0.4 CNCCC(C)C MCULE-9679972004 [0,1,1,0,0,0|1,0,1]=4 3578 B6R0.4 CNCCC(C)N MCULE-5955505029 [0,1,1,0,0,0|1,0,1]=4 3579 B6R0.4 CNCCC(C)N MCULE-8933967952 [0,1,1,0,0,0|1,0,1]=4 3580 B6R0.4 CNCCC(C)O MCULE-1615526002 [0,1,1,0,0,0|0,0,2]=4 3581 B6R0.4 CNCCN(C)C MCULE-3324857553 [0,1,1,0,0,0|2,0,0]=4 3582 B6R0.4 CNCCN(C)C MCULE-8014008412 [0,1,1,0,0,0|2,0,0]=4 3583 B6R0.4 CNCCN(C)C MCULE-9954339750 [0,1,1,0,0,0|2,0,0]=4 3584 B6R0.4 CNCC[C@@H](C)N MCULE-6024494304 [0,1,1,0,0,0|1,0,1]=4 3585 B6R0.4 CNCC[C@H](C)N MCULE-5449372796 [0,1,1,0,0,0|1,0,1]=4 3586 B6R0.4 CNCC[C@H](C)N MCULE-8157402351 [0,1,1,0,0,0|1,0,1]=4 3587 B6R0.4 CO/C=C/C(=O)C MCULE-1215649803 [0,1,1,0,0,0|0,0,2]=4 3588 B6R0.4 COC=CC(=O)C MCULE-4868833764 [0,1,1,0,0,0|0,0,2]=4 3589 B6R0.4 COCCC(=N)N MCULE-8118559492 [0,1,1,0,0,0|2,0,0]=4 3590 B6R0.4 COCCC(=N)N MCULE-9000138086 [0,1,1,0,0,0|2,0,0]=4 3591 B6R0.4 COCCC(=O)C MCULE-5939812376 [0,1,1,0,0,0|0,0,0]=2 3592 B6R0.4 COCCC(=O)Cl MCULE-9454266286 [0,1,1,0,0,0|1,0,0]=3 3593 B6R0.4 COCCC(=O)N MCULE-7556483675 [0,1,1,0,0,0|1,0,0]=3 3594 B6R0.4 COCCC(=O)O MCULE-3436347115 [0,1,1,0,0,0|1,0,0]=3 3595 B6R0.4 COCCC(C)Br MCULE-6529807745 [0,1,1,0,0,0|1,0,1]=4 3596 B6R0.4 COCCC(C)C MCULE-8727768886 [0,1,1,0,0,0|1,0,1]=4 3597 B6R0.4 COCCC(C)N MCULE-6183216923 [0,1,1,0,0,0|1,0,1]=4 3598 B6R0.4 COCCC(C)O MCULE-6536001437 [0,1,1,0,0,0|0,0,2]=4 3599 B6R0.4 COCCN(C)C MCULE-5323166567 [0,1,1,0,0,0|2,0,0]=4 3600 B6R0.4 COCCN(C)N MCULE-9480733049 [0,1,1,0,0,0|2,0,0]=4 3601 B6R0.4 COCC[C@H](C)N MCULE-6163336851 [0,1,1,0,0,0|1,0,1]=4 3602 B6R0.4 COCC[C@H](C)N MCULE-6363449253 [0,1,1,0,0,0|1,0,1]=4 3603 B6R0.4 COCNC(=O)N MCULE-8367032240 [0,1,1,0,0,0|2,0,0]=4 3604 B6R0.4 COCOC(=O)C MCULE-8876091916 [0,1,1,0,0,0|1,0,0]=3 3605 B6R0.4 CS(=O)CCCN MCULE-1124989526 [0,1,1,0,0,0|1,0,0]=3 3606 B6R0.4 CS(=O)CCCN MCULE-8758903495 [0,1,1,0,0,0|1,0,0]=3 3607 B6R0.4 CSCCC(=N)N MCULE-3926353306 [0,1,1,0,0,0|2,0,0]=4 3608 B6R0.4 CSCCC(=N)N MCULE-4451485733 [0,1,1,0,0,0|2,0,0]=4 3609 B6R0.4 CSCCC(=O)C MCULE-6178663156 [0,1,1,0,0,0|0,0,0]=2 3610 B6R0.4 CSCCC(=O)Cl MCULE-9732512141 [0,1,1,0,0,0|1,0,0]=3 3611 B6R0.4 CSCCC(=O)N MCULE-7105035733 [0,1,1,0,0,0|1,0,0]=3 3612 B6R0.4 CSCCC(=O)O MCULE-9550032941 [0,1,1,0,0,0|1,0,0]=3 3613 B6R0.4 CSCCC(C)N MCULE-3925048385 [0,1,1,0,0,0|1,0,1]=4 3614 B6R0.4 CSCCC(C)O MCULE-5934844952 [0,1,1,0,0,0|0,0,2]=4 3615 B6R0.4 CSCCN(C)C MCULE-2148124964 [0,1,1,0,0,0|2,0,0]=4 3616 B6R0.4 CSCCN(C)C MCULE-5176242697 [0,1,1,0,0,0|2,0,0]=4 3617 B6R0.4 CSCOC(=O)C MCULE-1498769347 [0,1,1,0,0,0|1,0,0]=3 3618 B6R0.4 CSSCC(=O)O MCULE-5829510166 [0,1,1,0,0,0|2,0,0]=4 3619 B6R0.4 C[C@@H](N)CCCO MCULE-8313291415 [0,1,1,0,0,0|1,0,1]=4 3620 B6R0.4 C[C@@H](O)CCCO MCULE-1658231016 [0,1,1,0,0,0|0,0,2]=4 3621 B6R0.4 N#CCCC(=O)O MCULE-3165189228 [0,1,1,0,0,0|1,0,1]=4 3622 B6R0.4 NC(=O)CCCCl MCULE-2774705212 [0,1,1,0,0,0|1,0,0]=3 3623 B6R0.4 NC(=O)CCCO MCULE-3779341561 [0,1,1,0,0,0|1,0,0]=3 3624 B6R0.4 NC(=O)NCCCl MCULE-6117142945 [0,1,1,0,0,0|2,0,0]=4 3625 B6R0.4 NC(=O)NCCF MCULE-9526714989 [0,1,1,0,0,0|2,0,0]=4 3626 B6R0.4 NC(=O)NCCO MCULE-2353513655 [0,1,1,0,0,0|2,0,0]=4 3627 B6R0.4 NC(=O)OCCCl MCULE-4259077420 [0,1,1,0,0,0|2,0,0]=4 3628 B6R0.4 NC(=O)OCCO MCULE-7565460845 [0,1,1,0,0,0|2,0,0]=4 3629 B6R0.4 NC(=S)CCCO MCULE-8951145487 [0,1,1,0,0,0|1,1,0]=4 3630 B6R0.4 NCCCC(=O)Cl MCULE-1312882775 [0,1,1,0,0,0|1,0,0]=3 3631 B6R0.4 NCCCC(=O)Cl MCULE-6405362906 [0,1,1,0,0,0|1,0,0]=3 3632 B6R0.4 NCCCC(=O)N MCULE-8039142092 [0,1,1,0,0,0|1,0,0]=3 3633 B6R0.4 NCCCC(=O)N MCULE-8262250872 [0,1,1,0,0,0|1,0,0]=3 3634 B6R0.4 NCCCC(=O)O MCULE-3615304273 [0,1,1,0,0,0|1,0,0]=3 3635 B6R0.4 NCCCC(=O)O MCULE-7613134021 [0,1,1,0,0,0|1,0,0]=3 3636 B6R0.4 NCCNC(=O)N MCULE-1197396950 [0,1,1,0,0,0|2,0,0]=4 3637 B6R0.4 NCCNC(=O)N MCULE-2171700183 [0,1,1,0,0,0|2,0,0]=4 3638 B6R0.4 NCCNC(=O)N MCULE-3799764813 [0,1,1,0,0,0|2,0,0]=4 3639 B6R0.4 NCCOC(=O)N MCULE-4144808257 [0,1,1,0,0,0|2,0,0]=4 3640 B6R0.4 NCCOC(=O)N MCULE-5815053840 [0,1,1,0,0,0|2,0,0]=4 3641 B6R0.4 NOCCC(=O)O MCULE-1529492904 [0,1,1,0,0,0|2,0,0]=4 3642 B6R0.4 NOCCC(=O)O MCULE-6297331357 [0,1,1,0,0,0|2,0,0]=4 3643 B6R0.4 O=C(Cl)CCCBr MCULE-1389049838 [0,1,1,0,0,0|1,0,0]=3 3644 B6R0.4 O=C(Cl)CCCCl MCULE-5885932072 [0,1,1,0,0,0|1,0,0]=3 3645 B6R0.4 O=C(Cl)OCCBr MCULE-6758010852 [0,1,1,0,0,0|2,0,0]=4 3646 B6R0.4 O=C(Cl)OCCCl MCULE-1505786385 [0,1,1,0,0,0|2,0,0]=4 3647 B6R0.4 O=C(Cl)OCCF MCULE-5233366139 [0,1,1,0,0,0|2,0,0]=4 3648 B6R0.4 O=C(O)CCCBr MCULE-5669825022 [0,1,1,0,0,0|1,0,0]=3 3649 B6R0.4 O=C(O)CCCCl MCULE-7721427391 [0,1,1,0,0,0|1,0,0]=3 3650 B6R0.4 O=C(O)CCCF MCULE-2415675768 [0,1,1,0,0,0|1,0,0]=3 3651 B6R0.4 O=C(O)CCCI MCULE-7794841553 [0,1,1,0,0,0|1,0,0]=3 3652 B6R0.4 O=C(O)CCCS MCULE-3352840152 [0,1,1,0,0,0|1,0,0]=3 3653 B6R0.4 O=C(O)CNCO MCULE-4092998319 [0,1,1,0,0,0|2,0,0]=4 3654 B6R0.4 O=C([O-])CCCCl MCULE-4131322715 [0,1,1,0,0,0|1,0,0]=3 3655 B6R0.4 O=C([O-])CNCO MCULE-2804068565 [0,1,1,0,0,0|2,0,0]=4 3656 B6R0.4 O=CCCC(=O)O MCULE-7183864722 [0,1,1,0,0,0|1,0,1]=4 3657 B6R0.4 O=N(=O)CCCBr MCULE-7541604704 [0,1,1,0,0,0|2,0,0]=4 3658 B6R0.4 O=N(=O)CCCCl MCULE-3635255631 [0,1,1,0,0,0|2,0,0]=4 3659 B6R0.4 O=N(=O)CCCO MCULE-5021681032 [0,1,1,0,0,0|2,0,0]=4 3660 B6R0.4 P(=O)([O-])OCCC MCULE-3877591764 [0,1,1,0,0,0|2,0,0]=4 3661 B6R0.5 CCCC(C)(C)C MCULE-2309229328 [0,1,1,0,0,0|1,0,1]=4 3662 B6R0.5 CCCC(C)(C)Cl MCULE-1426018824 [0,1,1,0,0,0|1,0,1]=4 3663 B6R0.5 CCCC(C)(C)N MCULE-2670535144 [0,1,1,0,0,0|1,0,1]=4 3664 B6R0.5 CCCC(C)(C)N MCULE-4533125677 [0,1,1,0,0,0|1,0,1]=4 3665 B6R0.5 CCCC(C)(C)O MCULE-2647276101 [0,1,1,0,0,0|0,0,2]=4 3666 B6R0.5 CCCP(=O)(O)O MCULE-3928382731 [0,1,1,0,0,0|2,0,0]=4 3667 B6R0.5 CCCS(=O)(=O)Cl MCULE-4980552385 [0,1,1,0,0,0|2,0,0]=4 3668 B6R0.5 CCCS(=O)(=O)F MCULE-7811564151 [0,1,1,0,0,0|2,0,0]=4 3669 B6R0.5 CCCS(=O)(=O)N MCULE-1554874611 [0,1,1,0,0,0|2,0,0]=4 3670 B6R0.5 CCCS(=O)(=O)O MCULE-5213264344 [0,1,1,0,0,0|2,0,0]=4 3671 B6R0.5 CCCS(=O)(=O)[O-] MCULE-5970988364 [0,1,1,0,0,0|2,0,0]=4 3672 B6R0.5 CCC[N+](C)(C)C MCULE-4840113179 [0,1,1,0,0,0|2,0,0]=4 3673 B6R0.5 CCC[N+](C)(C)C MCULE-6374165176 [0,1,1,0,0,0|2,0,0]=4 3674 B6R0.5 CCC[N+](C)(C)C MCULE-6861938722 [0,1,1,0,0,0|2,0,0]=4 3675 B6R0.5 CCC[Si](C)(C)Cl MCULE-2174562638 [0,1,1,0,0,0|1,1,0]=4 3676 B6R0.5 CCC[Si](C)(Cl)Cl MCULE-9758606777 [0,1,1,0,0,0|1,1,0]=4 3677 B6R0.5 CCNS(=O)(=O)C MCULE-7880259383 [0,1,1,0,0,0|2,0,0]=4 3678 B6R0.5 CCOP(=O)(C)S MCULE-4864782374 [0,1,1,0,0,0|2,0,0]=4 3679 B6R0.5 CCOS(=O)(=O)C MCULE-7269389229 [0,1,1,0,0,0|2,0,0]=4 3680 B6R0.5 CS(=N)(=O)CCO MCULE-8018746796 [0,1,1,0,0,0|2,0,0]=4 3681 B6R0.5 CS(=O)(=O)CCBr MCULE-8646670232 [0,1,1,0,0,0|2,0,0]=4 3682 B6R0.5 CS(=O)(=O)CCCl MCULE-2793702743 [0,1,1,0,0,0|2,0,0]=4 3683 B6R0.5 CS(=O)(=O)CCN MCULE-1321841891 [0,1,1,0,0,0|2,0,0]=4 3684 B6R0.5 CS(=O)(=O)CCN MCULE-2288346161 [0,1,1,0,0,0|2,0,0]=4 3685 B6R0.5 CS(=O)(=O)CCN MCULE-7691141389 [0,1,1,0,0,0|2,0,0]=4 3686 B6R0.5 CS(=O)(=O)CCO MCULE-1589351176 [0,1,1,0,0,0|2,0,0]=4 3687 B6R0.5 CS(=O)(=O)CCS MCULE-9115674422 [0,1,1,0,0,0|2,0,0]=4 3688 B6R0.6 BrCCCCCBr MCULE-7929769310 [0,1,1,0,0,0|1,0,1]=4 3689 B6R0.6 C#CCCCC=C MCULE-2596375073 [0,1,1,0,0,0|1,0,1]=4 3690 B6R0.6 C#CCCCC=O MCULE-4075029417 [0,1,1,0,0,0|0,0,1]=3 3691 B6R0.6 C#CCCCCBr MCULE-9086746106 [0,1,1,0,0,0|1,0,1]=4 3692 B6R0.6 C#CCCCCC MCULE-7776756434 [0,1,1,0,0,0|1,0,1]=4 3693 B6R0.6 C#CCCCCCl MCULE-3718113550 [0,1,1,0,0,0|1,0,1]=4 3694 B6R0.6 C#CCCCCI MCULE-6799128140 [0,1,1,0,0,0|1,0,1]=4 3695 B6R0.6 C#CCCCCN MCULE-1313888655 [0,1,1,0,0,0|1,0,1]=4 3696 B6R0.6 C#CCCCCN MCULE-5521830994 [0,1,1,0,0,0|1,0,1]=4 3697 B6R0.6 C#CCCCCO MCULE-2977997146 [0,1,1,0,0,0|1,0,1]=4 3698 B6R0.6 C#CCCCNC MCULE-4472877921 [0,1,1,0,0,0|1,0,1]=4 3699 B6R0.6 C#CCCCNC MCULE-9185657315 [0,1,1,0,0,0|1,0,1]=4 3700 B6R0.6 C#CCCCOC MCULE-3174650949 [0,1,1,0,0,0|1,0,1]=4 3701 B6R0.6 C#CCCSCC MCULE-1094584940 [0,1,1,0,0,0|1,0,1]=4 3702 B6R0.6 C#CCNCCC MCULE-7880884278 [0,1,1,0,0,0|1,0,1]=4 3703 B6R0.6 C#CCNCCC MCULE-8975069665 [0,1,1,0,0,0|1,0,1]=4 3704 B6R0.6 C(=C/CCC)\CO MCULE-6491762150 [0,1,1,0,0,0|0,0,2]=4 3705 B6R0.6 C/C=C/CCCC MCULE-6900331316 [0,1,1,0,0,0|1,0,0]=3 3706 B6R0.6 C/C=C/CCCO MCULE-9865436125 [0,1,1,0,0,0|1,0,1]=4 3707 B6R0.6 C/C=C\CCCC MCULE-8426867799 [0,1,1,0,0,0|1,0,0]=3 3708 B6R0.6 C/C=C\CCCO MCULE-3169839661 [0,1,1,0,0,0|1,0,1]=4 3709 B6R0.6 C=CCC/C=C/C MCULE-3936427871 [0,1,1,0,0,0|1,0,1]=4 3710 B6R0.6 C=CCCC=CC MCULE-6481809840 [0,1,1,0,0,0|1,0,1]=4 3711 B6R0.6 C=CCCCC#N MCULE-3708293792 [0,1,1,0,0,0|1,0,1]=4 3712 B6R0.6 C=CCCCC=O MCULE-8676840281 [0,1,1,0,0,0|0,0,1]=3 3713 B6R0.6 C=CCCCCBr MCULE-4313298656 [0,1,1,0,0,0|1,0,0]=3 3714 B6R0.6 C=CCCCCC MCULE-5868303078 [0,1,1,0,0,0|1,0,0]=3 3715 B6R0.6 C=CCCCCCl MCULE-7600727876 [0,1,1,0,0,0|1,0,0]=3 3716 B6R0.6 C=CCCCCI MCULE-5694143061 [0,1,1,0,0,0|1,0,0]=3 3717 B6R0.6 C=CCCCCN MCULE-1489231988 [0,1,1,0,0,0|1,0,0]=3 3718 B6R0.6 C=CCCCCN MCULE-4288584778 [0,1,1,0,0,0|1,0,0]=3 3719 B6R0.6 C=CCCCCO MCULE-3631432277 [0,1,1,0,0,0|1,0,0]=3 3720 B6R0.6 C=CCCCNC MCULE-6696525157 [0,1,1,0,0,0|1,0,0]=3 3721 B6R0.6 C=CCCCNC MCULE-7417274044 [0,1,1,0,0,0|1,0,0]=3 3722 B6R0.6 C=CCCCON MCULE-6496647420 [0,1,1,0,0,0|2,0,0]=4 3723 B6R0.6 C=CCCCON MCULE-7055713530 [0,1,1,0,0,0|2,0,0]=4 3724 B6R0.6 C=CCNCCC MCULE-4239068147 [0,1,1,0,0,0|1,0,0]=3 3725 B6R0.6 C=CCNCCC MCULE-9778489216 [0,1,1,0,0,0|1,0,0]=3 3726 B6R0.6 C=CCNCCO MCULE-5860509324 [0,1,1,0,0,0|2,0,0]=4 3727 B6R0.6 C=CCOCC=O MCULE-8507800253 [0,1,1,0,0,0|0,0,2]=4 3728 B6R0.6 C=CCOCCBr MCULE-7565992230 [0,1,1,0,0,0|2,0,0]=4 3729 B6R0.6 C=CCOCCCl MCULE-1353236332 [0,1,1,0,0,0|2,0,0]=4 3730 B6R0.6 C=CCOCCI MCULE-8468439129 [0,1,1,0,0,0|2,0,0]=4 3731 B6R0.6 C=CCOCCN MCULE-5411259412 [0,1,1,0,0,0|2,0,0]=4 3732 B6R0.6 C=CCOCCN MCULE-9798285838 [0,1,1,0,0,0|2,0,0]=4 3733 B6R0.6 C=CCOCCO MCULE-5718868633 [0,1,1,0,0,0|2,0,0]=4 3734 B6R0.6 C=CCOCOC MCULE-6553342654 [0,1,1,0,0,0|2,0,0]=4 3735 B6R0.6 C=CCSCCC MCULE-3855352363 [0,1,1,0,0,0|1,0,0]=3 3736 B6R0.6 C=CCSCCN MCULE-3972995930 [0,1,1,0,0,0|2,0,0]=4 3737 B6R0.6 C=CCSCCN MCULE-9922932955 [0,1,1,0,0,0|2,0,0]=4 3738 B6R0.6 C=COCCCC MCULE-2025922328 [0,1,1,0,0,0|1,0,0]=3 3739 B6R0.6 C=COCCCN MCULE-1669664157 [0,1,1,0,0,0|2,0,0]=4 3740 B6R0.6 C=COCCCO MCULE-8325617945 [0,1,1,0,0,0|2,0,0]=4 3741 B6R0.6 C=COCCOC MCULE-6845218696 [0,1,1,0,0,0|2,0,0]=4 3742 B6R0.6 CC#CCCCC MCULE-1899332515 [0,1,1,0,0,0|1,0,1]=4 3743 B6R0.6 CC/C=C/CCC MCULE-5222700461 [0,1,1,0,0,0|1,0,1]=4 3744 B6R0.6 CC/C=C\CC=O MCULE-1715953159 [0,1,1,0,0,0|0,0,1]=3 3745 B6R0.6 CC=CCCCBr MCULE-1109208969 [0,1,1,0,0,0|1,0,1]=4 3746 B6R0.6 CC=CCCCC MCULE-7277981733 [0,1,1,0,0,0|1,0,0]=3 3747 B6R0.6 CC=CCCCCl MCULE-7487798637 [0,1,1,0,0,0|1,0,1]=4 3748 B6R0.6 CC=CCCCO MCULE-1401303632 [0,1,1,0,0,0|1,0,1]=4 3749 B6R0.6 CC=CSCCC MCULE-3534082442 [0,1,1,0,0,0|1,0,1]=4 3750 B6R0.6 CCC#CCC=O MCULE-4049790039 [0,1,1,0,0,0|0,0,1]=3 3751 B6R0.6 CCC/C=C/C=O MCULE-3059768922 [0,1,1,0,0,0|0,0,1]=3 3752 B6R0.6 CCC=CCC=O MCULE-5764198290 [0,1,1,0,0,0|0,0,1]=3 3753 B6R0.6 CCC=CCCC MCULE-3739501724 [0,1,1,0,0,0|1,0,1]=4 3754 B6R0.6 CCCC=CC=O MCULE-5273169296 [0,1,1,0,0,0|0,0,1]=3 3755 B6R0.6 CCCC=CCBr MCULE-2474104566 [0,1,1,0,0,0|1,0,1]=4 3756 B6R0.6 CCCC=CCO MCULE-3204738641 [0,1,1,0,0,0|0,0,2]=4 3757 B6R0.6 CCCCCC#N MCULE-7596791521 [0,1,1,0,0,0|1,0,1]=4 3758 B6R0.6 CCCCCC=O MCULE-6770578514 [0,1,1,0,0,0|0,0,0]=2 3759 B6R0.6 CCCCCCBr MCULE-6022503394 [0,1,1,0,0,0|1,0,1]=4 3760 B6R0.6 CCCCCCC MCULE-5817084747 [0,1,1,0,0,0|1,0,1]=4 3761 B6R0.6 CCCCCCCl MCULE-3706149525 [0,1,1,0,0,0|1,0,1]=4 3762 B6R0.6 CCCCCCF MCULE-4320903575 [0,1,1,0,0,0|1,0,1]=4 3763 B6R0.6 CCCCCCI MCULE-1021236615 [0,1,1,0,0,0|1,0,1]=4 3764 B6R0.6 CCCCCCN MCULE-2944455155 [0,1,1,0,0,0|1,0,1]=4 3765 B6R0.6 CCCCCCN MCULE-6014217174 [0,1,1,0,0,0|1,0,1]=4 3766 B6R0.6 CCCCCCN MCULE-6021451227 [0,1,1,0,0,0|1,0,1]=4 3767 B6R0.6 CCCCCCO MCULE-4299150163 [0,1,1,0,0,0|0,0,2]=4 3768 B6R0.6 CCCCCCS MCULE-5962964855 [0,1,1,0,0,0|0,1,1]=4 3769 B6R0.6 CCCCCNC MCULE-8082703734 [0,1,1,0,0,0|1,0,1]=4 3770 B6R0.6 CCCCCNN MCULE-5089668540 [0,1,1,0,0,0|1,0,1]=4 3771 B6R0.6 CCCCCNN MCULE-7265120524 [0,1,1,0,0,0|1,0,1]=4 3772 B6R0.6 CCCCCOC MCULE-3370181741 [0,1,1,0,0,0|0,0,2]=4 3773 B6R0.6 CCCCCON MCULE-5372426564 [0,1,1,0,0,0|0,0,2]=4 3774 B6R0.6 CCCCCON MCULE-8557641459 [0,1,1,0,0,0|0,0,2]=4 3775 B6R0.6 CCCCCSC MCULE-6566108868 [0,1,1,0,0,0|0,1,1]=4 3776 B6R0.6 CCCCN=C=O MCULE-3381327717 [0,1,1,0,0,0|0,0,1]=3 3777 B6R0.6 CCCCN=C=S MCULE-3952129182 [0,1,1,0,0,0|0,1,1]=4 3778 B6R0.6 CCCCN=N#N MCULE-4207638779 [0,1,1,0,0,0|2,0,0]=4 3779 B6R0.6 CCCCNC=O MCULE-8821792924 [0,1,1,0,0,0|0,0,0]=2 3780 B6R0.6 CCCCNCC MCULE-8816750429 [0,1,1,0,0,0|1,0,1]=4 3781 B6R0.6 CCCCNOC MCULE-4265481432 [0,1,1,0,0,0|1,0,1]=4 3782 B6R0.6 CCCCOC=O MCULE-4633421026 [0,1,1,0,0,0|0,0,0]=2 3783 B6R0.6 CCCCOCC MCULE-5662731951 [0,1,1,0,0,0|1,0,1]=4 3784 B6R0.6 CCCCOCCl MCULE-5282964693 [0,1,1,0,0,0|1,0,1]=4 3785 B6R0.6 CCCCON=O MCULE-9992790020 [0,1,1,0,0,0|1,0,0]=3 3786 B6R0.6 CCCCSC#N MCULE-4585387956 [0,1,1,0,0,0|1,0,1]=4 3787 B6R0.6 CCCCSCC MCULE-4832924468 [0,1,1,0,0,0|1,0,1]=4 3788 B6R0.6 CCCCSCCl MCULE-4907770015 [0,1,1,0,0,0|1,0,1]=4 3789 B6R0.6 CCCNCC#N MCULE-3452380054 [0,1,1,0,0,0|1,0,1]=4 3790 B6R0.6 CCCNCCC MCULE-1452672638 [0,1,1,0,0,0|1,0,1]=4 3791 B6R0.6 CCCNCCC MCULE-6223802621 [0,1,1,0,0,0|1,0,1]=4 3792 B6R0.6 CCCNCCC MCULE-6789654118 [0,1,1,0,0,0|1,0,1]=4 3793 B6R0.6 CCCNCCN MCULE-2288945868 [0,1,1,0,0,0|1,0,1]=4 3794 B6R0.6 CCCNCCO MCULE-4813687741 [0,1,1,0,0,0|0,0,2]=4 3795 B6R0.6 CCCOCC#N MCULE-7011471802 [0,1,1,0,0,0|1,0,1]=4 3796 B6R0.6 CCCOCCC MCULE-1390130917 [0,1,1,0,0,0|1,0,1]=4 3797 B6R0.6 CCCOCCCl MCULE-6561613708 [0,1,1,0,0,0|1,0,1]=4 3798 B6R0.6 CCCOCCI MCULE-5330098176 [0,1,1,0,0,0|1,0,1]=4 3799 B6R0.6 CCCOCCN MCULE-1987261931 [0,1,1,0,0,0|1,0,1]=4 3800 B6R0.6 CCCOCCN MCULE-9033871038 [0,1,1,0,0,0|1,0,1]=4 3801 B6R0.6 CCCOCCO MCULE-3263526264 [0,1,1,0,0,0|0,0,2]=4 3802 B6R0.6 CCCSCCC MCULE-5531652471 [0,1,1,0,0,0|1,0,1]=4 3803 B6R0.6 CCCSCCN MCULE-3934428121 [0,1,1,0,0,0|1,0,1]=4 3804 B6R0.6 CCCSCCN MCULE-5705755172 [0,1,1,0,0,0|1,0,1]=4 3805 B6R0.6 CCCSCCO MCULE-8371796663 [0,1,1,0,0,0|0,0,2]=4 3806 B6R0.6 CCNCCC#N MCULE-8589229962 [0,1,1,0,0,0|1,0,1]=4 3807 B6R0.6 CCNCCCN MCULE-5811169148 [0,1,1,0,0,0|1,0,1]=4 3808 B6R0.6 CCNCCCO MCULE-3251610052 [0,1,1,0,0,0|0,0,2]=4 3809 B6R0.6 CCNCCNC MCULE-9372339393 [0,1,1,0,0,0|2,0,0]=4 3810 B6R0.6 CCNCCOC MCULE-1476772953 [0,1,1,0,0,0|2,0,0]=4 3811 B6R0.6 CCNCCOC MCULE-6652489795 [0,1,1,0,0,0|2,0,0]=4 3812 B6R0.6 CCNCCSC MCULE-1736157320 [0,1,1,0,0,0|2,0,0]=4 3813 B6R0.6 CCNCCSC MCULE-9369049891 [0,1,1,0,0,0|2,0,0]=4 3814 B6R0.6 CCOCCC#N MCULE-4907543374 [0,1,1,0,0,0|1,0,1]=4 3815 B6R0.6 CCOCCC=O MCULE-1664130148 [0,1,1,0,0,0|0,0,0]=2 3816 B6R0.6 CCOCCCBr MCULE-6544747281 [0,1,1,0,0,0|1,0,1]=4 3817 B6R0.6 CCOCCCCl MCULE-8523618681 [0,1,1,0,0,0|1,0,1]=4 3818 B6R0.6 CCOCCCI MCULE-6640732668 [0,1,1,0,0,0|1,0,1]=4 3819 B6R0.6 CCOCCCN MCULE-3491529722 [0,1,1,0,0,0|1,0,1]=4 3820 B6R0.6 CCOCCCO MCULE-3077567484 [0,1,1,0,0,0|0,0,2]=4 3821 B6R0.6 CCOCCNC MCULE-5244682559 [0,1,1,0,0,0|2,0,0]=4 3822 B6R0.6 CCOCCNC MCULE-9344296133 [0,1,1,0,0,0|2,0,0]=4 3823 B6R0.6 CCOCCNN MCULE-2995792378 [0,1,1,0,0,0|2,0,0]=4 3824 B6R0.6 CCOCCNN MCULE-7756116612 [0,1,1,0,0,0|2,0,0]=4 3825 B6R0.6 CCOCCOC MCULE-2753000412 [0,1,1,0,0,0|2,0,0]=4 3826 B6R0.6 CCOCCON MCULE-6072859154 [0,1,1,0,0,0|2,0,0]=4 3827 B6R0.6 CCOCCON MCULE-7716477934 [0,1,1,0,0,0|2,0,0]=4 3828 B6R0.6 CCSCCC=O MCULE-2493452950 [0,1,1,0,0,0|0,0,0]=2 3829 B6R0.6 CCSCCCBr MCULE-5143634954 [0,1,1,0,0,0|1,0,1]=4 3830 B6R0.6 CCSCCCN MCULE-4566450606 [0,1,1,0,0,0|1,0,1]=4 3831 B6R0.6 CCSCCCO MCULE-6719011943 [0,1,1,0,0,0|0,0,2]=4 3832 B6R0.6 CCSCCNC MCULE-6159594076 [0,1,1,0,0,0|2,0,0]=4 3833 B6R0.6 CCSCCNC MCULE-6696154047 [0,1,1,0,0,0|2,0,0]=4 3834 B6R0.6 CNCCCC#N MCULE-2995077554 [0,1,1,0,0,0|1,0,1]=4 3835 B6R0.6 CNCCCC#N MCULE-4831210709 [0,1,1,0,0,0|1,0,1]=4 3836 B6R0.6 CNCCCCBr MCULE-4148452640 [0,1,1,0,0,0|1,0,1]=4 3837 B6R0.6 CNCCCCBr MCULE-8686440557 [0,1,1,0,0,0|1,0,1]=4 3838 B6R0.6 CNCCCCCl MCULE-1170786568 [0,1,1,0,0,0|1,0,1]=4 3839 B6R0.6 CNCCCCCl MCULE-1726466829 [0,1,1,0,0,0|1,0,1]=4 3840 B6R0.6 CNCCCCN MCULE-2542685963 [0,1,1,0,0,0|1,0,1]=4 3841 B6R0.6 CNCCCCN MCULE-7925344560 [0,1,1,0,0,0|1,0,1]=4 3842 B6R0.6 CNCCCCO MCULE-9264393637 [0,1,1,0,0,0|0,0,2]=4 3843 B6R0.6 CNCCCNC MCULE-3840224541 [0,1,1,0,0,0|2,0,0]=4 3844 B6R0.6 CNCCCOC MCULE-4057126907 [0,1,1,0,0,0|2,0,0]=4 3845 B6R0.6 CNCCCOC MCULE-8552551858 [0,1,1,0,0,0|2,0,0]=4 3846 B6R0.6 CNCCCSC MCULE-6553998750 [0,1,1,0,0,0|2,0,0]=4 3847 B6R0.6 COCCCC#N MCULE-8739581354 [0,1,1,0,0,0|1,0,1]=4 3848 B6R0.6 COCCCC=O MCULE-2055914202 [0,1,1,0,0,0|0,0,0]=2 3849 B6R0.6 COCCCCBr MCULE-7500019583 [0,1,1,0,0,0|1,0,1]=4 3850 B6R0.6 COCCCCCl MCULE-3863170338 [0,1,1,0,0,0|1,0,1]=4 3851 B6R0.6 COCCCCN MCULE-9584631056 [0,1,1,0,0,0|1,0,1]=4 3852 B6R0.6 COCCCCO MCULE-2543196930 [0,1,1,0,0,0|0,0,2]=4 3853 B6R0.6 COCCCCO MCULE-8659106280 [0,1,1,0,0,0|0,0,2]=4 3854 B6R0.6 COCCCNN MCULE-5097653856 [0,1,1,0,0,0|2,0,0]=4 3855 B6R0.6 COCCCNN MCULE-7758841774 [0,1,1,0,0,0|2,0,0]=4 3856 B6R0.6 COCCCOC MCULE-5003816236 [0,1,1,0,0,0|2,0,0]=4 3857 B6R0.6 COCCCON MCULE-3859091617 [0,1,1,0,0,0|2,0,0]=4 3858 B6R0.6 COCCCON MCULE-4419390097 [0,1,1,0,0,0|2,0,0]=4 3859 B6R0.6 COCCN=C=O MCULE-7139432642 [0,1,1,0,0,0|1,0,1]=4 3860 B6R0.6 COCCNC=O MCULE-9003279073 [0,1,1,0,0,0|1,0,0]=3 3861 B6R0.6 CSCCCC=O MCULE-6353729217 [0,1,1,0,0,0|0,0,0]=2 3862 B6R0.6 CSCCCCN MCULE-2391033479 [0,1,1,0,0,0|1,0,1]=4 3863 B6R0.6 CSCCCCO MCULE-1045422424 [0,1,1,0,0,0|0,0,2]=4 3864 B6R0.6 CSCCCON MCULE-2543326517 [0,1,1,0,0,0|2,0,0]=4 3865 B6R0.6 CSCCCSC MCULE-6993538101 [0,1,1,0,0,0|2,0,0]=4 3866 B6R0.6 CSCCN=C=O MCULE-4217751051 [0,1,1,0,0,0|1,0,1]=4 3867 B6R0.6 ClCCCCCBr MCULE-6767883252 [0,1,1,0,0,0|1,0,1]=4 3868 B6R0.6 ClCCCCCCl MCULE-9302388009 [0,1,1,0,0,0|1,0,1]=4 3869 B6R0.6 ClCCCCCI MCULE-2173931817 [0,1,1,0,0,0|1,0,1]=4 3870 B6R0.6 FCCCCCBr MCULE-1314383985 [0,1,1,0,0,0|1,0,1]=4 3871 B6R0.6 ICCCCCI MCULE-2889089700 [0,1,1,0,0,0|1,0,1]=4 3872 B6R0.6 N#CCCCCBr MCULE-7152608116 [0,1,1,0,0,0|1,0,1]=4 3873 B6R0.6 N#CCCCCCl MCULE-9317036806 [0,1,1,0,0,0|1,0,1]=4 3874 B6R0.6 N#CCCCCF MCULE-1200512715 [0,1,1,0,0,0|1,0,1]=4 3875 B6R0.6 N#CCCCCI MCULE-8000340428 [0,1,1,0,0,0|1,0,1]=4 3876 B6R0.6 N#CCCCCN MCULE-4183048720 [0,1,1,0,0,0|1,0,1]=4 3877 B6R0.6 N#CCCCCN MCULE-4775375165 [0,1,1,0,0,0|1,0,1]=4 3878 B6R0.6 N#CCCCCO MCULE-4289736283 [0,1,1,0,0,0|1,0,1]=4 3879 B6R0.6 N#CCCCCS MCULE-6284171080 [0,1,1,0,0,0|1,0,1]=4 3880 B6R0.6 NCCCCCBr MCULE-3577483607 [0,1,1,0,0,0|1,0,1]=4 3881 B6R0.6 NCCCCCBr MCULE-7572691537 [0,1,1,0,0,0|1,0,1]=4 3882 B6R0.6 NCCCCCF MCULE-1057270243 [0,1,1,0,0,0|1,0,1]=4 3883 B6R0.6 NCCCCCN MCULE-3785554987 [0,1,1,0,0,0|1,0,1]=4 3884 B6R0.6 NCCCCCN MCULE-5173983982 [0,1,1,0,0,0|1,0,1]=4 3885 B6R0.6 NCCCCCO MCULE-8877250712 [0,1,1,0,0,0|0,0,2]=4 3886 B6R0.6 NCCCCCS MCULE-1813104379 [0,1,1,0,0,0|0,1,1]=4 3887 B6R0.6 NCCCCCS MCULE-6081835870 [0,1,1,0,0,0|0,1,1]=4 3888 B6R0.6 NCCCCNO MCULE-6478748569 [0,1,1,0,0,0|1,0,1]=4 3889 B6R0.6 NCCCNC=O MCULE-9651299205 [0,1,1,0,0,0|1,0,0]=3 3890 B6R0.6 NNCCCCO MCULE-3928748589 [0,1,1,0,0,0|2,0,0]=4 3891 B6R0.6 O=C=NCCCCl MCULE-4158367269 [0,1,1,0,0,0|1,0,1]=4 3892 B6R0.6 O=CCCCC=O MCULE-6802048757 [0,1,1,0,0,0|0,0,1]=3 3893 B6R0.6 O=CCCCCCl MCULE-1257670284 [0,1,1,0,0,0|0,0,0]=2 3894 B6R0.6 O=CCCCCO MCULE-7959082228 [0,1,1,0,0,0|0,0,0]=2 3895 B6R0.6 O=CNCCCO MCULE-7926485528 [0,1,1,0,0,0|1,0,0]=3 3896 B6R0.6 O=NCNCCO MCULE-4478167391 [0,1,1,0,0,0|2,0,0]=4 3897 B6R0.6 OCCCCCBr MCULE-1444733196 [0,1,1,0,0,0|0,0,2]=4 3898 B6R0.6 OCCCCCCl MCULE-5666058059 [0,1,1,0,0,0|0,0,2]=4 3899 B6R0.6 OCCCCCF MCULE-9253204275 [0,1,1,0,0,0|0,0,2]=4 3900 B6R0.6 OCCCCCI MCULE-8707758496 [0,1,1,0,0,0|0,0,2]=4 3901 B6R0.6 OCCCCCO MCULE-1044076048 [0,1,1,0,0,0|0,0,2]=4 3902 B6R0.6 SCCCCCS MCULE-4899719552 [0,1,1,0,0,0|0,1,1]=4 3903 B6R0.8 CCC(C)(Br)CC MCULE-6306783726 [0,1,1,0,0,0|1,0,1]=4 3904 B6R0.8 CCC(C)(C)CC MCULE-7259470376 [0,1,1,0,0,0|1,0,1]=4 3905 B6R0.8 CCC(C)(Cl)CC MCULE-2958469449 [0,1,1,0,0,0|1,0,1]=4 3906 B6R0.8 CCC(C)(N)CC MCULE-6775882748 [0,1,1,0,0,0|1,0,1]=4 3907 B6R0.8 CCC(C)(N)CC MCULE-8120212652 [0,1,1,0,0,0|1,0,1]=4 3908 B6R0.8 CCC(C)(O)CC MCULE-2300322554 [0,1,1,0,0,0|0,0,2]=4 3909 B6R0.8 CCP(=O)(O)CC MCULE-3198153356 [0,1,1,0,0,0|1,0,0]=3 3910 B6R0.8 CCS(=N)(=O)CC MCULE-1377380719 [0,1,1,0,0,0|1,0,0]=3 3911 B6R0.8 CCS(=O)(=O)CBr MCULE-9846834894 [0,1,1,0,0,0|2,0,0]=4 3912 B6R0.8 CCS(=O)(=O)CC MCULE-5339813362 [0,1,1,0,0,0|1,0,0]=3 3913 B6R0.8 CCS(=O)(=O)CCl MCULE-8191946420 [0,1,1,0,0,0|2,0,0]=4 3914 B6R0.8 CCS(=O)(=O)NC MCULE-6063674993 [0,1,1,0,0,0|2,0,0]=4 3915 B6R0.8 CCS(=O)(=O)OC MCULE-7196280359 [0,1,1,0,0,0|2,0,0]=4 3916 B6R0.8 CC[Ge](Cl)(Cl)CC MCULE-8426892874 [0,1,1,0,0,0|1,1,0]=4 3917 B6R0.8 CC[Si](Cl)(Cl)CC MCULE-3344875531 [0,1,1,0,0,0|1,1,0]=4 3918 B6R0.9 C#CC(CC)CC MCULE-6184220024 [0,1,1,0,0,0|1,0,1]=4 3919 B6R0.9 C/C=C(/C=O)\CC MCULE-4811305564 [0,1,1,0,0,0|0,0,1]=3 3920 B6R0.9 CC=C(C#N)CC MCULE-7873183675 [0,1,1,0,0,0|1,0,1]=4 3921 B6R0.9 CC=C(C=O)CC MCULE-3354209980 [0,1,1,0,0,0|0,0,1]=3 3922 B6R0.9 CC=C(CC)CC MCULE-5609717261 [0,1,1,0,0,0|1,0,0]=3 3923 B6R0.9 CCB(CC)OC MCULE-5839415433 [0,1,1,0,0,0|1,0,1]=4 3924 B6R0.9 CCC(=CO)CC MCULE-4973169590 [0,1,1,0,0,0|0,0,1]=3 3925 B6R0.9 CCC(=CO)CC MCULE-8459100577 [0,1,1,0,0,0|0,0,1]=3 3926 B6R0.9 CCC(C#N)CC MCULE-1817171032 [0,1,1,0,0,0|1,0,1]=4 3927 B6R0.9 CCC(C=O)CC MCULE-3529464122 [0,1,1,0,0,0|0,0,1]=3 3928 B6R0.9 CCC(CC)CBr MCULE-7035205946 [0,1,1,0,0,0|1,0,1]=4 3929 B6R0.9 CCC(CC)CC MCULE-4259310191 [0,1,1,0,0,0|1,0,1]=4 3930 B6R0.9 CCC(CC)CI MCULE-7444274747 [0,1,1,0,0,0|1,0,1]=4 3931 B6R0.9 CCC(CC)CN MCULE-2344837203 [0,1,1,0,0,0|1,0,1]=4 3932 B6R0.9 CCC(CC)CN MCULE-5753995416 [0,1,1,0,0,0|1,0,1]=4 3933 B6R0.9 CCC(CC)CO MCULE-8799293985 [0,1,1,0,0,0|0,0,2]=4 3934 B6R0.9 CCC(CC)NC MCULE-5581389070 [0,1,1,0,0,0|1,0,1]=4 3935 B6R0.9 CCC(CC)NC MCULE-9713693117 [0,1,1,0,0,0|1,0,1]=4 3936 B6R0.9 CCC(CC)NN MCULE-2238567966 [0,1,1,0,0,0|1,0,1]=4 3937 B6R0.9 CCC(CC)NN MCULE-6799511276 [0,1,1,0,0,0|1,0,1]=4 3938 B6R0.9 CCC(CC)NN MCULE-7243313185 [0,1,1,0,0,0|1,0,1]=4 3939 B6R0.9 CCN(C#N)CC MCULE-5340167535 [0,1,1,0,0,0|2,0,0]=4 3940 B6R0.9 CCN(C=O)CC MCULE-9053231156 [0,1,1,0,0,0|1,0,0]=3 3941 B6R0.9 CCN(CC)CC MCULE-1748959240 [0,1,1,0,0,0|2,0,0]=4 3942 B6R0.9 CCN(CC)CC MCULE-6692975244 [0,1,1,0,0,0|2,0,0]=4 3943 B6R0.9 CCN(CC)CC MCULE-8404374147 [0,1,1,0,0,0|2,0,0]=4 3944 B6R0.9 CCN(CC)CO MCULE-9782453115 [0,1,1,0,0,0|1,0,1]=4 3945 B6R0.9 CCN(CC)N=O MCULE-8931177297 [0,1,1,0,0,0|1,0,0]=3 3946 B6R0.9 CCP(CC)CC MCULE-9384101687 [0,1,1,0,0,0|2,0,0]=4 3947 B6R0.9 CC[BH-](CC)CC MCULE-2290572181 [0,1,1,0,0,0|2,0,0]=4 3948 B6R0.9 CC[BH-](CC)CC MCULE-8338494068 [0,1,1,0,0,0|2,0,0]=4 3949 B6R0.9 CC[NH+](CC)CC MCULE-2368942907 [0,1,1,0,0,0|2,0,0]=4 3950 B6R0.9 CC[O+](CC)CC MCULE-2279228362 [0,1,1,0,0,0|2,0,0]=4 3951 B6R0.9 CC[O+](CC)CC MCULE-9717277153 [0,1,1,0,0,0|2,0,0]=4 3952 B6R0.9 CC[S+](CC)CC MCULE-1808998862 [0,1,1,0,0,0|2,0,0]=4 3953 B6R0.9 CC[S+](CC)CC MCULE-5064870708 [0,1,1,0,0,0|2,0,0]=4 3954 B6R0.9 [SiH](CC)(CC)CC MCULE-6563417997 [0,1,1,0,0,0|1,1,0]=4 3955 B6R1.4 CC1CCC1=O MCULE-4548181715 [0,1,0,0,1,0|0,0,0]=2 3956 B6R1.4 CC1CCC1N MCULE-9634057678 [0,1,0,0,1,0|1,0,1]=4 3957 B6R1.4 CC1CCC1N MCULE-9849489304 [0,1,0,0,1,0|1,0,1]=4 3958 B6R1.4 CC1CCC1O MCULE-3852133104 [0,1,0,0,1,0|0,0,2]=4 3959 B6R1.4 CC1CNC1=O MCULE-5523309752 [0,1,0,0,1,0|1,0,0]=3 3960 B6R1.4 CC1COC1=O MCULE-9711165188 [0,1,0,0,1,0|1,0,0]=3 3961 B6R1.4 CC1OCC1=O MCULE-7718609686 [0,1,0,0,1,0|1,0,0]=3 3962 B6R1.4 C[C@@H]1CC[C@@H]1N MCULE-9803413081 [0,1,0,0,1,0|1,0,1]=4 3963 B6R1.4 C[C@@H]1CC[C@H]1N MCULE-3888655890 [0,1,0,0,1,0|1,0,1]=4 3964 B6R1.4 C[C@H]1CC[C@@H]1N MCULE-1445146965 [0,1,0,0,1,0|1,0,1]=4 3965 B6R1.4 C[C@H]1CC[C@H]1N MCULE-3329522369 [0,1,0,0,1,0|1,0,1]=4 3966 B6R1.4 NC1CCC1=O MCULE-3868209809 [0,1,0,0,1,0|0,0,0]=2 3967 B6R1.4 NC1CCC1=O MCULE-9741389143 [0,1,0,0,1,0|0,0,0]=2 3968 B6R1.4 NC1CCC1F MCULE-1403984623 [0,1,0,0,1,0|1,0,1]=4 3969 B6R1.4 NC1CCC1F MCULE-8216841286 [0,1,0,0,1,0|1,0,1]=4 3970 B6R1.4 NC1CCC1N MCULE-6052332328 [0,1,0,0,1,0|1,0,1]=4 3971 B6R1.4 NC1CCC1O MCULE-4636397534 [0,1,0,0,1,0|0,0,2]=4 3972 B6R1.4 NC1CCC1O MCULE-7148132261 [0,1,0,0,1,0|0,0,2]=4 3973 B6R1.4 NC1CNC1=O MCULE-2761616663 [0,1,0,0,1,0|1,0,0]=3 3974 B6R1.4 NC1CNC1=O MCULE-3021306383 [0,1,0,0,1,0|1,0,0]=3 3975 B6R1.4 NC1CNC1=O MCULE-3943057121 [0,1,0,0,1,0|1,0,0]=3 3976 B6R1.4 NC1COC1=O MCULE-6998565452 [0,1,0,0,1,0|1,0,0]=3 3977 B6R1.4 NN1CCC1=O MCULE-6200802911 [0,1,0,0,1,0|1,0,0]=3 3978 B6R1.4 NN1CCC1=O MCULE-8249778821 [0,1,0,0,1,0|1,0,0]=3 3979 B6R1.4 N[C@@H]1CC[C@@H]1O MCULE-1054283097 [0,1,0,0,1,0|0,0,2]=4 3980 B6R1.4 N[C@@H]1CC[C@@H]1O MCULE-3905992171 [0,1,0,0,1,0|0,0,2]=4 3981 B6R1.4 N[C@@H]1CC[C@@H]1O MCULE-6111990015 [0,1,0,0,1,0|0,0,2]=4 3982 B6R1.4 N[C@@H]1CC[C@@H]1O MCULE-9101755956 [0,1,0,0,1,0|0,0,2]=4 3983 B6R1.4 N[C@@H]1CC[C@H]1N MCULE-6204977772 [0,1,0,0,1,0|1,0,1]=4 3984 B6R1.4 N[C@@H]1CC[C@H]1O MCULE-1883601377 [0,1,0,0,1,0|0,0,2]=4 3985 B6R1.4 N[C@@H]1CC[C@H]1O MCULE-6045787726 [0,1,0,0,1,0|0,0,2]=4 3986 B6R1.4 N[C@@H]1CC[C@H]1O MCULE-7120290402 [0,1,0,0,1,0|0,0,2]=4 3987 B6R1.4 N[C@@H]1CC[C@H]1O MCULE-8603369729 [0,1,0,0,1,0|0,0,2]=4 3988 B6R1.4 N[C@@H]1CNC1=O MCULE-3645662662 [0,1,0,0,1,0|1,0,0]=3 3989 B6R1.4 N[C@@H]1CNC1=O MCULE-4399212271 [0,1,0,0,1,0|1,0,0]=3 3990 B6R1.4 N[C@@H]1CNC1=O MCULE-6332076219 [0,1,0,0,1,0|1,0,0]=3 3991 B6R1.4 N[C@@H]1CNC1=O MCULE-6365012530 [0,1,0,0,1,0|1,0,0]=3 3992 B6R1.4 N[C@@H]1COC1=O MCULE-8080548213 [0,1,0,0,1,0|1,0,0]=3 3993 B6R1.4 N[C@@H]1COC1=O MCULE-9370092691 [0,1,0,0,1,0|1,0,0]=3 3994 B6R1.4 N[C@H]1CC[C@@H]1N MCULE-3551063683 [0,1,0,0,1,0|1,0,1]=4 3995 B6R1.4 N[C@H]1CC[C@@H]1O MCULE-1761694918 [0,1,0,0,1,0|0,0,2]=4 3996 B6R1.4 N[C@H]1CC[C@@H]1O MCULE-2828590958 [0,1,0,0,1,0|0,0,2]=4 3997 B6R1.4 N[C@H]1CC[C@@H]1O MCULE-3261752057 [0,1,0,0,1,0|0,0,2]=4 3998 B6R1.4 N[C@H]1CC[C@@H]1O MCULE-7711512049 [0,1,0,0,1,0|0,0,2]=4 3999 B6R1.4 N[C@H]1CC[C@H]1N MCULE-2823061893 [0,1,0,0,1,0|1,0,1]=4 4000 B6R1.4 N[C@H]1CC[C@H]1N MCULE-6752412872 [0,1,0,0,1,0|1,0,1]=4 4001 B6R1.4 N[C@H]1CC[C@H]1O MCULE-3204268809 [0,1,0,0,1,0|0,0,2]=4 4002 B6R1.4 N[C@H]1CC[C@H]1O MCULE-4184135738 [0,1,0,0,1,0|0,0,2]=4 4003 B6R1.4 N[C@H]1CNC1=O MCULE-2792436534 [0,1,0,0,1,0|1,0,0]=3 4004 B6R1.4 N[C@H]1CNC1=O MCULE-6881316562 [0,1,0,0,1,0|1,0,0]=3 4005 B6R1.4 N[C@H]1CNC1=O MCULE-8864053661 [0,1,0,0,1,0|1,0,0]=3 4006 B6R1.4 N[C@H]1CNC1=O MCULE-9014449253 [0,1,0,0,1,0|1,0,0]=3 4007 B6R1.4 N[C@H]1COC1=O MCULE-4812631526 [0,1,0,0,1,0|1,0,0]=3 4008 B6R1.4 O=C1CCC1Br MCULE-1088592133 [0,1,0,0,1,0|0,0,0]=2 4009 B6R1.4 O=C1CCC1F MCULE-6197375881 [0,1,0,0,1,0|0,0,0]=2 4010 B6R1.4 O=C1CCC1O MCULE-1248327203 [0,1,0,0,1,0|0,0,0]=2 4011 B6R1.4 O=C1CC[C@@H]1Br MCULE-3455449754 [0,1,0,0,1,0|0,0,0]=2 4012 B6R1.4 OC1CCC1O MCULE-3286787157 [0,1,0,0,1,0|0,0,2]=4 4013 B6R1.4 O[C@@H]1CC[C@H]1O MCULE-5060593050 [0,1,0,0,1,0|0,0,2]=4 4014 B6R1.4 O[C@@H]1CC[C@H]1O MCULE-6357622033 [0,1,0,0,1,0|0,0,2]=4 4015 B6R1.4 O[C@H]1CC[C@H]1O MCULE-7964152901 [0,1,0,0,1,0|0,0,2]=4 4016 B6R1.4 [C@@H]1(COC1=O)N MCULE-7456320845 [0,1,0,0,1,0|1,0,0]=3 4017 B6R1.5 C=C1CC(=O)O1 MCULE-7149487095 [0,1,0,0,1,0|1,0,1]=4 4018 B6R1.5 C=C1CC(C1)N MCULE-4635717695 [0,1,0,0,1,0|1,0,0]=3 4019 B6R1.5 C=C1CC(C1)N MCULE-6992894696 [0,1,0,0,1,0|1,0,0]=3 4020 B6R1.5 CC1CC(=O)C1 MCULE-2159393653 [0,1,0,0,1,0|0,0,0]=2 4021 B6R1.5 CC1CC(=O)N1 MCULE-6139592633 [0,1,0,0,1,0|1,0,0]=3 4022 B6R1.5 CC1CC(=O)O1 MCULE-9285847382 [0,1,0,0,1,0|1,0,0]=3 4023 B6R1.5 CC1CC(C1)N MCULE-5323299846 [0,1,0,0,1,0|1,0,1]=4 4024 B6R1.5 CC1CC(C1)N MCULE-9940885824 [0,1,0,0,1,0|1,0,1]=4 4025 B6R1.5 CC1CC(C1)O MCULE-8612661286 [0,1,0,0,1,0|0,0,2]=4 4026 B6R1.5 CN1CC(=O)C1 MCULE-1685267969 [0,1,0,0,1,0|1,0,0]=3 4027 B6R1.5 CN1CC(=O)C1 MCULE-2242594777 [0,1,0,0,1,0|1,0,0]=3 4028 B6R1.5 CN1CC(C1)Cl MCULE-8475620447 [0,1,0,0,1,0|2,0,0]=4 4029 B6R1.5 CN1CC(C1)Cl MCULE-8543507391 [0,1,0,0,1,0|2,0,0]=4 4030 B6R1.5 CN1CC(C1)N MCULE-2180239206 [0,1,0,0,1,0|2,0,0]=4 4031 B6R1.5 CN1CC(C1)N MCULE-4181047352 [0,1,0,0,1,0|2,0,0]=4 4032 B6R1.5 CN1CC(C1)O MCULE-2897194266 [0,1,0,0,1,0|2,0,0]=4 4033 B6R1.5 CN1CC(C1)O MCULE-3717153558 [0,1,0,0,1,0|2,0,0]=4 4034 B6R1.5 CN1CC(C1)O MCULE-7229396078 [0,1,0,0,1,0|2,0,0]=4 4035 B6R1.5 C[C@@H]1CC(=O)O1 MCULE-3257475519 [0,1,0,0,1,0|1,0,0]=3 4036 B6R1.5 C[C@H]1C[C@@H](C1)N MCULE-1535311916 [0,1,0,0,1,0|1,0,1]=4 4037 B6R1.5 C[C@H]1C[C@@H](C1)N MCULE-2831484375 [0,1,0,0,1,0|1,0,1]=4 4038 B6R1.5 C[C@H]1C[C@H](C1)N MCULE-7323273959 [0,1,0,0,1,0|1,0,1]=4 4039 B6R1.5 C[C@H]1C[C@H](C1)N MCULE-9517005721 [0,1,0,0,1,0|1,0,1]=4 4040 B6R1.5 C[C@H]1C[C@H](C1)O MCULE-9757332081 [0,1,0,0,1,0|0,0,2]=4 4041 B6R1.5 NC1CC(=O)C1 MCULE-3450860282 [0,1,0,0,1,0|0,0,0]=2 4042 B6R1.5 NC1CC(=O)C1 MCULE-5974961836 [0,1,0,0,1,0|0,0,0]=2 4043 B6R1.5 NC1CC(C1)Br MCULE-1024702653 [0,1,0,0,1,0|1,0,1]=4 4044 B6R1.5 NC1CC(C1)Br MCULE-6956910745 [0,1,0,0,1,0|1,0,1]=4 4045 B6R1.5 NC1CC(C1)Cl MCULE-2079032271 [0,1,0,0,1,0|1,0,1]=4 4046 B6R1.5 NC1CC(C1)Cl MCULE-9907911910 [0,1,0,0,1,0|1,0,1]=4 4047 B6R1.5 NC1CC(C1)F MCULE-8668562856 [0,1,0,0,1,0|1,0,1]=4 4048 B6R1.5 NC1CC(C1)F MCULE-9413732351 [0,1,0,0,1,0|1,0,1]=4 4049 B6R1.5 NC1CC(C1)N MCULE-2499828215 [0,1,0,0,1,0|1,0,1]=4 4050 B6R1.5 NC1CC(C1)N MCULE-9585725038 [0,1,0,0,1,0|1,0,1]=4 4051 B6R1.5 NC1CC(C1)O MCULE-3800806511 [0,1,0,0,1,0|0,0,2]=4 4052 B6R1.5 NC1CC(C1)O MCULE-4101412744 [0,1,0,0,1,0|0,0,2]=4 4053 B6R1.5 NN1CC(C1)O MCULE-1883589988 [0,1,0,0,1,0|2,0,0]=4 4054 B6R1.5 NN1CC(C1)O MCULE-4736517920 [0,1,0,0,1,0|2,0,0]=4 4055 B6R1.5 N[C@H]1C[C@@H](C1)Br MCULE-2563959776 [0,1,0,0,1,0|1,0,1]=4 4056 B6R1.5 N[C@H]1C[C@@H](C1)Br MCULE-4159438704 [0,1,0,0,1,0|1,0,1]=4 4057 B6R1.5 N[C@H]1C[C@@H](C1)F MCULE-1693657713 [0,1,0,0,1,0|1,0,1]=4 4058 B6R1.5 N[C@H]1C[C@@H](C1)F MCULE-2842964955 [0,1,0,0,1,0|1,0,1]=4 4059 B6R1.5 N[C@H]1C[C@@H](C1)N MCULE-7371432215 [0,1,0,0,1,0|1,0,1]=4 4060 B6R1.5 N[C@H]1C[C@@H](C1)O MCULE-3690359453 [0,1,0,0,1,0|0,0,2]=4 4061 B6R1.5 N[C@H]1C[C@@H](C1)O MCULE-6031478808 [0,1,0,0,1,0|0,0,2]=4 4062 B6R1.5 N[C@H]1C[C@H](C1)F MCULE-7248556800 [0,1,0,0,1,0|1,0,1]=4 4063 B6R1.5 N[C@H]1C[C@H](C1)F MCULE-8169894230 [0,1,0,0,1,0|1,0,1]=4 4064 B6R1.5 N[C@H]1C[C@H](C1)N MCULE-2358029728 [0,1,0,0,1,0|1,0,1]=4 4065 B6R1.5 N[C@H]1C[C@H](C1)N MCULE-8703864989 [0,1,0,0,1,0|1,0,1]=4 4066 B6R1.5 N[C@H]1C[C@H](C1)O MCULE-2367486822 [0,1,0,0,1,0|0,0,2]=4 4067 B6R1.5 N[C@H]1C[C@H](C1)O MCULE-2477923057 [0,1,0,0,1,0|0,0,2]=4 4068 B6R1.5 O=C1CC(C1)Br MCULE-1715982282 [0,1,0,0,1,0|0,0,0]=2 4069 B6R1.5 O=C1CC(C1)F MCULE-2541516698 [0,1,0,0,1,0|0,0,0]=2 4070 B6R1.5 O=C1CC(C1)O MCULE-7099112258 [0,1,0,0,1,0|0,0,0]=2 4071 B6R1.5 OC1CC(C1)Br MCULE-8550195809 [0,1,0,0,1,0|0,0,2]=4 4072 B6R1.5 OC1CC(C1)F MCULE-7130501241 [0,1,0,0,1,0|0,0,2]=4 4073 B6R1.5 OC1CC(C1)O MCULE-4391504671 [0,1,0,0,1,0|0,0,2]=4 4074 B6R1.5 O[C@H]1C[C@@H](C1)F MCULE-8960643165 [0,1,0,0,1,0|0,0,2]=4 4075 B6R1.5 O[C@H]1C[C@@H](C1)O MCULE-5524471729 [0,1,0,0,1,0|0,0,2]=4 4076 B6R1.5 O[C@H]1C[C@H](C1)O MCULE-7725166436 [0,1,0,0,1,0|0,0,2]=4 4077 B6R1.5 [C@@H]1(C[C@@H](C1)N)N MCULE-6268630823 [0,1,0,0,1,0|1,0,1]=4 4078 B6R1.5 [C@@H]1(C[C@H](C1)F)O MCULE-5214761916 [0,1,0,0,1,0|0,0,2]=4 4079 B6R1.6 BrCC1CCC1 MCULE-6307620219 [0,1,0,0,1,0|1,0,1]=4 4080 B6R1.6 C#CC1CCC1 MCULE-3076610847 [0,1,0,0,1,0|1,0,1]=4 4081 B6R1.6 CNC1CCC1 MCULE-1364608179 [0,1,0,0,1,0|1,0,1]=4 4082 B6R1.6 CNC1CCC1 MCULE-2951993315 [0,1,0,0,1,0|1,0,1]=4 4083 B6R1.6 ClCC1CCC1 MCULE-2464596839 [0,1,0,0,1,0|1,0,1]=4 4084 B6R1.6 ICC1CCC1 MCULE-7767711699 [0,1,0,0,1,0|1,0,1]=4 4085 B6R1.6 N#CC1CCC1 MCULE-3335810526 [0,1,0,0,1,0|1,0,1]=4 4086 B6R1.6 NCC1CCC1 MCULE-4977602211 [0,1,0,0,1,0|1,0,1]=4 4087 B6R1.6 NCC1CCC1 MCULE-8434128112 [0,1,0,0,1,0|1,0,1]=4 4088 B6R1.6 NNC1CCC1 MCULE-2058855063 [0,1,0,0,1,0|1,0,1]=4 4089 B6R1.6 NNC1CCC1 MCULE-2355527907 [0,1,0,0,1,0|1,0,1]=4 4090 B6R1.6 NNC1CCC1 MCULE-7674249555 [0,1,0,0,1,0|1,0,1]=4 4091 B6R1.6 NOC1CCC1 MCULE-2140396646 [0,1,0,0,1,0|0,0,2]=4 4092 B6R1.6 NOC1CCC1 MCULE-9347173321 [0,1,0,0,1,0|0,0,2]=4 4093 B6R1.6 O=CC1CCC1 MCULE-8678026416 [0,1,0,0,1,0|0,0,1]=3 4094 B6R1.6 O=CC1COC1 MCULE-3773699476 [0,1,0,0,1,0|1,0,1]=4 4095 B6R1.6 O=CC1CSC1 MCULE-2648443908 [0,1,0,0,1,0|1,0,1]=4 4096 B6R1.6 OCC1CCC1 MCULE-3046613150 [0,1,0,0,1,0|0,0,2]=4 4097 B6R1.6 ON=C1CCC1 MCULE-4777625640 [0,1,0,0,1,0|0,0,1]=3 4098 B6R1.6 SCC1CCC1 MCULE-4083757063 [0,1,0,0,1,0|0,1,1]=4 4099 B6R1.10 CC1(CCC1)N MCULE-1932351179 [0,1,0,0,1,0|1,0,1]=4 4100 B6R1.10 CC1(CCC1)N MCULE-9177696302 [0,1,0,0,1,0|1,0,1]=4 4101 B6R1.10 CC1(CCC1)O MCULE-4021675717 [0,1,0,0,1,0|0,0,2]=4 4102 B6R1.10 C[Si]1(CCC1)C MCULE-9944003023 [0,1,0,0,1,0|1,1,0]=4 4103 B6R1.10 C[Si]1(CCC1)Cl MCULE-2261277636 [0,1,0,0,1,0|1,1,0]=4 4104 B6R1.10 Cl[Si]1(CCC1)Cl MCULE-2198954294 [0,1,0,0,1,0|1,1,0]=4 4105 B6R1.10 N=S1(=O)CCC1 MCULE-7690864417 [0,1,0,0,1,0|1,0,0]=3 4106 B6R1.10 O=S1(=O)CCC1 MCULE-7796411172 [0,1,0,0,1,0|1,0,0]=3 4107 B6R1.10 O=S1(=O)CCN1 MCULE-8786764000 [0,1,0,0,1,0|2,0,0]=4 4108 B8R1.2 BrC=C1CCCCC1 MCULE-1203677785 [0,1,0,0,0,1|1,0,0]=3 4109 B8R1.2 BrCC1=CCCCC1 MCULE-4196033923 [0,1,0,0,0,1|1,0,0]=3 4110 B8R1.2 BrCC1CCCCC1 MCULE-1732610761 [0,1,0,0,0,1|1,0,1]=4 4111 B8R1.2 BrCC1CCCCN1 MCULE-2625695671 [0,1,0,0,0,1|1,0,1]=4 4112 B8R1.2 BrCC1CCCCN1 MCULE-9807498006 [0,1,0,0,0,1|1,0,1]=4 4113 B8R1.2 BrCC1CCCCO1 MCULE-7555024882 [0,1,0,0,0,1|1,0,1]=4 4114 B8R1.2 BrCC1CCCNC1 MCULE-1688987947 [0,1,0,0,0,1|1,0,1]=4 4115 B8R1.2 BrCC1CCCNC1 MCULE-4639020810 [0,1,0,0,0,1|1,0,1]=4 4116 B8R1.2 BrCC1CCCNC1 MCULE-8872043199 [0,1,0,0,0,1|1,0,1]=4 4117 B8R1.2 BrCC1CCCOC1 MCULE-8233955986 [0,1,0,0,0,1|1,0,1]=4 4118 B8R1.2 BrCC1CCNCC1 MCULE-1902670324 [0,1,0,0,0,1|1,0,1]=4 4119 B8R1.2 BrCC1CCNCC1 MCULE-8151707836 [0,1,0,0,0,1|1,0,1]=4 4120 B8R1.2 BrCC1CCNCC1 MCULE-9263446096 [0,1,0,0,0,1|1,0,1]=4 4121 B8R1.2 BrCC1CCOCC1 MCULE-9730123228 [0,1,0,0,0,1|1,0,1]=4 4122 B8R1.2 BrCC1CCSCC1 MCULE-8599747764 [0,1,0,0,0,1|1,0,1]=4 4123 B8R1.2 BrC[C@H]1CCCOC1 MCULE-4617251201 [0,1,0,0,0,1|1,0,1]=4 4124 B8R1.2 C#CC1=CCCCC1 MCULE-2729587527 [0,1,0,0,0,1|1,0,0]=3 4125 B8R1.2 C#CC1CCCCC1 MCULE-1010712187 [0,1,0,0,0,1|1,0,1]=4 4126 B8R1.2 C#CC1CCCCN1 MCULE-4194715110 [0,1,0,0,0,1|1,0,1]=4 4127 B8R1.2 C#CC1CCCCN1 MCULE-7315074830 [0,1,0,0,0,1|1,0,1]=4 4128 B8R1.2 C#CC1CCCCO1 MCULE-3115070208 [0,1,0,0,0,1|1,0,1]=4 4129 B8R1.2 C#CC1CCCNC1 MCULE-1179885650 [0,1,0,0,0,1|1,0,1]=4 4130 B8R1.2 C#CC1CCCNC1 MCULE-6709114437 [0,1,0,0,0,1|1,0,1]=4 4131 B8R1.2 C#CC1CCCOC1 MCULE-3580388819 [0,1,0,0,0,1|1,0,1]=4 4132 B8R1.2 C#CC1CCNCC1 MCULE-1596796356 [0,1,0,0,0,1|1,0,1]=4 4133 B8R1.2 C#CC1CCNCC1 MCULE-6018312042 [0,1,0,0,0,1|1,0,1]=4 4134 B8R1.2 C#CC1CCOCC1 MCULE-1570710029 [0,1,0,0,0,1|1,0,1]=4 4135 B8R1.2 C#CC1CCSCC1 MCULE-7808338504 [0,1,0,0,0,1|1,0,1]=4 4136 B8R1.2 C#C[C@H]1CCCNC1 MCULE-3215954588 [0,1,0,0,0,1|1,0,1]=4 4137 B8R1.2 C#C[C@H]1CCCNC1 MCULE-6736017757 [0,1,0,0,0,1|1,0,1]=4 4138 B8R1.2 C/N=C\1/[NH2+]CCCS1 MCULE-7599934566 [0,1,0,0,0,1|2,0,0]=4 4139 B8R1.2 C1(CCCCN1)CO MCULE-7414417382 [0,1,0,0,0,1|0,0,2]=4 4140 B8R1.2 C1(CCCCO1)CC MCULE-5189391029 [0,1,0,0,0,1|1,0,1]=4 4141 B8R1.2 C1(CCCNC1)C#N MCULE-1172317679 [0,1,0,0,0,1|1,0,1]=4 4142 B8R1.2 C1(CCCNC1)C#N MCULE-9972435731 [0,1,0,0,0,1|1,0,1]=4 4143 B8R1.2 C1(CCCNC1)OC MCULE-1114013355 [0,1,0,0,0,1|0,0,2]=4 4144 B8R1.2 C1(CCCNC1)OC MCULE-4203507585 [0,1,0,0,0,1|0,0,2]=4 4145 B8R1.2 C1(CCCOC1)CN MCULE-9009856435 [0,1,0,0,0,1|1,0,1]=4 4146 B8R1.2 C=CC1CCCCC1 MCULE-5657998956 [0,1,0,0,0,1|1,0,1]=4 4147 B8R1.2 C=CC1CCCCN1 MCULE-1327502475 [0,1,0,0,0,1|1,0,1]=4 4148 B8R1.2 C=CC1CCCCN1 MCULE-7059257921 [0,1,0,0,0,1|1,0,1]=4 4149 B8R1.2 C=CC1CCCNC1 MCULE-4200920592 [0,1,0,0,0,1|1,0,1]=4 4150 B8R1.2 C=CC1CCCNC1 MCULE-5849078027 [0,1,0,0,0,1|1,0,1]=4 4151 B8R1.2 C=CC1CCNCC1 MCULE-1082479185 [0,1,0,0,0,1|1,0,1]=4 4152 B8R1.2 C=CC1CCNCC1 MCULE-1750757751 [0,1,0,0,0,1|1,0,1]=4 4153 B8R1.2 CC=C1CCCCC1 MCULE-6327883518 [0,1,0,0,0,1|1,0,0]=3 4154 B8R1.2 CCC1=NCCCC1 MCULE-5828184755 [0,1,0,0,0,1|1,0,0]=3 4155 B8R1.2 CCC1CCCCC1 MCULE-9302115958 [0,1,0,0,0,1|1,0,1]=4 4156 B8R1.2 CCC1CCCCN1 MCULE-1463828922 [0,1,0,0,0,1|1,0,1]=4 4157 B8R1.2 CCC1CCCCN1 MCULE-4345537199 [0,1,0,0,0,1|1,0,1]=4 4158 B8R1.2 CCC1CCCCN1 MCULE-4598810496 [0,1,0,0,0,1|1,0,1]=4 4159 B8R1.2 CCC1CCCCN1 MCULE-6373382965 [0,1,0,0,0,1|1,0,1]=4 4160 B8R1.2 CCC1CCCNC1 MCULE-1867940470 [0,1,0,0,0,1|1,0,1]=4 4161 B8R1.2 CCC1CCCNC1 MCULE-4023638399 [0,1,0,0,0,1|1,0,1]=4 4162 B8R1.2 CCC1CCNCC1 MCULE-3584183153 [0,1,0,0,0,1|1,0,1]=4 4163 B8R1.2 CCC1CCNCC1 MCULE-6344088971 [0,1,0,0,0,1|1,0,1]=4 4164 B8R1.2 CCN1CCCCC1 MCULE-4079252361 [0,1,0,0,0,1|2,0,0]=4 4165 B8R1.2 CCN1CCNCC1 MCULE-8430742064 [0,1,0,0,0,1|2,0,0]=4 4166 B8R1.2 CCN1CCOCC1 MCULE-6162178461 [0,1,0,0,0,1|2,0,0]=4 4167 B8R1.2 CC[C@@H]1CCCCN1 MCULE-1012550179 [0,1,0,0,0,1|1,0,1]=4 4168 B8R1.2 CC[C@@H]1CCCCN1 MCULE-6669069574 [0,1,0,0,0,1|1,0,1]=4 4169 B8R1.2 CC[C@@H]1CCCCN1 MCULE-7355467130 [0,1,0,0,0,1|1,0,1]=4 4170 B8R1.2 CC[C@@H]1CCCCN1 MCULE-7542229673 [0,1,0,0,0,1|1,0,1]=4 4171 B8R1.2 CC[C@H]1CCCCN1 MCULE-2554275022 [0,1,0,0,0,1|1,0,1]=4 4172 B8R1.2 CC[C@H]1CCCCN1 MCULE-3433938348 [0,1,0,0,0,1|1,0,1]=4 4173 B8R1.2 CC[C@H]1CCCCN1 MCULE-5134937129 [0,1,0,0,0,1|1,0,1]=4 4174 B8R1.2 CC[C@H]1CCCCN1 MCULE-9567977241 [0,1,0,0,0,1|1,0,1]=4 4175 B8R1.2 CNC1CCCCC1 MCULE-8593678924 [0,1,0,0,0,1|1,0,1]=4 4176 B8R1.2 CNC1CCCNC1 MCULE-4055178365 [0,1,0,0,0,1|1,0,1]=4 4177 B8R1.2 CNC1CCCNC1 MCULE-6973115629 [0,1,0,0,0,1|1,0,1]=4 4178 B8R1.2 CNC1CCCNC1 MCULE-8798931831 [0,1,0,0,0,1|1,0,1]=4 4179 B8R1.2 CNC1CCCOC1 MCULE-5347484719 [0,1,0,0,0,1|1,0,1]=4 4180 B8R1.2 CNC1CCCOC1 MCULE-9684329786 [0,1,0,0,0,1|1,0,1]=4 4181 B8R1.2 CNC1CCCSC1 MCULE-1133400404 [0,1,0,0,0,1|1,0,1]=4 4182 B8R1.2 CNC1CCCSC1 MCULE-7973096065 [0,1,0,0,0,1|1,0,1]=4 4183 B8R1.2 CNC1CCNCC1 MCULE-6977456206 [0,1,0,0,0,1|1,0,1]=4 4184 B8R1.2 CNC1CCNCC1 MCULE-7209675133 [0,1,0,0,0,1|1,0,1]=4 4185 B8R1.2 CNC1CCOCC1 MCULE-1492283397 [0,1,0,0,0,1|1,0,1]=4 4186 B8R1.2 CNC1CCOCC1 MCULE-7569572729 [0,1,0,0,0,1|1,0,1]=4 4187 B8R1.2 CNC1CCSCC1 MCULE-4357067702 [0,1,0,0,0,1|1,0,1]=4 4188 B8R1.2 CNC1CCSCC1 MCULE-4754451029 [0,1,0,0,0,1|1,0,1]=4 4189 B8R1.2 CNC1CCSCC1 MCULE-5928537305 [0,1,0,0,0,1|1,0,1]=4 4190 B8R1.2 CN[C@@H]1CCCOC1 MCULE-4540841602 [0,1,0,0,0,1|1,0,1]=4 4191 B8R1.2 CN[C@@H]1CCCOC1 MCULE-6421899072 [0,1,0,0,0,1|1,0,1]=4 4192 B8R1.2 CN[C@H]1CCCNC1 MCULE-5028194287 [0,1,0,0,0,1|1,0,1]=4 4193 B8R1.2 CN[C@H]1CCCNC1 MCULE-5432117284 [0,1,0,0,0,1|1,0,1]=4 4194 B8R1.2 CN[C@H]1CCCNC1 MCULE-8038385178 [0,1,0,0,0,1|1,0,1]=4 4195 B8R1.2 CN[C@H]1CCCOC1 MCULE-2085945812 [0,1,0,0,0,1|1,0,1]=4 4196 B8R1.2 CN[C@H]1CCCOC1 MCULE-3537766000 [0,1,0,0,0,1|1,0,1]=4 4197 B8R1.2 COC1=CCCCC1 MCULE-9079372045 [0,1,0,0,0,1|0,0,1]=3 4198 B8R1.2 COC1=CCOCC1 MCULE-8337045524 [0,1,0,0,0,1|0,0,2]=4 4199 B8R1.2 COC1=NCCCC1 MCULE-3080988027 [0,1,0,0,0,1|0,0,1]=3 4200 B8R1.2 COC1=NCCOC1 MCULE-6346383497 [0,1,0,0,0,1|1,0,1]=4 4201 B8R1.2 COC1CCCCC1 MCULE-2340244681 [0,1,0,0,0,1|0,0,2]=4 4202 B8R1.2 COC1CCCCO1 MCULE-5586923898 [0,1,0,0,0,1|0,0,2]=4 4203 B8R1.2 COC1CCCNC1 MCULE-2428257033 [0,1,0,0,0,1|0,0,2]=4 4204 B8R1.2 COC1CCCNC1 MCULE-8656248481 [0,1,0,0,0,1|0,0,2]=4 4205 B8R1.2 COC1CCNCC1 MCULE-4479092950 [0,1,0,0,0,1|0,0,2]=4 4206 B8R1.2 COC1CCNCC1 MCULE-9875032721 [0,1,0,0,0,1|0,0,2]=4 4207 B8R1.2 CON1CCNCC1 MCULE-1535907405 [0,1,0,0,0,1|1,0,1]=4 4208 B8R1.2 CO[C@@H]1CCCNC1 MCULE-1593626348 [0,1,0,0,0,1|0,0,2]=4 4209 B8R1.2 CO[C@@H]1CCCNC1 MCULE-4085125909 [0,1,0,0,0,1|0,0,2]=4 4210 B8R1.2 CO[C@@H]1CCCNC1 MCULE-6313387662 [0,1,0,0,0,1|0,0,2]=4 4211 B8R1.2 CO[C@@H]1CCCNC1 MCULE-8494307603 [0,1,0,0,0,1|0,0,2]=4 4212 B8R1.2 CO[C@H]1CCCNC1 MCULE-1042411558 [0,1,0,0,0,1|0,0,2]=4 4213 B8R1.2 CO[C@H]1CCCNC1 MCULE-3363706345 [0,1,0,0,0,1|0,0,2]=4 4214 B8R1.2 CO[C@H]1CCCNC1 MCULE-3745051847 [0,1,0,0,0,1|0,0,2]=4 4215 B8R1.2 CO[C@H]1CCCNC1 MCULE-6475889306 [0,1,0,0,0,1|0,0,2]=4 4216 B8R1.2 CSC1=NCCCN1 MCULE-4252949660 [0,1,0,0,0,1|1,1,0]=4 4217 B8R1.2 CSC1=NCCCN1 MCULE-4367422216 [0,1,0,0,0,1|1,1,0]=4 4218 B8R1.2 CSC1=NCCCN1 MCULE-7320602045 [0,1,0,0,0,1|1,1,0]=4 4219 B8R1.2 CSC1=NCCCS1 MCULE-6353934403 [0,1,0,0,0,1|1,1,0]=4 4220 B8R1.2 CSC1=NCCSC1 MCULE-1243311765 [0,1,0,0,0,1|1,1,0]=4 4221 B8R1.2 CSC1CCCCC1 MCULE-5570458252 [0,1,0,0,0,1|0,1,1]=4 4222 B8R1.2 CSC1CCCNC1 MCULE-3462764875 [0,1,0,0,0,1|0,1,1]=4 4223 B8R1.2 CSC1CCCNC1 MCULE-6182151720 [0,1,0,0,0,1|0,1,1]=4 4224 B8R1.2 CSC1CCNCC1 MCULE-1011005935 [0,1,0,0,0,1|0,1,1]=4 4225 B8R1.2 CSC1CCNCC1 MCULE-8269276198 [0,1,0,0,0,1|0,1,1]=4 4226 B8R1.2 ClCC1CCCCC1 MCULE-2364408988 [0,1,0,0,0,1|1,0,1]=4 4227 B8R1.2 ClCC1CCCCN1 MCULE-3215583581 [0,1,0,0,0,1|1,0,1]=4 4228 B8R1.2 ClCC1CCCCN1 MCULE-8949714419 [0,1,0,0,0,1|1,0,1]=4 4229 B8R1.2 ClCC1CCCCO1 MCULE-7493119643 [0,1,0,0,0,1|1,0,1]=4 4230 B8R1.2 ClCC1CCCNC1 MCULE-5655173642 [0,1,0,0,0,1|1,0,1]=4 4231 B8R1.2 ClCC1CCCNC1 MCULE-6782147187 [0,1,0,0,0,1|1,0,1]=4 4232 B8R1.2 ClCC1CCCOC1 MCULE-8502008950 [0,1,0,0,0,1|1,0,1]=4 4233 B8R1.2 ClCC1CCNCC1 MCULE-3291175881 [0,1,0,0,0,1|1,0,1]=4 4234 B8R1.2 ClCC1CCNCC1 MCULE-7012497581 [0,1,0,0,0,1|1,0,1]=4 4235 B8R1.2 ClCC1CCOCC1 MCULE-1211854956 [0,1,0,0,0,1|1,0,1]=4 4236 B8R1.2 ClCN1CCCCC1 MCULE-8272974338 [0,1,0,0,0,1|2,0,0]=4 4237 B8R1.2 ClCN1CCOCC1 MCULE-6980427130 [0,1,0,0,0,1|2,0,0]=4 4238 B8R1.2 ClN=C1CCCCC1 MCULE-6786339883 [0,1,0,0,0,1|1,0,0]=3 4239 B8R1.2 FCC1CCCCN1 MCULE-4091234595 [0,1,0,0,0,1|1,0,1]=4 4240 B8R1.2 FCC1CCCCN1 MCULE-7748360337 [0,1,0,0,0,1|1,0,1]=4 4241 B8R1.2 FCC1CCCNC1 MCULE-4910890691 [0,1,0,0,0,1|1,0,1]=4 4242 B8R1.2 FCC1CCCNC1 MCULE-9227191637 [0,1,0,0,0,1|1,0,1]=4 4243 B8R1.2 FCC1CCNCC1 MCULE-4678768007 [0,1,0,0,0,1|1,0,1]=4 4244 B8R1.2 FCC1CCNCC1 MCULE-6719565621 [0,1,0,0,0,1|1,0,1]=4 4245 B8R1.2 FC[C@@H]1CCCCN1 MCULE-2249718416 [0,1,0,0,0,1|1,0,1]=4 4246 B8R1.2 FC[C@@H]1CCCCN1 MCULE-2335185919 [0,1,0,0,0,1|1,0,1]=4 4247 B8R1.2 FC[C@@H]1CCCCN1 MCULE-7515953101 [0,1,0,0,0,1|1,0,1]=4 4248 B8R1.2 FC[C@@H]1CCCCN1 MCULE-8096430166 [0,1,0,0,0,1|1,0,1]=4 4249 B8R1.2 IC=C1CCCCC1 MCULE-9165742833 [0,1,0,0,0,1|1,0,0]=3 4250 B8R1.2 ICC1CCCCC1 MCULE-7820192716 [0,1,0,0,0,1|1,0,1]=4 4251 B8R1.2 ICC1CCCCN1 MCULE-5434926156 [0,1,0,0,0,1|1,0,1]=4 4252 B8R1.2 ICC1CCCCN1 MCULE-5785133159 [0,1,0,0,0,1|1,0,1]=4 4253 B8R1.2 ICC1CCCCO1 MCULE-4630701067 [0,1,0,0,0,1|1,0,1]=4 4254 B8R1.2 ICC1CCCNC1 MCULE-6140804596 [0,1,0,0,0,1|1,0,1]=4 4255 B8R1.2 ICC1CCCNC1 MCULE-7111371001 [0,1,0,0,0,1|1,0,1]=4 4256 B8R1.2 ICC1CCCOC1 MCULE-7706519514 [0,1,0,0,0,1|1,0,1]=4 4257 B8R1.2 ICC1CCNCC1 MCULE-1905252341 [0,1,0,0,0,1|1,0,1]=4 4258 B8R1.2 ICC1CCNCC1 MCULE-9474318973 [0,1,0,0,0,1|1,0,1]=4 4259 B8R1.2 ICC1CCOCC1 MCULE-1501983761 [0,1,0,0,0,1|1,0,1]=4 4260 B8R1.2 N#CC1=CCCCC1 MCULE-7215745635 [0,1,0,0,0,1|1,0,0]=3 4261 B8R1.2 N#CC1=CCCCO1 MCULE-5646992777 [0,1,0,0,0,1|1,0,1]=4 4262 B8R1.2 N#CC1=CCNCC1 MCULE-2620119006 [0,1,0,0,0,1|1,0,1]=4 4263 B8R1.2 N#CC1=CCNCC1 MCULE-3274888010 [0,1,0,0,0,1|1,0,1]=4 4264 B8R1.2 N#CC1=CCOCC1 MCULE-6283793140 [0,1,0,0,0,1|1,0,1]=4 4265 B8R1.2 N#CC1CCCCC1 MCULE-2156159345 [0,1,0,0,0,1|1,0,1]=4 4266 B8R1.2 N#CC1CCCCN1 MCULE-1697826413 [0,1,0,0,0,1|1,0,1]=4 4267 B8R1.2 N#CC1CCCCN1 MCULE-3334055664 [0,1,0,0,0,1|1,0,1]=4 4268 B8R1.2 N#CC1CCCCN1 MCULE-4086101013 [0,1,0,0,0,1|1,0,1]=4 4269 B8R1.2 N#CC1CCCCN1 MCULE-6025106560 [0,1,0,0,0,1|1,0,1]=4 4270 B8R1.2 N#CC1CCCCO1 MCULE-3506953632 [0,1,0,0,0,1|1,0,1]=4 4271 B8R1.2 N#CC1CCCCS1 MCULE-3643161044 [0,1,0,0,0,1|1,0,1]=4 4272 B8R1.2 N#CC1CCCNC1 MCULE-1330142499 [0,1,0,0,0,1|1,0,1]=4 4273 B8R1.2 N#CC1CCCNC1 MCULE-3633865726 [0,1,0,0,0,1|1,0,1]=4 4274 B8R1.2 N#CC1CCCNC1 MCULE-5925149452 [0,1,0,0,0,1|1,0,1]=4 4275 B8R1.2 N#CC1CCCOC1 MCULE-2931796321 [0,1,0,0,0,1|1,0,1]=4 4276 B8R1.2 N#CC1CCNCC1 MCULE-3389178352 [0,1,0,0,0,1|1,0,1]=4 4277 B8R1.2 N#CC1CCNCC1 MCULE-5337435572 [0,1,0,0,0,1|1,0,1]=4 4278 B8R1.2 N#CC1CCOCC1 MCULE-2478534329 [0,1,0,0,0,1|1,0,1]=4 4279 B8R1.2 N#CC1CCSCC1 MCULE-1212458709 [0,1,0,0,0,1|1,0,1]=4 4280 B8R1.2 N#CN1CCCCC1 MCULE-8529724585 [0,1,0,0,0,1|2,0,0]=4 4281 B8R1.2 N#CN1CCNCC1 MCULE-6779771028 [0,1,0,0,0,1|2,0,0]=4 4282 B8R1.2 N#CN1CCNCC1 MCULE-6854874960 [0,1,0,0,0,1|2,0,0]=4 4283 B8R1.2 N#CN1CCOCC1 MCULE-7233994917 [0,1,0,0,0,1|2,0,0]=4 4284 B8R1.2 N#C[C@@H]1CCCCN1 MCULE-4428095484 [0,1,0,0,0,1|1,0,1]=4 4285 B8R1.2 N#C[C@@H]1CCCCN1 MCULE-4927353010 [0,1,0,0,0,1|1,0,1]=4 4286 B8R1.2 N#C[C@@H]1CCCCN1 MCULE-5087232665 [0,1,0,0,0,1|1,0,1]=4 4287 B8R1.2 N#C[C@@H]1CCCCN1 MCULE-5509246319 [0,1,0,0,0,1|1,0,1]=4 4288 B8R1.2 N#C[C@@H]1CCCCN1 MCULE-6114021285 [0,1,0,0,0,1|1,0,1]=4 4289 B8R1.2 N#C[C@@H]1CCCCN1 MCULE-7595225760 [0,1,0,0,0,1|1,0,1]=4 4290 B8R1.2 N#C[C@@H]1CCCNC1 MCULE-1364055768 [0,1,0,0,0,1|1,0,1]=4 4291 B8R1.2 N#C[C@@H]1CCCNC1 MCULE-3422590356 [0,1,0,0,0,1|1,0,1]=4 4292 B8R1.2 N#C[C@@H]1CCCNC1 MCULE-3766135168 [0,1,0,0,0,1|1,0,1]=4 4293 B8R1.2 N#C[C@@H]1CCCNC1 MCULE-5778643850 [0,1,0,0,0,1|1,0,1]=4 4294 B8R1.2 N#C[C@@H]1CCCNC1 MCULE-6164791583 [0,1,0,0,0,1|1,0,1]=4 4295 B8R1.2 N#C[C@@H]1CCCNC1 MCULE-7171735860 [0,1,0,0,0,1|1,0,1]=4 4296 B8R1.2 N#C[C@H]1CCCCN1 MCULE-3583532381 [0,1,0,0,0,1|1,0,1]=4 4297 B8R1.2 N#C[C@H]1CCCCN1 MCULE-4527493190 [0,1,0,0,0,1|1,0,1]=4 4298 B8R1.2 N#C[C@H]1CCCCN1 MCULE-7988967151 [0,1,0,0,0,1|1,0,1]=4 4299 B8R1.2 N#C[C@H]1CCCCN1 MCULE-9951441572 [0,1,0,0,0,1|1,0,1]=4 4300 B8R1.2 N#C[C@H]1CCCNC1 MCULE-4676068376 [0,1,0,0,0,1|1,0,1]=4 4301 B8R1.2 N#C[C@H]1CCCNC1 MCULE-7483495478 [0,1,0,0,0,1|1,0,1]=4 4302 B8R1.2 N#C[C@H]1CCCNC1 MCULE-8961986217 [0,1,0,0,0,1|1,0,1]=4 4303 B8R1.2 N#C[C@H]1CCCNC1 MCULE-9399922029 [0,1,0,0,0,1|1,0,1]=4 4304 B8R1.2 NCC1=CCCCC1 MCULE-3951635533 [0,1,0,0,0,1|1,0,0]=3 4305 B8R1.2 NCC1=CCCCC1 MCULE-4923330324 [0,1,0,0,0,1|1,0,0]=3 4306 B8R1.2 NCC1=CCCOC1 MCULE-1828364688 [0,1,0,0,0,1|1,0,1]=4 4307 B8R1.2 NCC1=CCCOC1 MCULE-8439895783 [0,1,0,0,0,1|1,0,1]=4 4308 B8R1.2 NCC1=CCOCC1 MCULE-5018009136 [0,1,0,0,0,1|1,0,1]=4 4309 B8R1.2 NCC1=CCOCC1 MCULE-6920828049 [0,1,0,0,0,1|1,0,1]=4 4310 B8R1.2 NCC1=NCCCN1 MCULE-3240095476 [0,1,0,0,0,1|2,0,0]=4 4311 B8R1.2 NCC1=NCCCN1 MCULE-7557068134 [0,1,0,0,0,1|2,0,0]=4 4312 B8R1.2 NCC1CCCCC1 MCULE-3156148976 [0,1,0,0,0,1|1,0,1]=4 4313 B8R1.2 NCC1CCCCC1 MCULE-7375566253 [0,1,0,0,0,1|1,0,1]=4 4314 B8R1.2 NCC1CCCCC1 MCULE-8029432210 [0,1,0,0,0,1|1,0,1]=4 4315 B8R1.2 NCC1CCCCN1 MCULE-5628582900 [0,1,0,0,0,1|1,0,1]=4 4316 B8R1.2 NCC1CCCCN1 MCULE-7762336274 [0,1,0,0,0,1|1,0,1]=4 4317 B8R1.2 NCC1CCCCO1 MCULE-2644735894 [0,1,0,0,0,1|1,0,1]=4 4318 B8R1.2 NCC1CCCCO1 MCULE-5042678896 [0,1,0,0,0,1|1,0,1]=4 4319 B8R1.2 NCC1CCCCS1 MCULE-1705875111 [0,1,0,0,0,1|1,0,1]=4 4320 B8R1.2 NCC1CCCNC1 MCULE-3758525803 [0,1,0,0,0,1|1,0,1]=4 4321 B8R1.2 NCC1CCCNC1 MCULE-4215149964 [0,1,0,0,0,1|1,0,1]=4 4322 B8R1.2 NCC1CCCOC1 MCULE-2859652493 [0,1,0,0,0,1|1,0,1]=4 4323 B8R1.2 NCC1CCCOC1 MCULE-5411442728 [0,1,0,0,0,1|1,0,1]=4 4324 B8R1.2 NCC1CCCOC1 MCULE-6616131288 [0,1,0,0,0,1|1,0,1]=4 4325 B8R1.2 NCC1CCCOC1 MCULE-9893994601 [0,1,0,0,0,1|1,0,1]=4 4326 B8R1.2 NCC1CCCSC1 MCULE-1894328803 [0,1,0,0,0,1|1,0,1]=4 4327 B8R1.2 NCC1CCNCC1 MCULE-3105491297 [0,1,0,0,0,1|1,0,1]=4 4328 B8R1.2 NCC1CCOCC1 MCULE-6047019505 [0,1,0,0,0,1|1,0,1]=4 4329 B8R1.2 NCC1CCOCC1 MCULE-6910667705 [0,1,0,0,0,1|1,0,1]=4 4330 B8R1.2 NCC1CCSCC1 MCULE-1936385423 [0,1,0,0,0,1|1,0,1]=4 4331 B8R1.2 NCC1CCSCC1 MCULE-5910874273 [0,1,0,0,0,1|1,0,1]=4 4332 B8R1.2 NC[C@@H]1CCCCN1 MCULE-2094976900 [0,1,0,0,0,1|1,0,1]=4 4333 B8R1.2 NC[C@@H]1CCCCN1 MCULE-3736890217 [0,1,0,0,0,1|1,0,1]=4 4334 B8R1.2 NC[C@@H]1CCCCO1 MCULE-1435985280 [0,1,0,0,0,1|1,0,1]=4 4335 B8R1.2 NC[C@@H]1CCCCO1 MCULE-4778440271 [0,1,0,0,0,1|1,0,1]=4 4336 B8R1.2 NC[C@@H]1CCCCO1 MCULE-6014338525 [0,1,0,0,0,1|1,0,1]=4 4337 B8R1.2 NC[C@@H]1CCCCO1 MCULE-9488694680 [0,1,0,0,0,1|1,0,1]=4 4338 B8R1.2 NC[C@@H]1CCCNC1 MCULE-4700132151 [0,1,0,0,0,1|1,0,1]=4 4339 B8R1.2 NC[C@@H]1CCCNC1 MCULE-4826798446 [0,1,0,0,0,1|1,0,1]=4 4340 B8R1.2 NC[C@@H]1CCCNC1 MCULE-5621058783 [0,1,0,0,0,1|1,0,1]=4 4341 B8R1.2 NC[C@@H]1CCCOC1 MCULE-5314997557 [0,1,0,0,0,1|1,0,1]=4 4342 B8R1.2 NC[C@@H]1CCCOC1 MCULE-5553412637 [0,1,0,0,0,1|1,0,1]=4 4343 B8R1.2 NC[C@@H]1CCCOC1 MCULE-6349833867 [0,1,0,0,0,1|1,0,1]=4 4344 B8R1.2 NC[C@@H]1CCCOC1 MCULE-6463109886 [0,1,0,0,0,1|1,0,1]=4 4345 B8R1.2 NC[C@H]1CCCCN1 MCULE-2124027272 [0,1,0,0,0,1|1,0,1]=4 4346 B8R1.2 NC[C@H]1CCCCN1 MCULE-5815797207 [0,1,0,0,0,1|1,0,1]=4 4347 B8R1.2 NC[C@H]1CCCCO1 MCULE-2835389541 [0,1,0,0,0,1|1,0,1]=4 4348 B8R1.2 NC[C@H]1CCCCO1 MCULE-4500797236 [0,1,0,0,0,1|1,0,1]=4 4349 B8R1.2 NC[C@H]1CCCCO1 MCULE-5990717573 [0,1,0,0,0,1|1,0,1]=4 4350 B8R1.2 NC[C@H]1CCCCO1 MCULE-7362278601 [0,1,0,0,0,1|1,0,1]=4 4351 B8R1.2 NC[C@H]1CCCNC1 MCULE-1544884485 [0,1,0,0,0,1|1,0,1]=4 4352 B8R1.2 NC[C@H]1CCCNC1 MCULE-1869159747 [0,1,0,0,0,1|1,0,1]=4 4353 B8R1.2 NC[C@H]1CCCNC1 MCULE-5445972707 [0,1,0,0,0,1|1,0,1]=4 4354 B8R1.2 NC[C@H]1CCCNC1 MCULE-5734934526 [0,1,0,0,0,1|1,0,1]=4 4355 B8R1.2 NC[C@H]1CCCNC1 MCULE-9259563350 [0,1,0,0,0,1|1,0,1]=4 4356 B8R1.2 NC[C@H]1CCCOC1 MCULE-1996808023 [0,1,0,0,0,1|1,0,1]=4 4357 B8R1.2 NC[C@H]1CCCOC1 MCULE-8044635428 [0,1,0,0,0,1|1,0,1]=4 4358 B8R1.2 NC[C@H]1CCCOC1 MCULE-8246511133 [0,1,0,0,0,1|1,0,1]=4 4359 B8R1.2 NC[C@H]1CCCOC1 MCULE-8378816563 [0,1,0,0,0,1|1,0,1]=4 4360 B8R1.2 NNC1=NCCCN1 MCULE-4756445413 [0,1,0,0,0,1|2,0,0]=4 4361 B8R1.2 NNC1=NCCCN1 MCULE-9343792606 [0,1,0,0,0,1|2,0,0]=4 4362 B8R1.2 NNC1=NCCCN1 MCULE-9369072019 [0,1,0,0,0,1|2,0,0]=4 4363 B8R1.2 NNC1CCCCC1 MCULE-1043288751 [0,1,0,0,0,1|1,0,1]=4 4364 B8R1.2 NNC1CCCCC1 MCULE-2654277681 [0,1,0,0,0,1|1,0,1]=4 4365 B8R1.2 NNC1CCCCC1 MCULE-3543475794 [0,1,0,0,0,1|1,0,1]=4 4366 B8R1.2 NNC1CCCNC1 MCULE-1142369911 [0,1,0,0,0,1|1,0,1]=4 4367 B8R1.2 NNC1CCCNC1 MCULE-2208379430 [0,1,0,0,0,1|1,0,1]=4 4368 B8R1.2 NNC1CCCNC1 MCULE-2744143558 [0,1,0,0,0,1|1,0,1]=4 4369 B8R1.2 NNC1CCCOC1 MCULE-3363963508 [0,1,0,0,0,1|1,0,1]=4 4370 B8R1.2 NNC1CCCOC1 MCULE-4328194619 [0,1,0,0,0,1|1,0,1]=4 4371 B8R1.2 NNC1CCCOC1 MCULE-6284470956 [0,1,0,0,0,1|1,0,1]=4 4372 B8R1.2 NNC1CCCSC1 MCULE-2745263925 [0,1,0,0,0,1|1,0,1]=4 4373 B8R1.2 NNC1CCCSC1 MCULE-3788828042 [0,1,0,0,0,1|1,0,1]=4 4374 B8R1.2 NNC1CCNCC1 MCULE-3938953701 [0,1,0,0,0,1|1,0,1]=4 4375 B8R1.2 NNC1CCNCC1 MCULE-8657952837 [0,1,0,0,0,1|1,0,1]=4 4376 B8R1.2 NNC1CCNCC1 MCULE-9256934870 [0,1,0,0,0,1|1,0,1]=4 4377 B8R1.2 NNC1CCOCC1 MCULE-2888465129 [0,1,0,0,0,1|1,0,1]=4 4378 B8R1.2 NNC1CCOCC1 MCULE-5648614540 [0,1,0,0,0,1|1,0,1]=4 4379 B8R1.2 NNC1CCOCC1 MCULE-9621286158 [0,1,0,0,0,1|1,0,1]=4 4380 B8R1.2 NNC1CCSCC1 MCULE-1385495890 [0,1,0,0,0,1|1,0,1]=4 4381 B8R1.2 NNC1CCSCC1 MCULE-2488902180 [0,1,0,0,0,1|1,0,1]=4 4382 B8R1.2 NNC1CCSCC1 MCULE-6338456828 [0,1,0,0,0,1|1,0,1]=4 4383 B8R1.2 NN[C@H]1CCCOC1 MCULE-1777058599 [0,1,0,0,0,1|1,0,1]=4 4384 B8R1.2 NN[C@H]1CCCOC1 MCULE-4593180841 [0,1,0,0,0,1|1,0,1]=4 4385 B8R1.2 NOC1CCCCC1 MCULE-1475995970 [0,1,0,0,0,1|0,0,2]=4 4386 B8R1.2 NOC1CCCCC1 MCULE-3638462708 [0,1,0,0,0,1|0,0,2]=4 4387 B8R1.2 NOC1CCCCO1 MCULE-2818785498 [0,1,0,0,0,1|0,0,2]=4 4388 B8R1.2 NOC1CCCNC1 MCULE-5903081349 [0,1,0,0,0,1|0,0,2]=4 4389 B8R1.2 NOC1CCCNC1 MCULE-9939729891 [0,1,0,0,0,1|0,0,2]=4 4390 B8R1.2 NOC1CCOCC1 MCULE-7394034945 [0,1,0,0,0,1|0,0,2]=4 4391 B8R1.2 O=CC1=CCCCC1 MCULE-6209420256 [0,1,0,0,0,1|0,0,0]=2 4392 B8R1.2 O=CC1=CCCOC1 MCULE-5495935874 [0,1,0,0,0,1|0,0,1]=3 4393 B8R1.2 O=CC1=CCCSC1 MCULE-9611960845 [0,1,0,0,0,1|0,0,1]=3 4394 B8R1.2 O=CC1=COCCC1 MCULE-5246467858 [0,1,0,0,0,1|0,0,1]=3 4395 B8R1.2 O=CC1=COCCO1 MCULE-4502742368 [0,1,0,0,0,1|1,0,1]=4 4396 B8R1.2 O=CC1C=CCCC1 MCULE-7360804121 [0,1,0,0,0,1|0,0,2]=4 4397 B8R1.2 O=CC1CC=CCC1 MCULE-4752119585 [0,1,0,0,0,1|0,0,2]=4 4398 B8R1.2 O=CC1CCCCC1 MCULE-7345097178 [0,1,0,0,0,1|0,0,1]=3 4399 B8R1.2 O=CC1CCCCN1 MCULE-7681438476 [0,1,0,0,0,1|0,0,1]=3 4400 B8R1.2 O=CC1CCCCN1 MCULE-9370686295 [0,1,0,0,0,1|0,0,1]=3 4401 B8R1.2 O=CC1CCCCO1 MCULE-6497412510 [0,1,0,0,0,1|0,0,1]=3 4402 B8R1.2 O=CC1CCCNC1 MCULE-4037480911 [0,1,0,0,0,1|0,0,1]=3 4403 B8R1.2 O=CC1CCCNC1 MCULE-9205787069 [0,1,0,0,0,1|0,0,1]=3 4404 B8R1.2 O=CC1CCCOC1 MCULE-6841728518 [0,1,0,0,0,1|0,0,1]=3 4405 B8R1.2 O=CC1CCCSC1 MCULE-8369808876 [0,1,0,0,0,1|0,0,1]=3 4406 B8R1.2 O=CC1CCNCC1 MCULE-3856245073 [0,1,0,0,0,1|0,0,1]=3 4407 B8R1.2 O=CC1CCNCC1 MCULE-8439609130 [0,1,0,0,0,1|0,0,1]=3 4408 B8R1.2 O=CC1CCOCC1 MCULE-6884786677 [0,1,0,0,0,1|0,0,1]=3 4409 B8R1.2 O=CC1CCSCC1 MCULE-4728594373 [0,1,0,0,0,1|0,0,1]=3 4410 B8R1.2 O=CC1COCCO1 MCULE-3817488986 [0,1,0,0,0,1|1,0,1]=4 4411 B8R1.2 O=CN1CCCCC1 MCULE-3028605826 [0,1,0,0,0,1|1,0,0]=3 4412 B8R1.2 O=CN1CCNCC1 MCULE-8359044100 [0,1,0,0,0,1|1,0,0]=3 4413 B8R1.2 O=CN1CCOCC1 MCULE-2465964585 [0,1,0,0,0,1|1,0,0]=3 4414 B8R1.2 O=NN1CC=CCC1 MCULE-2216609455 [0,1,0,0,0,1|1,0,1]=4 4415 B8R1.2 O=NN1CCCCC1 MCULE-6180064865 [0,1,0,0,0,1|1,0,0]=3 4416 B8R1.2 O=NN1CCNCC1 MCULE-7259290085 [0,1,0,0,0,1|1,0,0]=3 4417 B8R1.2 O=NN1CCOCC1 MCULE-8445460226 [0,1,0,0,0,1|1,0,0]=3 4418 B8R1.2 OCC1=CCCCC1 MCULE-2422738199 [0,1,0,0,0,1|0,0,1]=3 4419 B8R1.2 OCC1=CCCCO1 MCULE-1995059172 [0,1,0,0,0,1|0,0,2]=4 4420 B8R1.2 OCC1=CCCOC1 MCULE-5407184933 [0,1,0,0,0,1|0,0,2]=4 4421 B8R1.2 OCC1=CCOCC1 MCULE-6666473990 [0,1,0,0,0,1|0,0,2]=4 4422 B8R1.2 OCC1=NOCCC1 MCULE-7754725295 [0,1,0,0,0,1|1,0,1]=4 4423 B8R1.2 OCC1CCCCC1 MCULE-6571547092 [0,1,0,0,0,1|0,0,2]=4 4424 B8R1.2 OCC1CCCCN1 MCULE-1839660028 [0,1,0,0,0,1|0,0,2]=4 4425 B8R1.2 OCC1CCCCN1 MCULE-5190999833 [0,1,0,0,0,1|0,0,2]=4 4426 B8R1.2 OCC1CCCCO1 MCULE-2390789074 [0,1,0,0,0,1|0,0,2]=4 4427 B8R1.2 OCC1CCCCO1 MCULE-7483291767 [0,1,0,0,0,1|0,0,2]=4 4428 B8R1.2 OCC1CCCCS1 MCULE-8533707311 [0,1,0,0,0,1|0,0,2]=4 4429 B8R1.2 OCC1CCCNC1 MCULE-1126180349 [0,1,0,0,0,1|0,0,2]=4 4430 B8R1.2 OCC1CCCNC1 MCULE-1796388857 [0,1,0,0,0,1|0,0,2]=4 4431 B8R1.2 OCC1CCCNC1 MCULE-3885962581 [0,1,0,0,0,1|0,0,2]=4 4432 B8R1.2 OCC1CCCNC1 MCULE-9246039906 [0,1,0,0,0,1|0,0,2]=4 4433 B8R1.2 OCC1CCCOC1 MCULE-6464024960 [0,1,0,0,0,1|0,0,2]=4 4434 B8R1.2 OCC1CCCOC1 MCULE-9624599290 [0,1,0,0,0,1|0,0,2]=4 4435 B8R1.2 OCC1CCCSC1 MCULE-1730158244 [0,1,0,0,0,1|0,0,2]=4 4436 B8R1.2 OCC1CCNCC1 MCULE-3303736479 [0,1,0,0,0,1|0,0,2]=4 4437 B8R1.2 OCC1CCNCC1 MCULE-5679503328 [0,1,0,0,0,1|0,0,2]=4 4438 B8R1.2 OCC1CCOCC1 MCULE-8259124266 [0,1,0,0,0,1|0,0,2]=4 4439 B8R1.2 OCC1CCSCC1 MCULE-5223983457 [0,1,0,0,0,1|0,0,2]=4 4440 B8R1.2 OC[C@@H]1CCCCN1 MCULE-6170192975 [0,1,0,0,0,1|0,0,2]=4 4441 B8R1.2 OC[C@@H]1CCCCN1 MCULE-7805438267 [0,1,0,0,0,1|0,0,2]=4 4442 B8R1.2 OC[C@@H]1CCCCN1 MCULE-8160671578 [0,1,0,0,0,1|0,0,2]=4 4443 B8R1.2 OC[C@@H]1CCCCO1 MCULE-5978396739 [0,1,0,0,0,1|0,0,2]=4 4444 B8R1.2 OC[C@@H]1CCCCO1 MCULE-8715909099 [0,1,0,0,0,1|0,0,2]=4 4445 B8R1.2 OC[C@@H]1CCCNC1 MCULE-1362591489 [0,1,0,0,0,1|0,0,2]=4 4446 B8R1.2 OC[C@@H]1CCCNC1 MCULE-2943211570 [0,1,0,0,0,1|0,0,2]=4 4447 B8R1.2 OC[C@@H]1CCCNC1 MCULE-8452110091 [0,1,0,0,0,1|0,0,2]=4 4448 B8R1.2 OC[C@@H]1CCCNC1 MCULE-9511978382 [0,1,0,0,0,1|0,0,2]=4 4449 B8R1.2 OC[C@@H]1CCCOC1 MCULE-5580637299 [0,1,0,0,0,1|0,0,2]=4 4450 B8R1.2 OC[C@@H]1CCCOC1 MCULE-9673827278 [0,1,0,0,0,1|0,0,2]=4 4451 B8R1.2 OC[C@H]1CCCCN1 MCULE-1585224164 [0,1,0,0,0,1|0,0,2]=4 4452 B8R1.2 OC[C@H]1CCCCN1 MCULE-2860177964 [0,1,0,0,0,1|0,0,2]=4 4453 B8R1.2 OC[C@H]1CCCCO1 MCULE-4700719427 [0,1,0,0,0,1|0,0,2]=4 4454 B8R1.2 OC[C@H]1CCCCO1 MCULE-7990169259 [0,1,0,0,0,1|0,0,2]=4 4455 B8R1.2 OC[C@H]1CCCNC1 MCULE-3504380705 [0,1,0,0,0,1|0,0,2]=4 4456 B8R1.2 OC[C@H]1CCCNC1 MCULE-6518143765 [0,1,0,0,0,1|0,0,2]=4 4457 B8R1.2 OC[C@H]1CCCNC1 MCULE-6752674060 [0,1,0,0,0,1|0,0,2]=4 4458 B8R1.2 OC[C@H]1CCCNC1 MCULE-9392193352 [0,1,0,0,0,1|0,0,2]=4 4459 B8R1.2 OC[C@H]1CCCOC1 MCULE-8066618329 [0,1,0,0,0,1|0,0,2]=4 4460 B8R1.2 OC[C@H]1CCCOC1 MCULE-8831105119 [0,1,0,0,0,1|0,0,2]=4 4461 B8R1.2 ON=C1CCCCC1 MCULE-4628080057 [0,1,0,0,0,1|0,0,1]=3 4462 B8R1.2 ON=C1CCOCC1 MCULE-4298814584 [0,1,0,0,0,1|0,0,1]=3 4463 B8R1.2 ON=C1CCSCC1 MCULE-4883904053 [0,1,0,0,0,1|0,0,1]=3 4464 B8R1.2 ONC1CCCCC1 MCULE-7854482550 [0,1,0,0,0,1|0,0,2]=4 4465 B8R1.2 O[NH2+]C1CCCCC1 MCULE-5578731568 [0,1,0,0,0,1|0,0,2]=4 4466 B8R1.2 S=CN1CCCCC1 MCULE-9360358622 [0,1,0,0,0,1|1,1,0]=4 4467 B8R1.2 SCC1CCCCC1 MCULE-4073711524 [0,1,0,0,0,1|0,1,1]=4 4468 B8R1.2 SCC1CCCOC1 MCULE-1197721149 [0,1,0,0,0,1|0,1,1]=4 4469 B8R1.2 SCC1CCNCC1 MCULE-3947635428 [0,1,0,0,0,1|0,1,1]=4 4470 B8R1.2 SCC1CCNCC1 MCULE-4731929818 [0,1,0,0,0,1|0,1,1]=4 4471 B8R1.2 SCC1CCOCC1 MCULE-1191986847 [0,1,0,0,0,1|0,1,1]=4 4472 B8R1.2 SCN1CCOCC1 MCULE-1013977666 [0,1,0,0,0,1|1,1,0]=4 4473 B8R1.3 BrC1CCC(NC1)Br MCULE-6328648168 [0,1,0,0,0,1|1,0,1]=4 4474 B8R1.3 C1(CNC(=O)CN1)C MCULE-9891046463 [0,1,0,0,0,1|1,0,0]=3 4475 B8R1.3 C=C1CCC(=O)CC1 MCULE-8766071389 [0,1,0,0,0,1|0,0,0]=2 4476 B8R1.3 C=C1CCC(CC1)C MCULE-8335929583 [0,1,0,0,0,1|1,0,0]=3 4477 B8R1.3 C=C1CCC(CC1)N MCULE-3488509161 [0,1,0,0,0,1|1,0,0]=3 4478 B8R1.3 C=C1CCC(CC1)N MCULE-4928995581 [0,1,0,0,0,1|1,0,0]=3 4479 B8R1.3 C=C1CCN(CC1)C MCULE-8616538841 [0,1,0,0,0,1|1,0,0]=3 4480 B8R1.3 CC1=CCC(=O)CC1 MCULE-5396065385 [0,1,0,0,0,1|0,0,1]=3 4481 B8R1.3 CC1=CCC(CC1)N MCULE-2698586518 [0,1,0,0,0,1|1,0,0]=3 4482 B8R1.3 CC1=NNC(=O)CC1 MCULE-3548202908 [0,1,0,0,0,1|1,0,1]=4 4483 B8R1.3 CC1C=CC(=O)CC1 MCULE-6972928704 [0,1,0,0,0,1|0,0,1]=3 4484 B8R1.3 CC1CC=C(CC1)Cl MCULE-9255462781 [0,1,0,0,0,1|1,0,0]=3 4485 B8R1.3 CC1CCC(=O)CC1 MCULE-5534475096 [0,1,0,0,0,1|0,0,0]=2 4486 B8R1.3 CC1CCC(=O)CC1 MCULE-9038467737 [0,1,0,0,0,1|0,0,0]=2 4487 B8R1.3 CC1CCC(=O)CN1 MCULE-1285022466 [0,1,0,0,0,1|0,0,0]=2 4488 B8R1.3 CC1CCC(=O)CN1 MCULE-9314433387 [0,1,0,0,0,1|0,0,0]=2 4489 B8R1.3 CC1CCC(=O)CO1 MCULE-8334906567 [0,1,0,0,0,1|0,0,0]=2 4490 B8R1.3 CC1CCC(=O)CS1 MCULE-9188619559 [0,1,0,0,0,1|0,0,0]=2 4491 B8R1.3 CC1CCC(=O)NC1 MCULE-1307751847 [0,1,0,0,0,1|0,0,0]=2 4492 B8R1.3 CC1CCC(CC1)Br MCULE-9651780583 [0,1,0,0,0,1|1,0,1]=4 4493 B8R1.3 CC1CCC(CC1)C MCULE-8970080763 [0,1,0,0,0,1|1,0,1]=4 4494 B8R1.3 CC1CCC(CC1)N MCULE-1405299661 [0,1,0,0,0,1|1,0,1]=4 4495 B8R1.3 CC1CCC(CC1)N MCULE-2075843541 [0,1,0,0,0,1|1,0,1]=4 4496 B8R1.3 CC1CCC(CC1)O MCULE-7501628471 [0,1,0,0,0,1|0,0,2]=4 4497 B8R1.3 CC1CCC(CC1)S MCULE-6252839554 [0,1,0,0,0,1|0,1,1]=4 4498 B8R1.3 CC1CCC(CN1)O MCULE-1965969511 [0,1,0,0,0,1|0,0,2]=4 4499 B8R1.3 CC1CCC(CN1)O MCULE-8922826910 [0,1,0,0,0,1|0,0,2]=4 4500 B8R1.3 CC1CCC(CO1)O MCULE-8416383333 [0,1,0,0,0,1|0,0,2]=4 4501 B8R1.3 CC1CCC(NC1)C MCULE-5442214938 [0,1,0,0,0,1|1,0,1]=4 4502 B8R1.3 CC1CCN(CC1)C MCULE-6129657861 [0,1,0,0,0,1|1,0,1]=4 4503 B8R1.3 CC1CCN(CC1)N MCULE-3896858235 [0,1,0,0,0,1|1,0,1]=4 4504 B8R1.3 CC1CCN(CC1)N MCULE-5103609084 [0,1,0,0,0,1|1,0,1]=4 4505 B8R1.3 CC1CCN(CC1)N MCULE-5894508004 [0,1,0,0,0,1|1,0,1]=4 4506 B8R1.3 CC1CNC(=O)CN1 MCULE-2050820306 [0,1,0,0,0,1|1,0,0]=3 4507 B8R1.3 CC1CNC(=O)CN1 MCULE-9509469557 [0,1,0,0,0,1|1,0,0]=3 4508 B8R1.3 CC1CNC(=O)CO1 MCULE-6817757578 [0,1,0,0,0,1|1,0,0]=3 4509 B8R1.3 CC1COC(=O)OC1 MCULE-6795228051 [0,1,0,0,0,1|1,0,0]=3 4510 B8R1.3 CN1CC=C(CC1)Br MCULE-7803632839 [0,1,0,0,0,1|1,0,1]=4 4511 B8R1.3 CN1CC=C(CC1)Br MCULE-9568791028 [0,1,0,0,0,1|1,0,1]=4 4512 B8R1.3 CN1CCC(=O)CC1 MCULE-3370577555 [0,1,0,0,0,1|0,0,0]=2 4513 B8R1.3 CN1CCC(=O)CC1 MCULE-5364011649 [0,1,0,0,0,1|0,0,0]=2 4514 B8R1.3 CN1CCC(CC1)Br MCULE-1146098660 [0,1,0,0,0,1|1,0,1]=4 4515 B8R1.3 CN1CCC(CC1)Br MCULE-1307546960 [0,1,0,0,0,1|1,0,1]=4 4516 B8R1.3 CN1CCC(CC1)Cl MCULE-6976794676 [0,1,0,0,0,1|1,0,1]=4 4517 B8R1.3 CN1CCC(CC1)F MCULE-6071710395 [0,1,0,0,0,1|1,0,1]=4 4518 B8R1.3 CN1CCC(CC1)I MCULE-8070069081 [0,1,0,0,0,1|1,0,1]=4 4519 B8R1.3 CN1CCC(CC1)N MCULE-2266692247 [0,1,0,0,0,1|1,0,1]=4 4520 B8R1.3 CN1CCC(CC1)N MCULE-2525636247 [0,1,0,0,0,1|1,0,1]=4 4521 B8R1.3 CN1CCC(CC1)N MCULE-3769368829 [0,1,0,0,0,1|1,0,1]=4 4522 B8R1.3 CN1CCC(CC1)O MCULE-1769465111 [0,1,0,0,0,1|0,0,2]=4 4523 B8R1.3 CN1CCC(CC1)O MCULE-8742465276 [0,1,0,0,0,1|0,0,2]=4 4524 B8R1.3 CN1CCC(CC1)S MCULE-2316487466 [0,1,0,0,0,1|0,1,1]=4 4525 B8R1.3 CN1CCN(CC1)C MCULE-8120318146 [0,1,0,0,0,1|2,0,0]=4 4526 B8R1.3 CN1CCN(CC1)N MCULE-3727071848 [0,1,0,0,0,1|2,0,0]=4 4527 B8R1.3 CN1CCN(CC1)N MCULE-8384705664 [0,1,0,0,0,1|2,0,0]=4 4528 B8R1.3 C[C@@H]1CCC(=O)CN1 MCULE-4693797730 [0,1,0,0,0,1|0,0,0]=2 4529 B8R1.3 C[C@@H]1CCC(=O)CN1 MCULE-5991774380 [0,1,0,0,0,1|0,0,0]=2 4530 B8R1.3 C[C@@H]1CCC(=O)CN1 MCULE-6484213897 [0,1,0,0,0,1|0,0,0]=2 4531 B8R1.3 C[C@@H]1CCC(=O)CN1 MCULE-7346191190 [0,1,0,0,0,1|0,0,0]=2 4532 B8R1.3 C[C@@H]1CC[C@@H](CN1)O MCULE-1181513126 [0,1,0,0,0,1|0,0,2]=4 4533 B8R1.3 C[C@@H]1CC[C@@H](CN1)O MCULE-1902739569 [0,1,0,0,0,1|0,0,2]=4 4534 B8R1.3 C[C@@H]1CC[C@@H](CN1)O MCULE-4923873245 [0,1,0,0,0,1|0,0,2]=4 4535 B8R1.3 C[C@@H]1CC[C@@H](CN1)O MCULE-5091971479 [0,1,0,0,0,1|0,0,2]=4 4536 B8R1.3 C[C@@H]1CC[C@@H](CN1)O MCULE-7440788820 [0,1,0,0,0,1|0,0,2]=4 4537 B8R1.3 C[C@@H]1CC[C@@H](CN1)O MCULE-8869692501 [0,1,0,0,0,1|0,0,2]=4 4538 B8R1.3 C[C@@H]1CC[C@H](CN1)O MCULE-8099689887 [0,1,0,0,0,1|0,0,2]=4 4539 B8R1.3 C[C@@H]1CC[C@H](CN1)O MCULE-8746216012 [0,1,0,0,0,1|0,0,2]=4 4540 B8R1.3 C[C@@H]1CC[C@H](CN1)O MCULE-9870191339 [0,1,0,0,0,1|0,0,2]=4 4541 B8R1.3 C[C@@H]1CNC(=O)CN1 MCULE-1088991552 [0,1,0,0,0,1|1,0,0]=3 4542 B8R1.3 C[C@@H]1CNC(=O)CN1 MCULE-1952714815 [0,1,0,0,0,1|1,0,0]=3 4543 B8R1.3 C[C@@H]1CNC(=O)CN1 MCULE-3350871833 [0,1,0,0,0,1|1,0,0]=3 4544 B8R1.3 C[C@@H]1CNC(=O)CN1 MCULE-9637742350 [0,1,0,0,0,1|1,0,0]=3 4545 B8R1.3 C[C@@H]1CNC(=O)CO1 MCULE-7192421297 [0,1,0,0,0,1|1,0,0]=3 4546 B8R1.3 C[C@@H]1CNC(=O)CO1 MCULE-7394512903 [0,1,0,0,0,1|1,0,0]=3 4547 B8R1.3 C[C@H]1CCC(=O)CN1 MCULE-6334939841 [0,1,0,0,0,1|0,0,0]=2 4548 B8R1.3 C[C@H]1CCC(=O)CN1 MCULE-8476307649 [0,1,0,0,0,1|0,0,0]=2 4549 B8R1.3 C[C@H]1CCC(=O)NC1 MCULE-5712112445 [0,1,0,0,0,1|0,0,0]=2 4550 B8R1.3 C[C@H]1CC[C@@H](CC1)N MCULE-4582129313 [0,1,0,0,0,1|1,0,1]=4 4551 B8R1.3 C[C@H]1CC[C@@H](CC1)N MCULE-8719793702 [0,1,0,0,0,1|1,0,1]=4 4552 B8R1.3 C[C@H]1CC[C@@H](CC1)O MCULE-9131864343 [0,1,0,0,0,1|0,0,2]=4 4553 B8R1.3 C[C@H]1CC[C@@H](CN1)O MCULE-4342382470 [0,1,0,0,0,1|0,0,2]=4 4554 B8R1.3 C[C@H]1CC[C@@H](CN1)O MCULE-7588845174 [0,1,0,0,0,1|0,0,2]=4 4555 B8R1.3 C[C@H]1CC[C@H](CC1)C MCULE-5381492320 [0,1,0,0,0,1|1,0,1]=4 4556 B8R1.3 C[C@H]1CC[C@H](CC1)N MCULE-5470842973 [0,1,0,0,0,1|1,0,1]=4 4557 B8R1.3 C[C@H]1CC[C@H](CC1)N MCULE-9610267582 [0,1,0,0,0,1|1,0,1]=4 4558 B8R1.3 C[C@H]1CC[C@H](CC1)O MCULE-3495737054 [0,1,0,0,0,1|0,0,2]=4 4559 B8R1.3 C[C@H]1CC[C@H](CN1)O MCULE-1161766631 [0,1,0,0,0,1|0,0,2]=4 4560 B8R1.3 C[C@H]1CC[C@H](CN1)O MCULE-1646727489 [0,1,0,0,0,1|0,0,2]=4 4561 B8R1.3 C[C@H]1CC[C@H](CN1)O MCULE-4706855730 [0,1,0,0,0,1|0,0,2]=4 4562 B8R1.3 C[C@H]1CC[C@H](CN1)O MCULE-6031163394 [0,1,0,0,0,1|0,0,2]=4 4563 B8R1.3 C[C@H]1CNC(=O)CN1 MCULE-3373819559 [0,1,0,0,0,1|1,0,0]=3 4564 B8R1.3 C[C@H]1CNC(=O)CN1 MCULE-4486681671 [0,1,0,0,0,1|1,0,0]=3 4565 B8R1.3 C[C@H]1CNC(=O)CN1 MCULE-7180229103 [0,1,0,0,0,1|1,0,0]=3 4566 B8R1.3 C[C@H]1CNC(=O)CN1 MCULE-9466864223 [0,1,0,0,0,1|1,0,0]=3 4567 B8R1.3 C[C@H]1CNC(=O)CO1 MCULE-6169535590 [0,1,0,0,0,1|1,0,0]=3 4568 B8R1.3 C[C@H]1CNC(=O)CO1 MCULE-8876635175 [0,1,0,0,0,1|1,0,0]=3 4569 B8R1.3 ClC1CCC(CC1)Cl MCULE-4367918159 [0,1,0,0,0,1|1,0,1]=4 4570 B8R1.3 Cl[C@H]1CC[C@@H](CC1)Cl MCULE-8069533472 [0,1,0,0,0,1|1,0,1]=4 4571 B8R1.3 NC1=NCC(CN1)O MCULE-3531969759 [0,1,0,0,0,1|2,0,0]=4 4572 B8R1.3 NC1CC=C(CC1)F MCULE-2544035375 [0,1,0,0,0,1|1,0,0]=3 4573 B8R1.3 NC1CC=C(CC1)F MCULE-8564869491 [0,1,0,0,0,1|1,0,0]=3 4574 B8R1.3 NC1CCC(=O)CC1 MCULE-5825363145 [0,1,0,0,0,1|0,0,0]=2 4575 B8R1.3 NC1CCC(=O)CC1 MCULE-6212878324 [0,1,0,0,0,1|0,0,0]=2 4576 B8R1.3 NC1CCC(=O)NC1 MCULE-2677675224 [0,1,0,0,0,1|0,0,0]=2 4577 B8R1.3 NC1CCC(=O)NC1 MCULE-8711968877 [0,1,0,0,0,1|0,0,0]=2 4578 B8R1.3 NC1CCC(=O)NC1 MCULE-8915391016 [0,1,0,0,0,1|0,0,0]=2 4579 B8R1.3 NC1CCC(CC1)Br MCULE-2984714817 [0,1,0,0,0,1|1,0,1]=4 4580 B8R1.3 NC1CCC(CC1)Br MCULE-7170151428 [0,1,0,0,0,1|1,0,1]=4 4581 B8R1.3 NC1CCC(CC1)Cl MCULE-8982345279 [0,1,0,0,0,1|1,0,1]=4 4582 B8R1.3 NC1CCC(CC1)Cl MCULE-9224760506 [0,1,0,0,0,1|1,0,1]=4 4583 B8R1.3 NC1CCC(CC1)F MCULE-1081012265 [0,1,0,0,0,1|1,0,1]=4 4584 B8R1.3 NC1CCC(CC1)F MCULE-4888084170 [0,1,0,0,0,1|1,0,1]=4 4585 B8R1.3 NC1CCC(CC1)I MCULE-1457514414 [0,1,0,0,0,1|1,0,1]=4 4586 B8R1.3 NC1CCC(CC1)I MCULE-8371155353 [0,1,0,0,0,1|1,0,1]=4 4587 B8R1.3 NC1CCC(CC1)N MCULE-1675686185 [0,1,0,0,0,1|1,0,1]=4 4588 B8R1.3 NC1CCC(CC1)N MCULE-9308852983 [0,1,0,0,0,1|1,0,1]=4 4589 B8R1.3 NC1CCC(CC1)O MCULE-8546049036 [0,1,0,0,0,1|0,0,2]=4 4590 B8R1.3 NC1CCC(CC1)O MCULE-9716076284 [0,1,0,0,0,1|0,0,2]=4 4591 B8R1.3 NC1CCS(=O)CC1 MCULE-3451996362 [0,1,0,0,0,1|1,0,0]=3 4592 B8R1.3 NC1CCS(=O)CC1 MCULE-4019175019 [0,1,0,0,0,1|1,0,0]=3 4593 B8R1.3 NN1CCC(CC1)O MCULE-8397021846 [0,1,0,0,0,1|0,0,2]=4 4594 B8R1.3 N[C@@H]1CCC(=O)NC1 MCULE-5372893548 [0,1,0,0,0,1|0,0,0]=2 4595 B8R1.3 N[C@@H]1CCC(=O)NC1 MCULE-6411408704 [0,1,0,0,0,1|0,0,0]=2 4596 B8R1.3 N[C@@H]1CCC(=O)NC1 MCULE-6771263407 [0,1,0,0,0,1|0,0,0]=2 4597 B8R1.3 N[C@@H]1CCC(=O)NC1 MCULE-9035818807 [0,1,0,0,0,1|0,0,0]=2 4598 B8R1.3 N[C@H]1CCC(=O)NC1 MCULE-1921494480 [0,1,0,0,0,1|0,0,0]=2 4599 B8R1.3 N[C@H]1CCC(=O)NC1 MCULE-4843708987 [0,1,0,0,0,1|0,0,0]=2 4600 B8R1.3 N[C@H]1CCC(=O)NC1 MCULE-6599794889 [0,1,0,0,0,1|0,0,0]=2 4601 B8R1.3 N[C@H]1CCC(=O)NC1 MCULE-7112568050 [0,1,0,0,0,1|0,0,0]=2 4602 B8R1.3 N[C@H]1CCC(=O)NC1 MCULE-9053885307 [0,1,0,0,0,1|0,0,0]=2 4603 B8R1.3 N[C@H]1CCC(=O)NC1 MCULE-9780118077 [0,1,0,0,0,1|0,0,0]=2 4604 B8R1.3 N[C@H]1CC[C@@H](CC1)F MCULE-6396367848 [0,1,0,0,0,1|1,0,1]=4 4605 B8R1.3 N[C@H]1CC[C@@H](CC1)F MCULE-6665686539 [0,1,0,0,0,1|1,0,1]=4 4606 B8R1.3 N[C@H]1CC[C@@H](CC1)N MCULE-5630099425 [0,1,0,0,0,1|1,0,1]=4 4607 B8R1.3 N[C@H]1CC[C@@H](CC1)N MCULE-7746015426 [0,1,0,0,0,1|1,0,1]=4 4608 B8R1.3 N[C@H]1CC[C@@H](CC1)O MCULE-5499393551 [0,1,0,0,0,1|0,0,2]=4 4609 B8R1.3 N[C@H]1CC[C@@H](CC1)O MCULE-8986905038 [0,1,0,0,0,1|0,0,2]=4 4610 B8R1.3 N[C@H]1CC[C@H](CC1)N MCULE-6319475446 [0,1,0,0,0,1|1,0,1]=4 4611 B8R1.3 N[C@H]1CC[C@H](CC1)N MCULE-6552936289 [0,1,0,0,0,1|1,0,1]=4 4612 B8R1.3 N[C@H]1CC[C@H](CC1)O MCULE-2039471973 [0,1,0,0,0,1|0,0,2]=4 4613 B8R1.3 N[C@H]1CC[C@H](CC1)O MCULE-9845054375 [0,1,0,0,0,1|0,0,2]=4 4614 B8R1.3 O=C1C=CC(OC1)O MCULE-1206409270 [0,1,0,0,0,1|0,0,2]=4 4615 B8R1.3 O=C1CCC(=O)CC1 MCULE-5432049567 [0,1,0,0,0,1|0,0,0]=2 4616 B8R1.3 O=C1CCC(=O)NC1 MCULE-8297515560 [0,1,0,0,0,1|0,0,1]=3 4617 B8R1.3 O=C1CCC(=O)NN1 MCULE-3404255918 [0,1,0,0,0,1|1,0,1]=4 4618 B8R1.3 O=C1CCC(=O)OC1 MCULE-5478039984 [0,1,0,0,0,1|0,0,1]=3 4619 B8R1.3 O=C1CCC(CC1)Br MCULE-1177789896 [0,1,0,0,0,1|0,0,0]=2 4620 B8R1.3 O=C1CCC(CC1)Cl MCULE-3647406761 [0,1,0,0,0,1|0,0,0]=2 4621 B8R1.3 O=C1CCC(CC1)F MCULE-5757540710 [0,1,0,0,0,1|0,0,0]=2 4622 B8R1.3 O=C1CCC(CC1)O MCULE-7247867750 [0,1,0,0,0,1|0,0,0]=2 4623 B8R1.3 O=C1CCC(CN1)F MCULE-1848493447 [0,1,0,0,0,1|0,0,0]=2 4624 B8R1.3 O=C1CCC(CN1)O MCULE-4501886280 [0,1,0,0,0,1|0,0,0]=2 4625 B8R1.3 O=C1CCC(CO1)O MCULE-6372408261 [0,1,0,0,0,1|0,0,0]=2 4626 B8R1.3 O=C1CCS(=O)CC1 MCULE-5385870019 [0,1,0,0,0,1|0,0,0]=2 4627 B8R1.3 O=C1CC[C@@H](CN1)O MCULE-3426407148 [0,1,0,0,0,1|0,0,0]=2 4628 B8R1.3 O=C1CC[C@@H](CN1)O MCULE-9592320749 [0,1,0,0,0,1|0,0,0]=2 4629 B8R1.3 O=C1CC[C@H](CN1)O MCULE-1500705916 [0,1,0,0,0,1|0,0,0]=2 4630 B8R1.3 O=C1CC[C@H](CN1)O MCULE-9578240246 [0,1,0,0,0,1|0,0,0]=2 4631 B8R1.3 O=C1CNC(=O)CN1 MCULE-7134033861 [0,1,0,0,0,1|1,0,1]=4 4632 B8R1.3 O=C1COC(=O)CN1 MCULE-4171313774 [0,1,0,0,0,1|1,0,1]=4 4633 B8R1.3 O=C1COC(=O)CO1 MCULE-8927291216 [0,1,0,0,0,1|1,0,1]=4 4634 B8R1.3 O=C1NCC(CN1)O MCULE-7019603243 [0,1,0,0,0,1|1,0,0]=3 4635 B8R1.3 O=S1CCC(CC1)O MCULE-7693506009 [0,1,0,0,0,1|1,0,0]=3 4636 B8R1.3 OC1CCC(CC1)Br MCULE-8198901639 [0,1,0,0,0,1|0,0,2]=4 4637 B8R1.3 OC1CCC(CC1)Cl MCULE-2412299435 [0,1,0,0,0,1|0,0,2]=4 4638 B8R1.3 OC1CCC(CC1)F MCULE-6919245281 [0,1,0,0,0,1|0,0,2]=4 4639 B8R1.3 OC1CCC(CC1)O MCULE-1213045312 [0,1,0,0,0,1|0,0,2]=4 4640 B8R1.3 O[C@H]1CC[C@@H](CC1)O MCULE-5169653700 [0,1,0,0,0,1|0,0,2]=4 4641 B8R1.3 O[C@H]1CC[C@H](CC1)O MCULE-1269237683 [0,1,0,0,0,1|0,0,2]=4 4642 B8R1.3 [C@@H]1(CC[C@@H](CC1)C)C MCULE-9917903475 [0,1,0,0,0,1|1,0,1]=4 4643 B8R1.3 [C@@H]1(CC[C@H](CC1)F)N MCULE-1471220632 [0,1,0,0,0,1|1,0,1]=4 4644 B8R1.3 [C@@H]1(CC[C@H](CC1)F)N MCULE-2396143611 [0,1,0,0,0,1|1,0,1]=4 4645 B8R1.3 [NH+]1(CCC(CC1)Cl)C MCULE-9642904586 [0,1,0,0,0,1|1,0,1]=4 4646 B8R1.4 BrC1CCCC(N1)Br MCULE-8097442417 [0,1,0,0,0,1|1,0,1]=4 4647 B8R1.4 BrC1CNCC(C1)Br MCULE-1913439395 [0,1,0,0,0,1|1,0,1]=4 4648 B8R1.4 C1(CC(=O)CCN1)C MCULE-1061296374 [0,1,0,0,0,1|0,0,0]=2 4649 B8R1.4 C1(CC(=O)CCN1)C MCULE-4465075512 [0,1,0,0,0,1|0,0,0]=2 4650 B8R1.4 C1(CC(=O)CCN1)C MCULE-9958407361 [0,1,0,0,0,1|0,0,0]=2 4651 B8R1.4 C1(CCCN(C1)C)N MCULE-3410822458 [0,1,0,0,0,1|1,0,1]=4 4652 B8R1.4 C1(CCCN(C1)C)N MCULE-3826219520 [0,1,0,0,0,1|1,0,1]=4 4653 B8R1.4 C1(CCCN(C1)C)N MCULE-4932517330 [0,1,0,0,0,1|1,0,1]=4 4654 B8R1.4 C1(CCCN(C1)C)O MCULE-3423318871 [0,1,0,0,0,1|0,0,2]=4 4655 B8R1.4 C1(CN(CCN1)C)C MCULE-4105126849 [0,1,0,0,0,1|2,0,0]=4 4656 B8R1.4 C1(CNCC(=O)N1)C MCULE-3246707428 [0,1,0,0,0,1|1,0,0]=3 4657 B8R1.4 C=C1CCCC(=O)O1 MCULE-1342678884 [0,1,0,0,0,1|0,0,1]=3 4658 B8R1.4 CC1=CC(=O)CCC1 MCULE-6849313207 [0,1,0,0,0,1|0,0,1]=3 4659 B8R1.4 CC1=CC(=O)OCC1 MCULE-1467184061 [0,1,0,0,0,1|0,0,2]=4 4660 B8R1.4 CC1=CC(CCC1)O MCULE-3389687006 [0,1,0,0,0,1|1,0,0]=3 4661 B8R1.4 CC1=CC(CNC1)C MCULE-4673363753 [0,1,0,0,0,1|1,0,1]=4 4662 B8R1.4 CC1=CC(CNC1)C MCULE-8321555834 [0,1,0,0,0,1|1,0,1]=4 4663 B8R1.4 CC1=CCCC(=O)C1 MCULE-8078773996 [0,1,0,0,0,1|0,0,1]=3 4664 B8R1.4 CC1=CCCC(=O)O1 MCULE-1590433845 [0,1,0,0,0,1|0,0,2]=4 4665 B8R1.4 CC1CC(=O)CCN1 MCULE-3306158037 [0,1,0,0,0,1|0,0,0]=2 4666 B8R1.4 CC1CC(=O)CCN1 MCULE-4556824309 [0,1,0,0,0,1|0,0,0]=2 4667 B8R1.4 CC1CC(=O)CCN1 MCULE-6103506996 [0,1,0,0,0,1|0,0,0]=2 4668 B8R1.4 CC1CC(=O)CCN1 MCULE-9670943852 [0,1,0,0,0,1|0,0,0]=2 4669 B8R1.4 CC1CC(=O)CCO1 MCULE-3051168755 [0,1,0,0,0,1|0,0,0]=2 4670 B8R1.4 CC1CC(CCN1)O MCULE-6498081704 [0,1,0,0,0,1|0,0,2]=4 4671 B8R1.4 CC1CC(CCN1)O MCULE-7903568675 [0,1,0,0,0,1|0,0,2]=4 4672 B8R1.4 CC1CC(CCO1)N MCULE-6804148880 [0,1,0,0,0,1|1,0,1]=4 4673 B8R1.4 CC1CC(CCO1)N MCULE-8648516718 [0,1,0,0,0,1|1,0,1]=4 4674 B8R1.4 CC1CC(CCO1)O MCULE-4865141445 [0,1,0,0,0,1|0,0,2]=4 4675 B8R1.4 CC1CC(CCS1)N MCULE-2033728520 [0,1,0,0,0,1|1,0,1]=4 4676 B8R1.4 CC1CC=CC(=O)O1 MCULE-3191839185 [0,1,0,0,0,1|0,0,2]=4 4677 B8R1.4 CC1CCCC(=O)C1 MCULE-6473963111 [0,1,0,0,0,1|0,0,0]=2 4678 B8R1.4 CC1CCCC(=O)C1 MCULE-9918051823 [0,1,0,0,0,1|0,0,0]=2 4679 B8R1.4 CC1CCCC(=O)N1 MCULE-3851963076 [0,1,0,0,0,1|0,0,0]=2 4680 B8R1.4 CC1CCCC(=O)O1 MCULE-4000069856 [0,1,0,0,0,1|0,0,0]=2 4681 B8R1.4 CC1CCCC(C1)Br MCULE-5316207726 [0,1,0,0,0,1|1,0,1]=4 4682 B8R1.4 CC1CCCC(C1)C MCULE-4586744389 [0,1,0,0,0,1|1,0,1]=4 4683 B8R1.4 CC1CCCC(C1)N MCULE-5556282713 [0,1,0,0,0,1|1,0,1]=4 4684 B8R1.4 CC1CCCC(C1)N MCULE-8731144009 [0,1,0,0,0,1|1,0,1]=4 4685 B8R1.4 CC1CCCC(C1)O MCULE-5839979596 [0,1,0,0,0,1|0,0,2]=4 4686 B8R1.4 CC1CCCC(C1)S MCULE-6656207820 [0,1,0,0,0,1|0,1,1]=4 4687 B8R1.4 CC1CCCC(N1)C MCULE-1701252671 [0,1,0,0,0,1|1,0,1]=4 4688 B8R1.4 CC1CCCC(N1)C MCULE-3781585788 [0,1,0,0,0,1|1,0,1]=4 4689 B8R1.4 CC1CCC[C@@H](N1)C MCULE-6717885612 [0,1,0,0,0,1|1,0,1]=4 4690 B8R1.4 CC1CCC[C@@H](N1)C MCULE-8850784160 [0,1,0,0,0,1|1,0,1]=4 4691 B8R1.4 CC1CCC[C@H](C1)O MCULE-8817611474 [0,1,0,0,0,1|0,0,2]=4 4692 B8R1.4 CC1CCC[C@H](N1)C MCULE-3950492914 [0,1,0,0,0,1|1,0,1]=4 4693 B8R1.4 CC1CCC[C@H](N1)C MCULE-6363665850 [0,1,0,0,0,1|1,0,1]=4 4694 B8R1.4 CC1CCN=C(S1)N MCULE-2188659606 [0,1,0,0,0,1|2,0,0]=4 4695 B8R1.4 CC1CCN=C(S1)N MCULE-8502352820 [0,1,0,0,0,1|2,0,0]=4 4696 B8R1.4 CC1CCNC(=N)C1 MCULE-2615774284 [0,1,0,0,0,1|1,0,0]=3 4697 B8R1.4 CC1CCNC(=N)C1 MCULE-9034088725 [0,1,0,0,0,1|1,0,0]=3 4698 B8R1.4 CC1CCNC(=O)C1 MCULE-8903018599 [0,1,0,0,0,1|0,0,0]=2 4699 B8R1.4 CC1CCNC(=O)N1 MCULE-6491047836 [0,1,0,0,0,1|1,0,0]=3 4700 B8R1.4 CC1CCNC(C1)C MCULE-8040810294 [0,1,0,0,0,1|1,0,1]=4 4701 B8R1.4 CC1CCNC(C1)C MCULE-8404028981 [0,1,0,0,0,1|1,0,1]=4 4702 B8R1.4 CC1CCOC(=O)C1 MCULE-2682865017 [0,1,0,0,0,1|0,0,0]=2 4703 B8R1.4 CC1CCOC(=O)O1 MCULE-5929311811 [0,1,0,0,0,1|1,0,0]=3 4704 B8R1.4 CC1CCOS(=O)O1 MCULE-8688981983 [0,1,0,0,0,1|2,0,0]=4 4705 B8R1.4 CC1CN(CCN1)C MCULE-1055309117 [0,1,0,0,0,1|2,0,0]=4 4706 B8R1.4 CC1CN(CCN1)C MCULE-3824647587 [0,1,0,0,0,1|2,0,0]=4 4707 B8R1.4 CC1CN(CCN1)C MCULE-6324823217 [0,1,0,0,0,1|2,0,0]=4 4708 B8R1.4 CC1CN(CCN1)C MCULE-6503611187 [0,1,0,0,0,1|2,0,0]=4 4709 B8R1.4 CC1CN(CCN1)C MCULE-7041006360 [0,1,0,0,0,1|2,0,0]=4 4710 B8R1.4 CC1CN(CCN1)C MCULE-7191718712 [0,1,0,0,0,1|2,0,0]=4 4711 B8R1.4 CC1CNCC(=O)N1 MCULE-5727167900 [0,1,0,0,0,1|1,0,0]=3 4712 B8R1.4 CC1CNCC(=O)N1 MCULE-9599432640 [0,1,0,0,0,1|1,0,0]=3 4713 B8R1.4 CC1CNCC(C1)C MCULE-6398397068 [0,1,0,0,0,1|1,0,1]=4 4714 B8R1.4 CC1CNCC(C1)F MCULE-8189756576 [0,1,0,0,0,1|1,0,1]=4 4715 B8R1.4 CC1CNCC(C1)N MCULE-3061635524 [0,1,0,0,0,1|1,0,1]=4 4716 B8R1.4 CC1CNCC(C1)O MCULE-3984160340 [0,1,0,0,0,1|0,0,2]=4 4717 B8R1.4 CC1CNCC(C1)O MCULE-8485435970 [0,1,0,0,0,1|0,0,2]=4 4718 B8R1.4 CC1COCC(=O)N1 MCULE-4768427051 [0,1,0,0,0,1|1,0,0]=3 4719 B8R1.4 CC1COCC(=O)N1 MCULE-5909800781 [0,1,0,0,0,1|1,0,0]=3 4720 B8R1.4 CC1CS(=O)CCN1 MCULE-1283703183 [0,1,0,0,0,1|1,0,0]=3 4721 B8R1.4 CN1CCC=C(C1)Br MCULE-2257933393 [0,1,0,0,0,1|1,0,1]=4 4722 B8R1.4 CN1CCC=C(C1)Br MCULE-5744160461 [0,1,0,0,0,1|1,0,1]=4 4723 B8R1.4 CN1CCCC(=O)C1 MCULE-1067967474 [0,1,0,0,0,1|0,0,0]=2 4724 B8R1.4 CN1CCCC(=O)C1 MCULE-4816876030 [0,1,0,0,0,1|0,0,0]=2 4725 B8R1.4 CN1CCCC(C1)Br MCULE-2651622305 [0,1,0,0,0,1|1,0,1]=4 4726 B8R1.4 CN1CCCC(C1)Br MCULE-7531396410 [0,1,0,0,0,1|1,0,1]=4 4727 B8R1.4 CN1CCCC(C1)I MCULE-6532551702 [0,1,0,0,0,1|1,0,1]=4 4728 B8R1.4 CN1CCCC(C1)N MCULE-6006250747 [0,1,0,0,0,1|1,0,1]=4 4729 B8R1.4 CN1CCCC(C1)N MCULE-7505616938 [0,1,0,0,0,1|1,0,1]=4 4730 B8R1.4 CN1CCCC(C1)O MCULE-1282411969 [0,1,0,0,0,1|0,0,2]=4 4731 B8R1.4 CN1CCCC(C1)O MCULE-5914090374 [0,1,0,0,0,1|0,0,2]=4 4732 B8R1.4 CN1CCC[C@@H](C1)Br MCULE-1921611819 [0,1,0,0,0,1|1,0,1]=4 4733 B8R1.4 CN1CCC[C@@H](C1)Cl MCULE-3600433530 [0,1,0,0,0,1|1,0,1]=4 4734 B8R1.4 CN1CCC[C@@H](C1)I MCULE-2822466049 [0,1,0,0,0,1|1,0,1]=4 4735 B8R1.4 CN1CCC[C@@H](C1)N MCULE-1641136932 [0,1,0,0,0,1|1,0,1]=4 4736 B8R1.4 CN1CCC[C@@H](C1)N MCULE-3051988205 [0,1,0,0,0,1|1,0,1]=4 4737 B8R1.4 CN1CCC[C@@H](C1)N MCULE-5382532780 [0,1,0,0,0,1|1,0,1]=4 4738 B8R1.4 CN1CCC[C@@H](C1)N MCULE-6456540641 [0,1,0,0,0,1|1,0,1]=4 4739 B8R1.4 CN1CCC[C@@H](C1)N MCULE-9630175341 [0,1,0,0,0,1|1,0,1]=4 4740 B8R1.4 CN1CCC[C@@H](C1)O MCULE-7507199450 [0,1,0,0,0,1|0,0,2]=4 4741 B8R1.4 CN1CCC[C@@H](C1)O MCULE-7595542900 [0,1,0,0,0,1|0,0,2]=4 4742 B8R1.4 CN1CCC[C@H](C1)Br MCULE-4528000337 [0,1,0,0,0,1|1,0,1]=4 4743 B8R1.4 CN1CCC[C@H](C1)Cl MCULE-5866202004 [0,1,0,0,0,1|1,0,1]=4 4744 B8R1.4 CN1CCC[C@H](C1)I MCULE-2032023429 [0,1,0,0,0,1|1,0,1]=4 4745 B8R1.4 CN1CCC[C@H](C1)N MCULE-3791229169 [0,1,0,0,0,1|1,0,1]=4 4746 B8R1.4 CN1CCC[C@H](C1)N MCULE-4311816417 [0,1,0,0,0,1|1,0,1]=4 4747 B8R1.4 CN1CCC[C@H](C1)N MCULE-4894370636 [0,1,0,0,0,1|1,0,1]=4 4748 B8R1.4 CN1CCC[C@H](C1)N MCULE-8680638890 [0,1,0,0,0,1|1,0,1]=4 4749 B8R1.4 CN1CCC[C@H](C1)N MCULE-9687896539 [0,1,0,0,0,1|1,0,1]=4 4750 B8R1.4 CN1CCC[C@H](C1)O MCULE-1943345564 [0,1,0,0,0,1|0,0,2]=4 4751 B8R1.4 CN1CCC[C@H](C1)O MCULE-2523873601 [0,1,0,0,0,1|0,0,2]=4 4752 B8R1.4 CN1CCNC(=O)C1 MCULE-5564854834 [0,1,0,0,0,1|1,0,0]=3 4753 B8R1.4 CN1CCOC(=O)C1 MCULE-2224720964 [0,1,0,0,0,1|1,0,0]=3 4754 B8R1.4 CN1CCOC(=O)C1 MCULE-9163078129 [0,1,0,0,0,1|1,0,0]=3 4755 B8R1.4 C[C@@H]1CC(=O)CCN1 MCULE-7688577280 [0,1,0,0,0,1|0,0,0]=2 4756 B8R1.4 C[C@@H]1CC(=O)CCN1 MCULE-7762440526 [0,1,0,0,0,1|0,0,0]=2 4757 B8R1.4 C[C@@H]1CC(=O)CCN1 MCULE-8158589956 [0,1,0,0,0,1|0,0,0]=2 4758 B8R1.4 C[C@@H]1CC(=O)CCN1 MCULE-9544551566 [0,1,0,0,0,1|0,0,0]=2 4759 B8R1.4 C[C@@H]1CC(=O)CCO1 MCULE-4878813100 [0,1,0,0,0,1|0,0,0]=2 4760 B8R1.4 C[C@@H]1CC(=O)CCO1 MCULE-7917159022 [0,1,0,0,0,1|0,0,0]=2 4761 B8R1.4 C[C@@H]1CCCC(=O)C1 MCULE-1868776628 [0,1,0,0,0,1|0,0,0]=2 4762 B8R1.4 C[C@@H]1CCCC(=O)C1 MCULE-6973928430 [0,1,0,0,0,1|0,0,0]=2 4763 B8R1.4 C[C@@H]1CCCC(=O)N1 MCULE-2050655386 [0,1,0,0,0,1|0,0,0]=2 4764 B8R1.4 C[C@@H]1CCCC(=O)N1 MCULE-7049359933 [0,1,0,0,0,1|0,0,0]=2 4765 B8R1.4 C[C@@H]1CCCC(=O)O1 MCULE-6306078053 [0,1,0,0,0,1|0,0,0]=2 4766 B8R1.4 C[C@@H]1CCCC(=O)O1 MCULE-7616070208 [0,1,0,0,0,1|0,0,0]=2 4767 B8R1.4 C[C@@H]1CCC[C@@H](C1)N MCULE-4415985299 [0,1,0,0,0,1|1,0,1]=4 4768 B8R1.4 C[C@@H]1CCC[C@@H](C1)N MCULE-8377118927 [0,1,0,0,0,1|1,0,1]=4 4769 B8R1.4 C[C@@H]1CCC[C@@H](C1)O MCULE-9818117668 [0,1,0,0,0,1|0,0,2]=4 4770 B8R1.4 C[C@@H]1CCC[C@H](C1)C MCULE-3238245504 [0,1,0,0,0,1|1,0,1]=4 4771 B8R1.4 C[C@@H]1CCC[C@H](C1)C MCULE-5078558305 [0,1,0,0,0,1|1,0,1]=4 4772 B8R1.4 C[C@@H]1CCC[C@H](C1)N MCULE-8122076410 [0,1,0,0,0,1|1,0,1]=4 4773 B8R1.4 C[C@@H]1CCC[C@H](C1)N MCULE-8755565938 [0,1,0,0,0,1|1,0,1]=4 4774 B8R1.4 C[C@@H]1CCC[C@H](N1)C MCULE-3698881454 [0,1,0,0,0,1|1,0,1]=4 4775 B8R1.4 C[C@@H]1CCC[C@H](N1)C MCULE-9551065058 [0,1,0,0,0,1|1,0,1]=4 4776 B8R1.4 C[C@@H]1CCN=C(S1)N MCULE-5066686774 [0,1,0,0,0,1|2,0,0]=4 4777 B8R1.4 C[C@@H]1CCN=C(S1)N MCULE-6965708093 [0,1,0,0,0,1|2,0,0]=4 4778 B8R1.4 C[C@@H]1CCN[C@@H](C1)C MCULE-1028257294 [0,1,0,0,0,1|1,0,1]=4 4779 B8R1.4 C[C@@H]1CCN[C@@H](C1)C MCULE-6672836947 [0,1,0,0,0,1|1,0,1]=4 4780 B8R1.4 C[C@@H]1CN(CCN1)C MCULE-1570359061 [0,1,0,0,0,1|2,0,0]=4 4781 B8R1.4 C[C@@H]1CN(CCN1)C MCULE-2310985091 [0,1,0,0,0,1|2,0,0]=4 4782 B8R1.4 C[C@@H]1CN(CCN1)C MCULE-2316648491 [0,1,0,0,0,1|2,0,0]=4 4783 B8R1.4 C[C@@H]1CN(CCN1)C MCULE-3211045897 [0,1,0,0,0,1|2,0,0]=4 4784 B8R1.4 C[C@@H]1CN(CCN1)C MCULE-4792990163 [0,1,0,0,0,1|2,0,0]=4 4785 B8R1.4 C[C@@H]1CN(CCN1)C MCULE-7243491288 [0,1,0,0,0,1|2,0,0]=4 4786 B8R1.4 C[C@@H]1CN(CCN1)C MCULE-7866165756 [0,1,0,0,0,1|2,0,0]=4 4787 B8R1.4 C[C@@H]1CN(CCN1)C MCULE-8629381213 [0,1,0,0,0,1|2,0,0]=4 4788 B8R1.4 C[C@@H]1CNCC(=O)N1 MCULE-3378865379 [0,1,0,0,0,1|1,0,0]=3 4789 B8R1.4 C[C@@H]1CNCC(=O)N1 MCULE-5740698320 [0,1,0,0,0,1|1,0,0]=3 4790 B8R1.4 C[C@@H]1CNCC(=O)N1 MCULE-7692987274 [0,1,0,0,0,1|1,0,0]=3 4791 B8R1.4 C[C@@H]1CNCC(=O)N1 MCULE-8897582822 [0,1,0,0,0,1|1,0,0]=3 4792 B8R1.4 C[C@@H]1CNC[C@@H](C1)C MCULE-5074164144 [0,1,0,0,0,1|1,0,1]=4 4793 B8R1.4 C[C@@H]1CNC[C@@H](C1)C MCULE-6080949069 [0,1,0,0,0,1|1,0,1]=4 4794 B8R1.4 C[C@@H]1CNC[C@H](C1)C MCULE-2125944179 [0,1,0,0,0,1|1,0,1]=4 4795 B8R1.4 C[C@@H]1CNC[C@H](C1)C MCULE-2907126543 [0,1,0,0,0,1|1,0,1]=4 4796 B8R1.4 C[C@@H]1COCC(=O)N1 MCULE-1758598852 [0,1,0,0,0,1|1,0,0]=3 4797 B8R1.4 C[C@@H]1COCC(=O)N1 MCULE-2011395384 [0,1,0,0,0,1|1,0,0]=3 4798 B8R1.4 C[C@@H]1C[C@@H](CCN1)F MCULE-1398077984 [0,1,0,0,0,1|1,0,1]=4 4799 B8R1.4 C[C@@H]1C[C@@H](CCN1)F MCULE-2358777348 [0,1,0,0,0,1|1,0,1]=4 4800 B8R1.4 C[C@@H]1C[C@@H](CCN1)F MCULE-3912836765 [0,1,0,0,0,1|1,0,1]=4 4801 B8R1.4 C[C@@H]1C[C@@H](CCN1)F MCULE-4676698183 [0,1,0,0,0,1|1,0,1]=4 4802 B8R1.4 C[C@@H]1C[C@@H](CCN1)N MCULE-5240939973 [0,1,0,0,0,1|1,0,1]=4 4803 B8R1.4 C[C@@H]1C[C@@H](CCN1)N MCULE-7786078968 [0,1,0,0,0,1|1,0,1]=4 4804 B8R1.4 C[C@@H]1C[C@@H](CCN1)O MCULE-4140093728 [0,1,0,0,0,1|0,0,2]=4 4805 B8R1.4 C[C@@H]1C[C@@H](CCN1)O MCULE-5163618886 [0,1,0,0,0,1|0,0,2]=4 4806 B8R1.4 C[C@@H]1C[C@@H](CCN1)O MCULE-7763919398 [0,1,0,0,0,1|0,0,2]=4 4807 B8R1.4 C[C@@H]1C[C@@H](CCN1)O MCULE-8618284571 [0,1,0,0,0,1|0,0,2]=4 4808 B8R1.4 C[C@@H]1C[C@@H](CCO1)N MCULE-5401313109 [0,1,0,0,0,1|1,0,1]=4 4809 B8R1.4 C[C@@H]1C[C@@H](CCO1)N MCULE-6369939467 [0,1,0,0,0,1|1,0,1]=4 4810 B8R1.4 C[C@@H]1C[C@@H](CCO1)O MCULE-6251959536 [0,1,0,0,0,1|0,0,2]=4 4811 B8R1.4 C[C@@H]1C[C@H](CCN1)O MCULE-6703272966 [0,1,0,0,0,1|0,0,2]=4 4812 B8R1.4 C[C@@H]1C[C@H](CCO1)Br MCULE-5055630042 [0,1,0,0,0,1|1,0,1]=4 4813 B8R1.4 C[C@@H]1C[C@H](CCO1)N MCULE-3414529082 [0,1,0,0,0,1|1,0,1]=4 4814 B8R1.4 C[C@@H]1C[C@H](CCO1)N MCULE-9424615508 [0,1,0,0,0,1|1,0,1]=4 4815 B8R1.4 C[C@H]1CC(=O)CCN1 MCULE-1599463757 [0,1,0,0,0,1|0,0,0]=2 4816 B8R1.4 C[C@H]1CC(=O)CCN1 MCULE-4580048332 [0,1,0,0,0,1|0,0,0]=2 4817 B8R1.4 C[C@H]1CC(=O)CCN1 MCULE-5356496154 [0,1,0,0,0,1|0,0,0]=2 4818 B8R1.4 C[C@H]1CC(=O)CCN1 MCULE-5733481696 [0,1,0,0,0,1|0,0,0]=2 4819 B8R1.4 C[C@H]1CC(=O)CCN1 MCULE-6641640616 [0,1,0,0,0,1|0,0,0]=2 4820 B8R1.4 C[C@H]1CC(=O)CCN1 MCULE-8001129555 [0,1,0,0,0,1|0,0,0]=2 4821 B8R1.4 C[C@H]1CC(=O)CCO1 MCULE-7799394182 [0,1,0,0,0,1|0,0,0]=2 4822 B8R1.4 C[C@H]1CCCC(=O)C1 MCULE-4643975445 [0,1,0,0,0,1|0,0,0]=2 4823 B8R1.4 C[C@H]1CCCC(=O)C1 MCULE-6122391840 [0,1,0,0,0,1|0,0,0]=2 4824 B8R1.4 C[C@H]1CCC[C@@H](N1)C MCULE-1147260663 [0,1,0,0,0,1|1,0,1]=4 4825 B8R1.4 C[C@H]1CCC[C@@H](N1)C MCULE-9029116005 [0,1,0,0,0,1|1,0,1]=4 4826 B8R1.4 C[C@H]1CCC[C@H](C1)C MCULE-7889833647 [0,1,0,0,0,1|1,0,1]=4 4827 B8R1.4 C[C@H]1CCC[C@H](C1)N MCULE-5054508849 [0,1,0,0,0,1|1,0,1]=4 4828 B8R1.4 C[C@H]1CCC[C@H](C1)O MCULE-9355825371 [0,1,0,0,0,1|0,0,2]=4 4829 B8R1.4 C[C@H]1CCC[C@H](N1)C MCULE-5870895189 [0,1,0,0,0,1|1,0,1]=4 4830 B8R1.4 C[C@H]1CCC[C@H](N1)C MCULE-9926277933 [0,1,0,0,0,1|1,0,1]=4 4831 B8R1.4 C[C@H]1CCNC(=O)C1 MCULE-7120988665 [0,1,0,0,0,1|0,0,0]=2 4832 B8R1.4 C[C@H]1CCN[C@H](C1)C MCULE-3280721182 [0,1,0,0,0,1|1,0,1]=4 4833 B8R1.4 C[C@H]1CCN[C@H](C1)C MCULE-4356238844 [0,1,0,0,0,1|1,0,1]=4 4834 B8R1.4 C[C@H]1CN(CCN1)C MCULE-3768688515 [0,1,0,0,0,1|2,0,0]=4 4835 B8R1.4 C[C@H]1CN(CCN1)C MCULE-4142367217 [0,1,0,0,0,1|2,0,0]=4 4836 B8R1.4 C[C@H]1CN(CCN1)C MCULE-7427337853 [0,1,0,0,0,1|2,0,0]=4 4837 B8R1.4 C[C@H]1CN(CCN1)C MCULE-9194909314 [0,1,0,0,0,1|2,0,0]=4 4838 B8R1.4 C[C@H]1CNCC(=O)N1 MCULE-3182538973 [0,1,0,0,0,1|1,0,0]=3 4839 B8R1.4 C[C@H]1CNCC(=O)N1 MCULE-3207104811 [0,1,0,0,0,1|1,0,0]=3 4840 B8R1.4 C[C@H]1CNCC(=O)N1 MCULE-5895954143 [0,1,0,0,0,1|1,0,0]=3 4841 B8R1.4 C[C@H]1CNCC(=O)N1 MCULE-6535652978 [0,1,0,0,0,1|1,0,0]=3 4842 B8R1.4 C[C@H]1CNC[C@@H](C1)C MCULE-3540731481 [0,1,0,0,0,1|1,0,1]=4 4843 B8R1.4 C[C@H]1COCC(=O)N1 MCULE-5693624195 [0,1,0,0,0,1|1,0,0]=3 4844 B8R1.4 C[C@H]1COCC(=O)N1 MCULE-8476323396 [0,1,0,0,0,1|1,0,0]=3 4845 B8R1.4 C[C@H]1C[C@@H](CCN1)O MCULE-1694554479 [0,1,0,0,0,1|0,0,2]=4 4846 B8R1.4 C[C@H]1C[C@@H](CCO1)N MCULE-1731421927 [0,1,0,0,0,1|1,0,1]=4 4847 B8R1.4 C[C@H]1C[C@@H](CCO1)O MCULE-3846187212 [0,1,0,0,0,1|0,0,2]=4 4848 B8R1.4 C[C@H]1C[C@H](CCN1)O MCULE-2129467220 [0,1,0,0,0,1|0,0,2]=4 4849 B8R1.4 C[C@H]1C[C@H](CCN1)O MCULE-2293561927 [0,1,0,0,0,1|0,0,2]=4 4850 B8R1.4 C[C@H]1C[C@H](CCN1)O MCULE-2465229358 [0,1,0,0,0,1|0,0,2]=4 4851 B8R1.4 C[C@H]1C[C@H](CCN1)O MCULE-2588665539 [0,1,0,0,0,1|0,0,2]=4 4852 B8R1.4 C[C@H]1C[C@H](CCN1)O MCULE-4194322726 [0,1,0,0,0,1|0,0,2]=4 4853 B8R1.4 C[C@H]1C[C@H](CCN1)O MCULE-4666938059 [0,1,0,0,0,1|0,0,2]=4 4854 B8R1.4 C[C@H]1C[C@H](CCO1)N MCULE-6954386064 [0,1,0,0,0,1|1,0,1]=4 4855 B8R1.4 C[C@H]1C[C@H](CCO1)O MCULE-3007764630 [0,1,0,0,0,1|0,0,2]=4 4856 B8R1.4 FC1CNCC(C1)F MCULE-7036198816 [0,1,0,0,0,1|1,0,1]=4 4857 B8R1.4 FC1CNCC(C1)F MCULE-8984375278 [0,1,0,0,0,1|1,0,1]=4 4858 B8R1.4 F[C@@H]1CNC[C@@H](C1)F MCULE-3023507482 [0,1,0,0,0,1|1,0,1]=4 4859 B8R1.4 F[C@@H]1CNC[C@@H](C1)F MCULE-7727281752 [0,1,0,0,0,1|1,0,1]=4 4860 B8R1.4 F[C@@H]1CNC[C@H](C1)F MCULE-8649676242 [0,1,0,0,0,1|1,0,1]=4 4861 B8R1.4 F[C@@H]1CNC[C@H](C1)F MCULE-9246860374 [0,1,0,0,0,1|1,0,1]=4 4862 B8R1.4 F[C@H]1CNC[C@@H](C1)F MCULE-1364264287 [0,1,0,0,0,1|1,0,1]=4 4863 B8R1.4 F[C@H]1CNC[C@@H](C1)F MCULE-3285682330 [0,1,0,0,0,1|1,0,1]=4 4864 B8R1.4 F[C@H]1CNC[C@@H](C1)F MCULE-3772724613 [0,1,0,0,0,1|1,0,1]=4 4865 B8R1.4 F[C@H]1CNC[C@@H](C1)F MCULE-7488553617 [0,1,0,0,0,1|1,0,1]=4 4866 B8R1.4 NC1=CC(=O)CCC1 MCULE-3362548403 [0,1,0,0,0,1|0,0,1]=3 4867 B8R1.4 NC1=CC(=O)COC1 MCULE-7765608843 [0,1,0,0,0,1|0,0,2]=4 4868 B8R1.4 NC1=NCCC(=O)N1 MCULE-1616157929 [0,1,0,0,0,1|1,0,1]=4 4869 B8R1.4 NC1C=C(CCC1)F MCULE-7477602128 [0,1,0,0,0,1|1,0,0]=3 4870 B8R1.4 NC1CCCC(=O)C1 MCULE-3659606498 [0,1,0,0,0,1|0,0,0]=2 4871 B8R1.4 NC1CCCC(=O)C1 MCULE-8815445353 [0,1,0,0,0,1|0,0,0]=2 4872 B8R1.4 NC1CCCC(C1)Cl MCULE-7655504973 [0,1,0,0,0,1|1,0,1]=4 4873 B8R1.4 NC1CCCC(C1)Cl MCULE-9341575456 [0,1,0,0,0,1|1,0,1]=4 4874 B8R1.4 NC1CCCC(C1)F MCULE-5865882171 [0,1,0,0,0,1|1,0,1]=4 4875 B8R1.4 NC1CCCC(C1)F MCULE-8837450344 [0,1,0,0,0,1|1,0,1]=4 4876 B8R1.4 NC1CCCC(C1)N MCULE-3029985677 [0,1,0,0,0,1|1,0,1]=4 4877 B8R1.4 NC1CCCC(C1)N MCULE-6391736640 [0,1,0,0,0,1|1,0,1]=4 4878 B8R1.4 NC1CCCC(C1)O MCULE-6642881941 [0,1,0,0,0,1|0,0,2]=4 4879 B8R1.4 NC1CCCC(C1)O MCULE-7481733301 [0,1,0,0,0,1|0,0,2]=4 4880 B8R1.4 NC1CCNC(=O)C1 MCULE-2185303732 [0,1,0,0,0,1|0,0,0]=2 4881 B8R1.4 NC1CCNC(=O)C1 MCULE-4290135082 [0,1,0,0,0,1|0,0,0]=2 4882 B8R1.4 NC1CCNC(=O)C1 MCULE-6525283699 [0,1,0,0,0,1|0,0,0]=2 4883 B8R1.4 NC1CCNC(=O)C1 MCULE-8080194775 [0,1,0,0,0,1|0,0,0]=2 4884 B8R1.4 NC1CNCC(C1)O MCULE-6920221467 [0,1,0,0,0,1|0,0,2]=4 4885 B8R1.4 NC1COCC(=O)C1 MCULE-4958107203 [0,1,0,0,0,1|0,0,0]=2 4886 B8R1.4 NC1COCC(=O)C1 MCULE-9645630994 [0,1,0,0,0,1|0,0,0]=2 4887 B8R1.4 NC1COCC(C1)O MCULE-4181084305 [0,1,0,0,0,1|0,0,2]=4 4888 B8R1.4 NC1COCC(C1)O MCULE-5761305163 [0,1,0,0,0,1|0,0,2]=4 4889 B8R1.4 NN1CCCC(C1)O MCULE-4022389356 [0,1,0,0,0,1|0,0,2]=4 4890 B8R1.4 N[C@@H]1CCCC(=O)C1 MCULE-4006583256 [0,1,0,0,0,1|0,0,0]=2 4891 B8R1.4 N[C@@H]1CCC[C@@H](C1)O MCULE-2185895220 [0,1,0,0,0,1|0,0,2]=4 4892 B8R1.4 N[C@@H]1CCC[C@@H](C1)O MCULE-6878512399 [0,1,0,0,0,1|0,0,2]=4 4893 B8R1.4 N[C@@H]1CCC[C@@H](C1)O MCULE-7794771906 [0,1,0,0,0,1|0,0,2]=4 4894 B8R1.4 N[C@@H]1CCC[C@@H](C1)O MCULE-9600913098 [0,1,0,0,0,1|0,0,2]=4 4895 B8R1.4 N[C@@H]1CCC[C@H](C1)F MCULE-2536282257 [0,1,0,0,0,1|1,0,1]=4 4896 B8R1.4 N[C@@H]1CCC[C@H](C1)F MCULE-2736673815 [0,1,0,0,0,1|1,0,1]=4 4897 B8R1.4 N[C@@H]1CCC[C@H](C1)F MCULE-4628461523 [0,1,0,0,0,1|1,0,1]=4 4898 B8R1.4 N[C@@H]1CCC[C@H](C1)F MCULE-9688546453 [0,1,0,0,0,1|1,0,1]=4 4899 B8R1.4 N[C@@H]1CCC[C@H](C1)N MCULE-2130309446 [0,1,0,0,0,1|1,0,1]=4 4900 B8R1.4 N[C@@H]1CCC[C@H](C1)O MCULE-3943542357 [0,1,0,0,0,1|0,0,2]=4 4901 B8R1.4 N[C@@H]1CCC[C@H](C1)O MCULE-7462583711 [0,1,0,0,0,1|0,0,2]=4 4902 B8R1.4 N[C@@H]1CCC[C@H](C1)O MCULE-8163415958 [0,1,0,0,0,1|0,0,2]=4 4903 B8R1.4 N[C@@H]1CCC[C@H](C1)O MCULE-9050533878 [0,1,0,0,0,1|0,0,2]=4 4904 B8R1.4 N[C@@H]1CCNC(=O)C1 MCULE-8276559925 [0,1,0,0,0,1|0,0,0]=2 4905 B8R1.4 N[C@@H]1COCC(=O)C1 MCULE-3299834957 [0,1,0,0,0,1|0,0,0]=2 4906 B8R1.4 N[C@@H]1COCC(=O)C1 MCULE-6683156371 [0,1,0,0,0,1|0,0,0]=2 4907 B8R1.4 N[C@@H]1COC[C@@H](C1)O MCULE-2589345375 [0,1,0,0,0,1|0,0,2]=4 4908 B8R1.4 N[C@@H]1COC[C@@H](C1)O MCULE-5154891684 [0,1,0,0,0,1|0,0,2]=4 4909 B8R1.4 N[C@@H]1COC[C@H](C1)O MCULE-1888308248 [0,1,0,0,0,1|0,0,2]=4 4910 B8R1.4 N[C@@H]1COC[C@H](C1)O MCULE-4630509866 [0,1,0,0,0,1|0,0,2]=4 4911 B8R1.4 N[C@H]1CCCC(=O)C1 MCULE-9786035316 [0,1,0,0,0,1|0,0,0]=2 4912 B8R1.4 N[C@H]1CCC[C@@H](C1)F MCULE-3206920587 [0,1,0,0,0,1|1,0,1]=4 4913 B8R1.4 N[C@H]1CCC[C@@H](C1)F MCULE-3799023910 [0,1,0,0,0,1|1,0,1]=4 4914 B8R1.4 N[C@H]1CCC[C@@H](C1)F MCULE-4345615346 [0,1,0,0,0,1|1,0,1]=4 4915 B8R1.4 N[C@H]1CCC[C@@H](C1)F MCULE-6740747871 [0,1,0,0,0,1|1,0,1]=4 4916 B8R1.4 N[C@H]1CCC[C@@H](C1)N MCULE-1460773264 [0,1,0,0,0,1|1,0,1]=4 4917 B8R1.4 N[C@H]1CCC[C@@H](C1)N MCULE-7326708293 [0,1,0,0,0,1|1,0,1]=4 4918 B8R1.4 N[C@H]1CCC[C@@H](C1)N MCULE-7679169264 [0,1,0,0,0,1|1,0,1]=4 4919 B8R1.4 N[C@H]1CCC[C@@H](C1)N MCULE-8810866148 [0,1,0,0,0,1|1,0,1]=4 4920 B8R1.4 N[C@H]1CCC[C@@H](C1)O MCULE-2088777566 [0,1,0,0,0,1|0,0,2]=4 4921 B8R1.4 N[C@H]1CCC[C@@H](C1)O MCULE-6052884406 [0,1,0,0,0,1|0,0,2]=4 4922 B8R1.4 N[C@H]1CCC[C@@H](C1)O MCULE-7145455722 [0,1,0,0,0,1|0,0,2]=4 4923 B8R1.4 N[C@H]1CCC[C@@H](C1)O MCULE-8458598098 [0,1,0,0,0,1|0,0,2]=4 4924 B8R1.4 N[C@H]1CCC[C@H](C1)Cl MCULE-1818262804 [0,1,0,0,0,1|1,0,1]=4 4925 B8R1.4 N[C@H]1CCC[C@H](C1)Cl MCULE-8427852595 [0,1,0,0,0,1|1,0,1]=4 4926 B8R1.4 N[C@H]1CCC[C@H](C1)F MCULE-1359534220 [0,1,0,0,0,1|1,0,1]=4 4927 B8R1.4 N[C@H]1CCC[C@H](C1)F MCULE-1857618544 [0,1,0,0,0,1|1,0,1]=4 4928 B8R1.4 N[C@H]1CCC[C@H](C1)F MCULE-4081113085 [0,1,0,0,0,1|1,0,1]=4 4929 B8R1.4 N[C@H]1CCC[C@H](C1)F MCULE-9022718283 [0,1,0,0,0,1|1,0,1]=4 4930 B8R1.4 N[C@H]1CCC[C@H](C1)N MCULE-7378030264 [0,1,0,0,0,1|1,0,1]=4 4931 B8R1.4 N[C@H]1CCC[C@H](C1)N MCULE-8100723700 [0,1,0,0,0,1|1,0,1]=4 4932 B8R1.4 N[C@H]1CCC[C@H](C1)N MCULE-8346537188 [0,1,0,0,0,1|1,0,1]=4 4933 B8R1.4 N[C@H]1CCC[C@H](C1)O MCULE-1402442931 [0,1,0,0,0,1|0,0,2]=4 4934 B8R1.4 N[C@H]1CCC[C@H](C1)O MCULE-2566868682 [0,1,0,0,0,1|0,0,2]=4 4935 B8R1.4 N[C@H]1CCC[C@H](C1)O MCULE-8263508625 [0,1,0,0,0,1|0,0,2]=4 4936 B8R1.4 N[C@H]1CCC[C@H](C1)O MCULE-9158452946 [0,1,0,0,0,1|0,0,2]=4 4937 B8R1.4 N[C@H]1CCC[C@H](C1)O MCULE-9908500977 [0,1,0,0,0,1|0,0,2]=4 4938 B8R1.4 N[C@H]1CCNC(=O)C1 MCULE-1641151984 [0,1,0,0,0,1|0,0,0]=2 4939 B8R1.4 N[C@H]1CCNC(=O)C1 MCULE-2042394403 [0,1,0,0,0,1|0,0,0]=2 4940 B8R1.4 N[C@H]1CCNC(=O)C1 MCULE-6400271298 [0,1,0,0,0,1|0,0,0]=2 4941 B8R1.4 N[C@H]1COC[C@@H](C1)O MCULE-6168789714 [0,1,0,0,0,1|0,0,2]=4 4942 B8R1.4 N[C@H]1COC[C@H](C1)O MCULE-1887576189 [0,1,0,0,0,1|0,0,2]=4 4943 B8R1.4 N[C@H]1COC[C@H](C1)O MCULE-2203204142 [0,1,0,0,0,1|0,0,2]=4 4944 B8R1.4 O=C1C=C(CCC1)Br MCULE-3733885681 [0,1,0,0,0,1|0,0,1]=3 4945 B8R1.4 O=C1C=C(CCC1)Cl MCULE-9612484193 [0,1,0,0,0,1|0,0,1]=3 4946 B8R1.4 O=C1C=C(CCC1)I MCULE-4085762002 [0,1,0,0,0,1|0,0,1]=3 4947 B8R1.4 O=C1C=C(CCC1)O MCULE-5615245957 [0,1,0,0,0,1|0,0,1]=3 4948 B8R1.4 O=C1C=C(CCN1)Br MCULE-5356952780 [0,1,0,0,0,1|0,0,2]=4 4949 B8R1.4 O=C1C=C(COC1)O MCULE-2385941614 [0,1,0,0,0,1|0,0,2]=4 4950 B8R1.4 O=C1CC(CCN1)F MCULE-3828280868 [0,1,0,0,0,1|0,0,0]=2 4951 B8R1.4 O=C1CC(CCN1)F MCULE-8150833328 [0,1,0,0,0,1|0,0,0]=2 4952 B8R1.4 O=C1CC(CCN1)O MCULE-5400068518 [0,1,0,0,0,1|0,0,0]=2 4953 B8R1.4 O=C1CC(CCN1)O MCULE-8702086069 [0,1,0,0,0,1|0,0,0]=2 4954 B8R1.4 O=C1CCCC(=O)C1 MCULE-7494421285 [0,1,0,0,0,1|0,0,0]=2 4955 B8R1.4 O=C1CCCC(=O)N1 MCULE-7505150579 [0,1,0,0,0,1|0,0,1]=3 4956 B8R1.4 O=C1CCCC(=O)O1 MCULE-4866925975 [0,1,0,0,0,1|0,0,1]=3 4957 B8R1.4 O=C1CCCC(C1)O MCULE-3100717907 [0,1,0,0,0,1|0,0,0]=2 4958 B8R1.4 O=C1CCC[C@@H](C1)O MCULE-3841179351 [0,1,0,0,0,1|0,0,0]=2 4959 B8R1.4 O=C1CCNC(=O)C1 MCULE-7662080105 [0,1,0,0,0,1|0,0,1]=3 4960 B8R1.4 O=C1CCNC(=O)N1 MCULE-8986910982 [0,1,0,0,0,1|1,0,1]=4 4961 B8R1.4 O=C1CCNC(=O)O1 MCULE-8298722634 [0,1,0,0,0,1|1,0,1]=4 4962 B8R1.4 O=C1CCOC(=O)C1 MCULE-3134133687 [0,1,0,0,0,1|0,0,1]=3 4963 B8R1.4 O=C1CNCC(=O)C1 MCULE-9390215509 [0,1,0,0,0,1|0,0,1]=3 4964 B8R1.4 O=C1CNCC(=O)C1 MCULE-9631657912 [0,1,0,0,0,1|0,0,1]=3 4965 B8R1.4 O=C1CNCC(=O)N1 MCULE-2684405909 [0,1,0,0,0,1|1,0,1]=4 4966 B8R1.4 O=C1CNCC(=O)N1 MCULE-8918860650 [0,1,0,0,0,1|1,0,1]=4 4967 B8R1.4 O=C1COCC(=O)C1 MCULE-1763175933 [0,1,0,0,0,1|0,0,1]=3 4968 B8R1.4 O=C1COCC(=O)N1 MCULE-2640203723 [0,1,0,0,0,1|1,0,1]=4 4969 B8R1.4 O=C1COCC(=O)O1 MCULE-7640970930 [0,1,0,0,0,1|1,0,1]=4 4970 B8R1.4 O=C1COCC(C1)O MCULE-6056926421 [0,1,0,0,0,1|0,0,0]=2 4971 B8R1.4 O=C1CSCC(=O)C1 MCULE-7749510849 [0,1,0,0,0,1|0,0,1]=3 4972 B8R1.4 O=C1CSCC(=O)N1 MCULE-5124635458 [0,1,0,0,0,1|1,0,1]=4 4973 B8R1.4 O=C1CSCC(=O)O1 MCULE-6767203470 [0,1,0,0,0,1|1,0,1]=4 4974 B8R1.4 O=C1C[C@@H](CCN1)O MCULE-8279613188 [0,1,0,0,0,1|0,0,0]=2 4975 B8R1.4 O=C1C[C@@H](CCN1)O MCULE-9911849866 [0,1,0,0,0,1|0,0,0]=2 4976 B8R1.4 O=C1C[C@H](CCN1)O MCULE-3843806479 [0,1,0,0,0,1|0,0,0]=2 4977 B8R1.4 O=C1C[C@H](CCN1)O MCULE-9127195212 [0,1,0,0,0,1|0,0,0]=2 4978 B8R1.4 O=C1NC(=S)CCS1 MCULE-5745642312 [0,1,0,0,0,1|1,0,1]=4 4979 B8R1.4 O=C1[CH-]C(=O)COC1 MCULE-6235987509 [0,1,0,0,0,1|0,0,2]=4 4980 B8R1.4 O=C1[CH-]C(=O)COC1 MCULE-9016019550 [0,1,0,0,0,1|0,0,2]=4 4981 B8R1.4 OC1C=C(COC1)Br MCULE-4969292541 [0,1,0,0,0,1|1,0,1]=4 4982 B8R1.4 OC1CCCC(C1)O MCULE-5377622416 [0,1,0,0,0,1|0,0,2]=4 4983 B8R1.4 OC1CNCC(C1)O MCULE-1197120974 [0,1,0,0,0,1|0,0,2]=4 4984 B8R1.4 OC1CNCC(C1)O MCULE-4759581472 [0,1,0,0,0,1|0,0,2]=4 4985 B8R1.4 O[C@@H]1CCC[C@H](C1)O MCULE-1135108851 [0,1,0,0,0,1|0,0,2]=4 4986 B8R1.4 O[C@@H]1CCC[C@H](C1)O MCULE-4488851523 [0,1,0,0,0,1|0,0,2]=4 4987 B8R1.4 O[C@@H]1CNC[C@@H](C1)F MCULE-1439853464 [0,1,0,0,0,1|0,0,2]=4 4988 B8R1.4 O[C@@H]1CNC[C@@H](C1)F MCULE-9096067151 [0,1,0,0,0,1|0,0,2]=4 4989 B8R1.4 O[C@@H]1CNC[C@@H](C1)O MCULE-1294085941 [0,1,0,0,0,1|0,0,2]=4 4990 B8R1.4 O[C@@H]1CNC[C@@H](C1)O MCULE-3774231585 [0,1,0,0,0,1|0,0,2]=4 4991 B8R1.4 O[C@@H]1CNC[C@H](C1)O MCULE-5630014959 [0,1,0,0,0,1|0,0,2]=4 4992 B8R1.4 O[C@@H]1CNC[C@H](C1)O MCULE-8096152429 [0,1,0,0,0,1|0,0,2]=4 4993 B8R1.4 O[C@H]1CCC[C@@H](C1)O MCULE-4718573149 [0,1,0,0,0,1|0,0,2]=4 4994 B8R1.4 O[C@H]1CCC[C@H](C1)O MCULE-9402957017 [0,1,0,0,0,1|0,0,2]=4 4995 B8R1.4 O[C@H]1CNC[C@@H](C1)O MCULE-3635256197 [0,1,0,0,0,1|0,0,2]=4 4996 B8R1.4 O[C@H]1CNC[C@@H](C1)O MCULE-7162868831 [0,1,0,0,0,1|0,0,2]=4 4997 B8R1.4 [C@@H]1(CCCC(=O)N1)C MCULE-8906937588 [0,1,0,0,0,1|0,0,0]=2 4998 B8R1.4 [C@@H]1(CCC[C@@H](C1)N)C MCULE-3863430976 [0,1,0,0,0,1|1,0,1]=4 4999 B8R1.4 [C@H]1(CCC[C@H](C1)O)N MCULE-1919170190 [0,1,0,0,0,1|0,0,2]=4 5000 B8R1.4 [C@H]1(CCC[C@H](C1)O)N MCULE-2985238129 [0,1,0,0,0,1|0,0,2]=4 5001 B8R1.5 BrC1=C(CCCC1)Br MCULE-3043011492 [0,1,0,0,0,1|1,0,0]=3 5002 B8R1.5 BrC1=CCCCC1Br MCULE-4680116883 [0,1,0,0,0,1|1,0,0]=3 5003 B8R1.5 BrC1CCCCC1Br MCULE-1701720026 [0,1,0,0,0,1|1,0,1]=4 5004 B8R1.5 BrC1CCCOC1Br MCULE-5122148511 [0,1,0,0,0,1|1,0,1]=4 5005 B8R1.5 Br[C@@H]1CCCC[C@H]1Br MCULE-3924798087 [0,1,0,0,0,1|1,0,1]=4 5006 B8R1.5 Br[C@@H]1CCCC[C@H]1Br MCULE-5649353367 [0,1,0,0,0,1|1,0,1]=4 5007 B8R1.5 Br[C@H]1CCCC[C@@H]1Br MCULE-1538086495 [0,1,0,0,0,1|1,0,1]=4 5008 B8R1.5 Br[C@H]1CCCC[C@@H]1Br MCULE-2632706043 [0,1,0,0,0,1|1,0,1]=4 5009 B8R1.5 C1(CNCCN1C)C MCULE-7298788210 [0,1,0,0,0,1|2,0,0]=4 5010 B8R1.5 C1(CNCCN1C)C MCULE-9473957667 [0,1,0,0,0,1|2,0,0]=4 5011 B8R1.5 C=C1CCCCC1O MCULE-3853228524 [0,1,0,0,0,1|1,0,0]=3 5012 B8R1.5 C=C1CCCCC1O MCULE-5911864977 [0,1,0,0,0,1|1,0,0]=3 5013 B8R1.5 C=C1CCCNC1=O MCULE-1867993758 [0,1,0,0,0,1|0,0,1]=3 5014 B8R1.5 C=C1COCCC1N MCULE-4966385224 [0,1,0,0,0,1|1,0,0]=3 5015 B8R1.5 CC1=C(CNCC1)Br MCULE-2210558974 [0,1,0,0,0,1|1,0,1]=4 5016 B8R1.5 CC1=C(CNCC1)Br MCULE-2548770953 [0,1,0,0,0,1|1,0,1]=4 5017 B8R1.5 CC1=C(CNCC1)C MCULE-7715400597 [0,1,0,0,0,1|1,0,1]=4 5018 B8R1.5 CC1=C(CNCC1)C MCULE-9843104075 [0,1,0,0,0,1|1,0,1]=4 5019 B8R1.5 CC1=CCCCC1=O MCULE-6245248136 [0,1,0,0,0,1|0,0,1]=3 5020 B8R1.5 CC1=NCCCN1C MCULE-1598225464 [0,1,0,0,0,1|2,0,0]=4 5021 B8R1.5 CC1CCCCC1=O MCULE-6363555535 [0,1,0,0,0,1|0,0,0]=2 5022 B8R1.5 CC1CCCCC1C MCULE-9841432259 [0,1,0,0,0,1|1,0,1]=4 5023 B8R1.5 CC1CCCCC1N MCULE-3041016580 [0,1,0,0,0,1|1,0,1]=4 5024 B8R1.5 CC1CCCCC1N MCULE-4294403075 [0,1,0,0,0,1|1,0,1]=4 5025 B8R1.5 CC1CCCCC1O MCULE-2704647488 [0,1,0,0,0,1|0,0,2]=4 5026 B8R1.5 CC1CCCCN1C MCULE-8197728941 [0,1,0,0,0,1|1,0,1]=4 5027 B8R1.5 CC1CCCCN1N MCULE-8724967874 [0,1,0,0,0,1|1,0,1]=4 5028 B8R1.5 CC1CCCNC1=O MCULE-5295531632 [0,1,0,0,0,1|0,0,0]=2 5029 B8R1.5 CC1CCCNC1C MCULE-4611965577 [0,1,0,0,0,1|1,0,1]=4 5030 B8R1.5 CC1CCCNC1C MCULE-5766379292 [0,1,0,0,0,1|1,0,1]=4 5031 B8R1.5 CC1CCCNC1C MCULE-6191112458 [0,1,0,0,0,1|1,0,1]=4 5032 B8R1.5 CC1CCCOC1=O MCULE-5926029136 [0,1,0,0,0,1|0,0,0]=2 5033 B8R1.5 CC1CCNCC1=O MCULE-8618050685 [0,1,0,0,0,1|0,0,0]=2 5034 B8R1.5 CC1CCNCC1=O MCULE-9238977073 [0,1,0,0,0,1|0,0,0]=2 5035 B8R1.5 CC1CCNCC1C MCULE-5683848513 [0,1,0,0,0,1|1,0,1]=4 5036 B8R1.5 CC1CCNCC1F MCULE-2423279658 [0,1,0,0,0,1|1,0,1]=4 5037 B8R1.5 CC1CCNCC1F MCULE-3345403654 [0,1,0,0,0,1|1,0,1]=4 5038 B8R1.5 CC1CCNCC1O MCULE-5450375148 [0,1,0,0,0,1|0,0,2]=4 5039 B8R1.5 CC1CCNCC1O MCULE-5649027214 [0,1,0,0,0,1|0,0,2]=4 5040 B8R1.5 CC1CCOCC1=O MCULE-2481965177 [0,1,0,0,0,1|0,0,0]=2 5041 B8R1.5 CC1CNCCC1=O MCULE-6306655160 [0,1,0,0,0,1|0,0,0]=2 5042 B8R1.5 CC1CNCCC1=O MCULE-9018912988 [0,1,0,0,0,1|0,0,0]=2 5043 B8R1.5 CC1CNCCC1N MCULE-4288510851 [0,1,0,0,0,1|1,0,1]=4 5044 B8R1.5 CC1CNCCC1N MCULE-7264043917 [0,1,0,0,0,1|1,0,1]=4 5045 B8R1.5 CC1CNCCC1O MCULE-1960718296 [0,1,0,0,0,1|0,0,2]=4 5046 B8R1.5 CC1CNCCC1O MCULE-8434519185 [0,1,0,0,0,1|0,0,2]=4 5047 B8R1.5 CC1CNCCN1C MCULE-6819150286 [0,1,0,0,0,1|2,0,0]=4 5048 B8R1.5 CC1CNCCN1C MCULE-7498903385 [0,1,0,0,0,1|2,0,0]=4 5049 B8R1.5 CC1CNCCS1=O MCULE-7861495998 [0,1,0,0,0,1|1,0,0]=3 5050 B8R1.5 CC1COCCC1=O MCULE-2694187526 [0,1,0,0,0,1|0,0,0]=2 5051 B8R1.5 CC1COCCC1N MCULE-6236890728 [0,1,0,0,0,1|1,0,1]=4 5052 B8R1.5 CC1COCCC1N MCULE-7497946239 [0,1,0,0,0,1|1,0,1]=4 5053 B8R1.5 CC1COCCC1O MCULE-9430778912 [0,1,0,0,0,1|0,0,2]=4 5054 B8R1.5 CC1CSCCC1=O MCULE-4565033608 [0,1,0,0,0,1|0,0,0]=2 5055 B8R1.5 CC1NCCCC1=O MCULE-1303642695 [0,1,0,0,0,1|0,0,0]=2 5056 B8R1.5 CC1NCCCC1=O MCULE-6618358169 [0,1,0,0,0,1|0,0,0]=2 5057 B8R1.5 CC1NCCCC1O MCULE-4670774259 [0,1,0,0,0,1|0,0,2]=4 5058 B8R1.5 CC1NCCCC1O MCULE-7229970366 [0,1,0,0,0,1|0,0,2]=4 5059 B8R1.5 CC1NCCNC1=O MCULE-3078767867 [0,1,0,0,0,1|1,0,0]=3 5060 B8R1.5 CC1NCCNC1=O MCULE-9884862705 [0,1,0,0,0,1|1,0,0]=3 5061 B8R1.5 CC1OCCNC1=O MCULE-8812176499 [0,1,0,0,0,1|1,0,0]=3 5062 B8R1.5 CC1SCCCC1=O MCULE-7641066964 [0,1,0,0,0,1|0,0,0]=2 5063 B8R1.5 CC1SCCNC1=O MCULE-1825894745 [0,1,0,0,0,1|1,0,0]=3 5064 B8R1.5 CN1CCCCC1=O MCULE-9619129797 [0,1,0,0,0,1|0,0,0]=2 5065 B8R1.5 CN1CCCNC1=O MCULE-3141639397 [0,1,0,0,0,1|1,0,0]=3 5066 B8R1.5 CN1CCCNC1=S MCULE-2262321761 [0,1,0,0,0,1|1,1,0]=4 5067 B8R1.5 CN1CCNCC1=O MCULE-4783963074 [0,1,0,0,0,1|1,0,0]=3 5068 B8R1.5 CN1CCNCC1=O MCULE-7251084542 [0,1,0,0,0,1|1,0,0]=3 5069 B8R1.5 CN1CCNCC1=O MCULE-9201460493 [0,1,0,0,0,1|1,0,0]=3 5070 B8R1.5 CN1CCNCC1=O MCULE-9789420240 [0,1,0,0,0,1|1,0,0]=3 5071 B8R1.5 CN1CCOCC1=O MCULE-8864378597 [0,1,0,0,0,1|1,0,0]=3 5072 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-2207912311 [0,1,0,0,0,1|1,0,1]=4 5073 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-3227199256 [0,1,0,0,0,1|1,0,1]=4 5074 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-4948677049 [0,1,0,0,0,1|1,0,1]=4 5075 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-6377741621 [0,1,0,0,0,1|1,0,1]=4 5076 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-8426223529 [0,1,0,0,0,1|1,0,1]=4 5077 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-9542068395 [0,1,0,0,0,1|1,0,1]=4 5078 B8R1.5 C[C@@H]1CCCC[C@@H]1O MCULE-3547716632 [0,1,0,0,0,1|0,0,2]=4 5079 B8R1.5 C[C@@H]1CCCC[C@@H]1O MCULE-9259793572 [0,1,0,0,0,1|0,0,2]=4 5080 B8R1.5 C[C@@H]1CCCC[C@H]1N MCULE-2021817746 [0,1,0,0,0,1|1,0,1]=4 5081 B8R1.5 C[C@@H]1CCCC[C@H]1N MCULE-3944837592 [0,1,0,0,0,1|1,0,1]=4 5082 B8R1.5 C[C@@H]1CCCN[C@@H]1C MCULE-1550031816 [0,1,0,0,0,1|1,0,1]=4 5083 B8R1.5 C[C@@H]1CCCN[C@@H]1C MCULE-6650080658 [0,1,0,0,0,1|1,0,1]=4 5084 B8R1.5 C[C@@H]1CCCN[C@@H]1C MCULE-6715745499 [0,1,0,0,0,1|1,0,1]=4 5085 B8R1.5 C[C@@H]1CCCN[C@@H]1C MCULE-7283977917 [0,1,0,0,0,1|1,0,1]=4 5086 B8R1.5 C[C@@H]1CCNC[C@@H]1O MCULE-6946702609 [0,1,0,0,0,1|0,0,2]=4 5087 B8R1.5 C[C@@H]1CCNC[C@@H]1O MCULE-7899767253 [0,1,0,0,0,1|0,0,2]=4 5088 B8R1.5 C[C@@H]1CCNC[C@@H]1O MCULE-9159305922 [0,1,0,0,0,1|0,0,2]=4 5089 B8R1.5 C[C@@H]1CCNC[C@@H]1O MCULE-9391376462 [0,1,0,0,0,1|0,0,2]=4 5090 B8R1.5 C[C@@H]1CCNC[C@H]1F MCULE-1681100584 [0,1,0,0,0,1|1,0,1]=4 5091 B8R1.5 C[C@@H]1CCNC[C@H]1F MCULE-2733502904 [0,1,0,0,0,1|1,0,1]=4 5092 B8R1.5 C[C@@H]1CCNC[C@H]1O MCULE-4706073937 [0,1,0,0,0,1|0,0,2]=4 5093 B8R1.5 C[C@@H]1CCNC[C@H]1O MCULE-5188621987 [0,1,0,0,0,1|0,0,2]=4 5094 B8R1.5 C[C@@H]1CCNC[C@H]1O MCULE-6031430878 [0,1,0,0,0,1|0,0,2]=4 5095 B8R1.5 C[C@@H]1CCNC[C@H]1O MCULE-8311134495 [0,1,0,0,0,1|0,0,2]=4 5096 B8R1.5 C[C@@H]1CNCCN1C MCULE-4245576564 [0,1,0,0,0,1|2,0,0]=4 5097 B8R1.5 C[C@@H]1CNCCN1C MCULE-5117246567 [0,1,0,0,0,1|2,0,0]=4 5098 B8R1.5 C[C@@H]1CNCCN1C MCULE-6852418533 [0,1,0,0,0,1|2,0,0]=4 5099 B8R1.5 C[C@@H]1CNCCN1C MCULE-8377240136 [0,1,0,0,0,1|2,0,0]=4 5100 B8R1.5 C[C@@H]1CNCC[C@@H]1N MCULE-1733727000 [0,1,0,0,0,1|1,0,1]=4 5101 B8R1.5 C[C@@H]1CNCC[C@@H]1N MCULE-5971884774 [0,1,0,0,0,1|1,0,1]=4 5102 B8R1.5 C[C@@H]1CNCC[C@H]1N MCULE-4381780061 [0,1,0,0,0,1|1,0,1]=4 5103 B8R1.5 C[C@@H]1CNCC[C@H]1N MCULE-7332887720 [0,1,0,0,0,1|1,0,1]=4 5104 B8R1.5 C[C@@H]1CNCC[C@H]1O MCULE-1211656855 [0,1,0,0,0,1|0,0,2]=4 5105 B8R1.5 C[C@@H]1CNCC[C@H]1O MCULE-8887033073 [0,1,0,0,0,1|0,0,2]=4 5106 B8R1.5 C[C@@H]1COCC[C@@H]1N MCULE-1854737385 [0,1,0,0,0,1|1,0,1]=4 5107 B8R1.5 C[C@@H]1COCC[C@@H]1N MCULE-5272955365 [0,1,0,0,0,1|1,0,1]=4 5108 B8R1.5 C[C@@H]1COCC[C@H]1N MCULE-1385721208 [0,1,0,0,0,1|1,0,1]=4 5109 B8R1.5 C[C@@H]1COCC[C@H]1N MCULE-1584947952 [0,1,0,0,0,1|1,0,1]=4 5110 B8R1.5 C[C@@H]1COCC[C@H]1N MCULE-3448920251 [0,1,0,0,0,1|1,0,1]=4 5111 B8R1.5 C[C@@H]1COCC[C@H]1N MCULE-7256484712 [0,1,0,0,0,1|1,0,1]=4 5112 B8R1.5 C[C@@H]1NCCC[C@H]1O MCULE-4565116334 [0,1,0,0,0,1|0,0,2]=4 5113 B8R1.5 C[C@@H]1NCCNC1=O MCULE-1719923601 [0,1,0,0,0,1|1,0,0]=3 5114 B8R1.5 C[C@@H]1NCCNC1=O MCULE-3211216058 [0,1,0,0,0,1|1,0,0]=3 5115 B8R1.5 C[C@@H]1NCCNC1=O MCULE-4268624973 [0,1,0,0,0,1|1,0,0]=3 5116 B8R1.5 C[C@H]1CCCC[C@@H]1C MCULE-3536263334 [0,1,0,0,0,1|1,0,1]=4 5117 B8R1.5 C[C@H]1CCCC[C@@H]1C MCULE-5867798019 [0,1,0,0,0,1|1,0,1]=4 5118 B8R1.5 C[C@H]1CCCC[C@@H]1N MCULE-3841584035 [0,1,0,0,0,1|1,0,1]=4 5119 B8R1.5 C[C@H]1CCCC[C@@H]1N MCULE-4158219749 [0,1,0,0,0,1|1,0,1]=4 5120 B8R1.5 C[C@H]1CCCC[C@@H]1N MCULE-8973971252 [0,1,0,0,0,1|1,0,1]=4 5121 B8R1.5 C[C@H]1CCCC[C@@H]1N MCULE-9885453921 [0,1,0,0,0,1|1,0,1]=4 5122 B8R1.5 C[C@H]1CCCC[C@@H]1O MCULE-4879328575 [0,1,0,0,0,1|0,0,2]=4 5123 B8R1.5 C[C@H]1CCCC[C@@H]1O MCULE-7331434797 [0,1,0,0,0,1|0,0,2]=4 5124 B8R1.5 C[C@H]1CCCC[C@H]1C MCULE-9131794520 [0,1,0,0,0,1|1,0,1]=4 5125 B8R1.5 C[C@H]1CCCC[C@H]1N MCULE-1533998857 [0,1,0,0,0,1|1,0,1]=4 5126 B8R1.5 C[C@H]1CCCC[C@H]1N MCULE-5254242664 [0,1,0,0,0,1|1,0,1]=4 5127 B8R1.5 C[C@H]1CCCC[C@H]1N MCULE-5432486645 [0,1,0,0,0,1|1,0,1]=4 5128 B8R1.5 C[C@H]1CCCC[C@H]1N MCULE-7149509445 [0,1,0,0,0,1|1,0,1]=4 5129 B8R1.5 C[C@H]1CCNC[C@@H]1F MCULE-4761102749 [0,1,0,0,0,1|1,0,1]=4 5130 B8R1.5 C[C@H]1CCNC[C@@H]1F MCULE-8933374788 [0,1,0,0,0,1|1,0,1]=4 5131 B8R1.5 C[C@H]1CCNC[C@@H]1O MCULE-2413866964 [0,1,0,0,0,1|0,0,2]=4 5132 B8R1.5 C[C@H]1CCNC[C@@H]1O MCULE-3541397142 [0,1,0,0,0,1|0,0,2]=4 5133 B8R1.5 C[C@H]1CCNC[C@@H]1O MCULE-4524645861 [0,1,0,0,0,1|0,0,2]=4 5134 B8R1.5 C[C@H]1CCNC[C@@H]1O MCULE-4989324272 [0,1,0,0,0,1|0,0,2]=4 5135 B8R1.5 C[C@H]1CCNC[C@H]1F MCULE-4253107784 [0,1,0,0,0,1|1,0,1]=4 5136 B8R1.5 C[C@H]1CCNC[C@H]1F MCULE-5700696523 [0,1,0,0,0,1|1,0,1]=4 5137 B8R1.5 C[C@H]1CCNC[C@H]1O MCULE-6149485279 [0,1,0,0,0,1|0,0,2]=4 5138 B8R1.5 C[C@H]1CCNC[C@H]1O MCULE-9609136161 [0,1,0,0,0,1|0,0,2]=4 5139 B8R1.5 C[C@H]1CNCCC1=O MCULE-8062269317 [0,1,0,0,0,1|0,0,0]=2 5140 B8R1.5 C[C@H]1CNCCC1=O MCULE-9510433313 [0,1,0,0,0,1|0,0,0]=2 5141 B8R1.5 C[C@H]1CNCCN1C MCULE-2247489661 [0,1,0,0,0,1|2,0,0]=4 5142 B8R1.5 C[C@H]1CNCCN1C MCULE-2710257203 [0,1,0,0,0,1|2,0,0]=4 5143 B8R1.5 C[C@H]1CNCCN1C MCULE-4486771855 [0,1,0,0,0,1|2,0,0]=4 5144 B8R1.5 C[C@H]1CNCCN1C MCULE-8285859555 [0,1,0,0,0,1|2,0,0]=4 5145 B8R1.5 C[C@H]1CNCC[C@@H]1N MCULE-1222815331 [0,1,0,0,0,1|1,0,1]=4 5146 B8R1.5 C[C@H]1CNCC[C@@H]1N MCULE-1657518091 [0,1,0,0,0,1|1,0,1]=4 5147 B8R1.5 C[C@H]1CNCC[C@@H]1O MCULE-1418189839 [0,1,0,0,0,1|0,0,2]=4 5148 B8R1.5 C[C@H]1CNCC[C@@H]1O MCULE-2162007646 [0,1,0,0,0,1|0,0,2]=4 5149 B8R1.5 C[C@H]1CNCC[C@@H]1O MCULE-4884869364 [0,1,0,0,0,1|0,0,2]=4 5150 B8R1.5 C[C@H]1CNCC[C@@H]1O MCULE-9707177849 [0,1,0,0,0,1|0,0,2]=4 5151 B8R1.5 C[C@H]1CNCC[C@H]1N MCULE-2604448103 [0,1,0,0,0,1|1,0,1]=4 5152 B8R1.5 C[C@H]1CNCC[C@H]1N MCULE-4549710847 [0,1,0,0,0,1|1,0,1]=4 5153 B8R1.5 C[C@H]1CNCC[C@H]1O MCULE-1909814972 [0,1,0,0,0,1|0,0,2]=4 5154 B8R1.5 C[C@H]1CNCC[C@H]1O MCULE-8202226496 [0,1,0,0,0,1|0,0,2]=4 5155 B8R1.5 C[C@H]1CNCC[C@H]1O MCULE-9674887824 [0,1,0,0,0,1|0,0,2]=4 5156 B8R1.5 C[C@H]1CNCC[C@H]1O MCULE-9888495251 [0,1,0,0,0,1|0,0,2]=4 5157 B8R1.5 C[C@H]1COCCC1=O MCULE-3103478095 [0,1,0,0,0,1|0,0,0]=2 5158 B8R1.5 C[C@H]1COCC[C@@H]1N MCULE-3420685614 [0,1,0,0,0,1|1,0,1]=4 5159 B8R1.5 C[C@H]1COCC[C@@H]1N MCULE-4495690357 [0,1,0,0,0,1|1,0,1]=4 5160 B8R1.5 C[C@H]1COCC[C@@H]1N MCULE-9724547988 [0,1,0,0,0,1|1,0,1]=4 5161 B8R1.5 C[C@H]1COCC[C@@H]1N MCULE-9889716251 [0,1,0,0,0,1|1,0,1]=4 5162 B8R1.5 C[C@H]1COCC[C@H]1N MCULE-3075216082 [0,1,0,0,0,1|1,0,1]=4 5163 B8R1.5 C[C@H]1COCC[C@H]1N MCULE-4276602047 [0,1,0,0,0,1|1,0,1]=4 5164 B8R1.5 C[C@H]1COCC[C@H]1N MCULE-6090606114 [0,1,0,0,0,1|1,0,1]=4 5165 B8R1.5 C[C@H]1COCC[C@H]1N MCULE-6610603811 [0,1,0,0,0,1|1,0,1]=4 5166 B8R1.5 C[C@H]1NCCC[C@@H]1O MCULE-4581708846 [0,1,0,0,0,1|0,0,2]=4 5167 B8R1.5 C[C@H]1NCCNC1=O MCULE-1350777729 [0,1,0,0,0,1|1,0,0]=3 5168 B8R1.5 C[C@H]1NCCNC1=O MCULE-3433713206 [0,1,0,0,0,1|1,0,0]=3 5169 B8R1.5 C[C@H]1NCCNC1=O MCULE-6014092524 [0,1,0,0,0,1|1,0,0]=3 5170 B8R1.5 ClC1CCCCC1Cl MCULE-4249390413 [0,1,0,0,0,1|1,0,1]=4 5171 B8R1.5 Cl[C@@H]1CCCC[C@H]1Cl MCULE-7886724296 [0,1,0,0,0,1|1,0,1]=4 5172 B8R1.5 Cl[C@H]1CCCC[C@@H]1Br MCULE-5215368864 [0,1,0,0,0,1|1,0,1]=4 5173 B8R1.5 Cl[C@H]1CCCC[C@@H]1Cl MCULE-4820169474 [0,1,0,0,0,1|1,0,1]=4 5174 B8R1.5 Cl[C@H]1CCCC[C@@H]1Cl MCULE-7788819843 [0,1,0,0,0,1|1,0,1]=4 5175 B8R1.5 Cl[C@H]1CCCC[C@H]1Cl MCULE-8380485042 [0,1,0,0,0,1|1,0,1]=4 5176 B8R1.5 FC1=C(CCCC1)Br MCULE-1560441134 [0,1,0,0,0,1|1,0,0]=3 5177 B8R1.5 FC1CCCCC1Br MCULE-5989278401 [0,1,0,0,0,1|1,0,1]=4 5178 B8R1.5 FC1CCNCC1F MCULE-6536309243 [0,1,0,0,0,1|1,0,1]=4 5179 B8R1.5 FC1CCNCC1F MCULE-7145018916 [0,1,0,0,0,1|1,0,1]=4 5180 B8R1.5 F[C@@H]1CCNC[C@H]1F MCULE-6799503527 [0,1,0,0,0,1|1,0,1]=4 5181 B8R1.5 F[C@@H]1CCNC[C@H]1F MCULE-9656045295 [0,1,0,0,0,1|1,0,1]=4 5182 B8R1.5 F[C@H]1CCNC[C@H]1F MCULE-3083739703 [0,1,0,0,0,1|1,0,1]=4 5183 B8R1.5 F[C@H]1CCNC[C@H]1F MCULE-5631085665 [0,1,0,0,0,1|1,0,1]=4 5184 B8R1.5 F[C@H]1CNCC[C@H]1F MCULE-6688369638 [0,1,0,0,0,1|1,0,1]=4 5185 B8R1.5 F[C@H]1CNCC[C@H]1F MCULE-7021410764 [0,1,0,0,0,1|1,0,1]=4 5186 B8R1.5 NC1CCCCC1=O MCULE-2382898926 [0,1,0,0,0,1|0,0,0]=2 5187 B8R1.5 NC1CCCCC1=O MCULE-9230455128 [0,1,0,0,0,1|0,0,0]=2 5188 B8R1.5 NC1CCCCC1Cl MCULE-3676302646 [0,1,0,0,0,1|1,0,1]=4 5189 B8R1.5 NC1CCCCC1Cl MCULE-7920658638 [0,1,0,0,0,1|1,0,1]=4 5190 B8R1.5 NC1CCCCC1F MCULE-6643891539 [0,1,0,0,0,1|1,0,1]=4 5191 B8R1.5 NC1CCCCC1F MCULE-7855236144 [0,1,0,0,0,1|1,0,1]=4 5192 B8R1.5 NC1CCCCC1N MCULE-1677916175 [0,1,0,0,0,1|1,0,1]=4 5193 B8R1.5 NC1CCCCC1N MCULE-9568644004 [0,1,0,0,0,1|1,0,1]=4 5194 B8R1.5 NC1CCCCC1O MCULE-1427424523 [0,1,0,0,0,1|0,0,2]=4 5195 B8R1.5 NC1CCCCC1O MCULE-2793336591 [0,1,0,0,0,1|0,0,2]=4 5196 B8R1.5 NC1CCCNC1=O MCULE-2560564171 [0,1,0,0,0,1|0,0,0]=2 5197 B8R1.5 NC1CCCNC1=O MCULE-4494449620 [0,1,0,0,0,1|0,0,0]=2 5198 B8R1.5 NC1CCCNC1=O MCULE-7473475906 [0,1,0,0,0,1|0,0,0]=2 5199 B8R1.5 NC1CCCNC1=O MCULE-8288645102 [0,1,0,0,0,1|0,0,0]=2 5200 B8R1.5 NC1CCNCC1O MCULE-2705091841 [0,1,0,0,0,1|0,0,2]=4 5201 B8R1.5 NC1CCOCC1F MCULE-1016932578 [0,1,0,0,0,1|1,0,1]=4 5202 B8R1.5 NC1CCOCC1F MCULE-9622790392 [0,1,0,0,0,1|1,0,1]=4 5203 B8R1.5 NC1CCOCC1O MCULE-2815184899 [0,1,0,0,0,1|0,0,2]=4 5204 B8R1.5 NC1CCOCC1O MCULE-4548392204 [0,1,0,0,0,1|0,0,2]=4 5205 B8R1.5 NC1COCCC1=O MCULE-2621905094 [0,1,0,0,0,1|0,0,0]=2 5206 B8R1.5 NC1COCCC1=O MCULE-5417580672 [0,1,0,0,0,1|0,0,0]=2 5207 B8R1.5 NC1COCCC1F MCULE-1455837903 [0,1,0,0,0,1|1,0,1]=4 5208 B8R1.5 NC1COCCC1F MCULE-7145252320 [0,1,0,0,0,1|1,0,1]=4 5209 B8R1.5 NC1COCCC1O MCULE-6374385354 [0,1,0,0,0,1|0,0,2]=4 5210 B8R1.5 NC1COCCC1O MCULE-7944406292 [0,1,0,0,0,1|0,0,2]=4 5211 B8R1.5 NN1CCCCC1=O MCULE-3663308028 [0,1,0,0,0,1|0,0,0]=2 5212 B8R1.5 NN1CCCCC1=O MCULE-9929233745 [0,1,0,0,0,1|0,0,0]=2 5213 B8R1.5 NN1CCCNC1=O MCULE-1690172508 [0,1,0,0,0,1|1,0,0]=3 5214 B8R1.5 NN1CCCOC1=O MCULE-6942418314 [0,1,0,0,0,1|1,0,0]=3 5215 B8R1.5 N[C@@H]1CCCC[C@@H]1F MCULE-1657692826 [0,1,0,0,0,1|1,0,1]=4 5216 B8R1.5 N[C@@H]1CCCC[C@@H]1F MCULE-3328673946 [0,1,0,0,0,1|1,0,1]=4 5217 B8R1.5 N[C@@H]1CCCC[C@@H]1O MCULE-2753918610 [0,1,0,0,0,1|0,0,2]=4 5218 B8R1.5 N[C@@H]1CCCC[C@@H]1O MCULE-2761271370 [0,1,0,0,0,1|0,0,2]=4 5219 B8R1.5 N[C@@H]1CCCC[C@@H]1O MCULE-4978213189 [0,1,0,0,0,1|0,0,2]=4 5220 B8R1.5 N[C@@H]1CCCC[C@@H]1O MCULE-9182719952 [0,1,0,0,0,1|0,0,2]=4 5221 B8R1.5 N[C@@H]1CCCC[C@H]1F MCULE-3474870548 [0,1,0,0,0,1|1,0,1]=4 5222 B8R1.5 N[C@@H]1CCCC[C@H]1F MCULE-3984172565 [0,1,0,0,0,1|1,0,1]=4 5223 B8R1.5 N[C@@H]1CCCC[C@H]1F MCULE-4705427644 [0,1,0,0,0,1|1,0,1]=4 5224 B8R1.5 N[C@@H]1CCCC[C@H]1F MCULE-7025237099 [0,1,0,0,0,1|1,0,1]=4 5225 B8R1.5 N[C@@H]1CCCC[C@H]1N MCULE-1186999216 [0,1,0,0,0,1|1,0,1]=4 5226 B8R1.5 N[C@@H]1CCCC[C@H]1N MCULE-2134025562 [0,1,0,0,0,1|1,0,1]=4 5227 B8R1.5 N[C@@H]1CCCC[C@H]1N MCULE-6149251599 [0,1,0,0,0,1|1,0,1]=4 5228 B8R1.5 N[C@@H]1CCCC[C@H]1N MCULE-6588424966 [0,1,0,0,0,1|1,0,1]=4 5229 B8R1.5 N[C@@H]1CCCC[C@H]1O MCULE-1509174959 [0,1,0,0,0,1|0,0,2]=4 5230 B8R1.5 N[C@@H]1CCCC[C@H]1O MCULE-2336529349 [0,1,0,0,0,1|0,0,2]=4 5231 B8R1.5 N[C@@H]1CCCC[C@H]1O MCULE-4732604931 [0,1,0,0,0,1|0,0,2]=4 5232 B8R1.5 N[C@@H]1CCCC[C@H]1O MCULE-6124510830 [0,1,0,0,0,1|0,0,2]=4 5233 B8R1.5 N[C@@H]1CCCC[C@H]1O MCULE-7301593250 [0,1,0,0,0,1|0,0,2]=4 5234 B8R1.5 N[C@@H]1CCCC[C@H]1O MCULE-8501577810 [0,1,0,0,0,1|0,0,2]=4 5235 B8R1.5 N[C@@H]1CCCNC1=O MCULE-2058435105 [0,1,0,0,0,1|0,0,0]=2 5236 B8R1.5 N[C@@H]1CCCNC1=O MCULE-2444659445 [0,1,0,0,0,1|0,0,0]=2 5237 B8R1.5 N[C@@H]1CCCNC1=O MCULE-3005560472 [0,1,0,0,0,1|0,0,0]=2 5238 B8R1.5 N[C@@H]1CCCNC1=O MCULE-6935410876 [0,1,0,0,0,1|0,0,0]=2 5239 B8R1.5 N[C@@H]1CCNC[C@H]1O MCULE-1435526553 [0,1,0,0,0,1|0,0,2]=4 5240 B8R1.5 N[C@@H]1CCNC[C@H]1O MCULE-8731873892 [0,1,0,0,0,1|0,0,2]=4 5241 B8R1.5 N[C@@H]1CCOC[C@@H]1F MCULE-1239747130 [0,1,0,0,0,1|1,0,1]=4 5242 B8R1.5 N[C@@H]1CCOC[C@@H]1F MCULE-2720196545 [0,1,0,0,0,1|1,0,1]=4 5243 B8R1.5 N[C@@H]1CCOC[C@@H]1F MCULE-4681308404 [0,1,0,0,0,1|1,0,1]=4 5244 B8R1.5 N[C@@H]1CCOC[C@@H]1F MCULE-5510784592 [0,1,0,0,0,1|1,0,1]=4 5245 B8R1.5 N[C@@H]1CCOC[C@@H]1F MCULE-6118396691 [0,1,0,0,0,1|1,0,1]=4 5246 B8R1.5 N[C@@H]1CCOC[C@@H]1F MCULE-9001277868 [0,1,0,0,0,1|1,0,1]=4 5247 B8R1.5 N[C@@H]1CCOC[C@@H]1O MCULE-1888816293 [0,1,0,0,0,1|0,0,2]=4 5248 B8R1.5 N[C@@H]1CCOC[C@@H]1O MCULE-3667258867 [0,1,0,0,0,1|0,0,2]=4 5249 B8R1.5 N[C@@H]1CCOC[C@@H]1O MCULE-3915823883 [0,1,0,0,0,1|0,0,2]=4 5250 B8R1.5 N[C@@H]1CCOC[C@@H]1O MCULE-9959521476 [0,1,0,0,0,1|0,0,2]=4 5251 B8R1.5 N[C@@H]1CCOC[C@H]1F MCULE-3556707940 [0,1,0,0,0,1|1,0,1]=4 5252 B8R1.5 N[C@@H]1CCOC[C@H]1F MCULE-4525092522 [0,1,0,0,0,1|1,0,1]=4 5253 B8R1.5 N[C@@H]1CCOC[C@H]1F MCULE-7086756183 [0,1,0,0,0,1|1,0,1]=4 5254 B8R1.5 N[C@@H]1CCOC[C@H]1F MCULE-8506007792 [0,1,0,0,0,1|1,0,1]=4 5255 B8R1.5 N[C@@H]1CCOC[C@H]1O MCULE-1071839837 [0,1,0,0,0,1|0,0,2]=4 5256 B8R1.5 N[C@@H]1CCOC[C@H]1O MCULE-6051401821 [0,1,0,0,0,1|0,0,2]=4 5257 B8R1.5 N[C@@H]1CCOC[C@H]1O MCULE-7013720281 [0,1,0,0,0,1|0,0,2]=4 5258 B8R1.5 N[C@@H]1CCOC[C@H]1O MCULE-8477518337 [0,1,0,0,0,1|0,0,2]=4 5259 B8R1.5 N[C@@H]1COCC[C@@H]1O MCULE-1031623201 [0,1,0,0,0,1|0,0,2]=4 5260 B8R1.5 N[C@@H]1COCC[C@@H]1O MCULE-2846030882 [0,1,0,0,0,1|0,0,2]=4 5261 B8R1.5 N[C@@H]1COCC[C@@H]1O MCULE-8863364874 [0,1,0,0,0,1|0,0,2]=4 5262 B8R1.5 N[C@@H]1COCC[C@@H]1O MCULE-9836639365 [0,1,0,0,0,1|0,0,2]=4 5263 B8R1.5 N[C@@H]1COCC[C@H]1F MCULE-2318671918 [0,1,0,0,0,1|1,0,1]=4 5264 B8R1.5 N[C@@H]1COCC[C@H]1F MCULE-3695420668 [0,1,0,0,0,1|1,0,1]=4 5265 B8R1.5 N[C@@H]1COCC[C@H]1F MCULE-6955873978 [0,1,0,0,0,1|1,0,1]=4 5266 B8R1.5 N[C@@H]1COCC[C@H]1F MCULE-8343413560 [0,1,0,0,0,1|1,0,1]=4 5267 B8R1.5 N[C@@H]1COCC[C@H]1O MCULE-4436769496 [0,1,0,0,0,1|0,0,2]=4 5268 B8R1.5 N[C@@H]1COCC[C@H]1O MCULE-6163244980 [0,1,0,0,0,1|0,0,2]=4 5269 B8R1.5 N[C@@H]1COCC[C@H]1O MCULE-8697534407 [0,1,0,0,0,1|0,0,2]=4 5270 B8R1.5 N[C@@H]1COCC[C@H]1O MCULE-9625047427 [0,1,0,0,0,1|0,0,2]=4 5271 B8R1.5 N[C@H]1CCCC[C@@H]1F MCULE-2983212378 [0,1,0,0,0,1|1,0,1]=4 5272 B8R1.5 N[C@H]1CCCC[C@@H]1F MCULE-6196710696 [0,1,0,0,0,1|1,0,1]=4 5273 B8R1.5 N[C@H]1CCCC[C@@H]1N MCULE-3653211978 [0,1,0,0,0,1|1,0,1]=4 5274 B8R1.5 N[C@H]1CCCC[C@@H]1N MCULE-5059719804 [0,1,0,0,0,1|1,0,1]=4 5275 B8R1.5 N[C@H]1CCCC[C@@H]1O MCULE-1277967673 [0,1,0,0,0,1|0,0,2]=4 5276 B8R1.5 N[C@H]1CCCC[C@@H]1O MCULE-1301750612 [0,1,0,0,0,1|0,0,2]=4 5277 B8R1.5 N[C@H]1CCCC[C@@H]1O MCULE-3861922722 [0,1,0,0,0,1|0,0,2]=4 5278 B8R1.5 N[C@H]1CCCC[C@@H]1O MCULE-8489439004 [0,1,0,0,0,1|0,0,2]=4 5279 B8R1.5 N[C@H]1CCCC[C@H]1F MCULE-7579368841 [0,1,0,0,0,1|1,0,1]=4 5280 B8R1.5 N[C@H]1CCCC[C@H]1F MCULE-8479221038 [0,1,0,0,0,1|1,0,1]=4 5281 B8R1.5 N[C@H]1CCCC[C@H]1N MCULE-2011367325 [0,1,0,0,0,1|1,0,1]=4 5282 B8R1.5 N[C@H]1CCCC[C@H]1N MCULE-7126233212 [0,1,0,0,0,1|1,0,1]=4 5283 B8R1.5 N[C@H]1CCCC[C@H]1O MCULE-1599409645 [0,1,0,0,0,1|0,0,2]=4 5284 B8R1.5 N[C@H]1CCCC[C@H]1O MCULE-3318800690 [0,1,0,0,0,1|0,0,2]=4 5285 B8R1.5 N[C@H]1CCCC[C@H]1O MCULE-4235445104 [0,1,0,0,0,1|0,0,2]=4 5286 B8R1.5 N[C@H]1CCCC[C@H]1O MCULE-6518289705 [0,1,0,0,0,1|0,0,2]=4 5287 B8R1.5 N[C@H]1CCCC[C@H]1O MCULE-6606691116 [0,1,0,0,0,1|0,0,2]=4 5288 B8R1.5 N[C@H]1CCCC[C@H]1O MCULE-9979333085 [0,1,0,0,0,1|0,0,2]=4 5289 B8R1.5 N[C@H]1CCCNC1=O MCULE-1247931890 [0,1,0,0,0,1|0,0,0]=2 5290 B8R1.5 N[C@H]1CCCNC1=O MCULE-2425510086 [0,1,0,0,0,1|0,0,0]=2 5291 B8R1.5 N[C@H]1CCCNC1=O MCULE-6121950966 [0,1,0,0,0,1|0,0,0]=2 5292 B8R1.5 N[C@H]1CCCNC1=O MCULE-7701042199 [0,1,0,0,0,1|0,0,0]=2 5293 B8R1.5 N[C@H]1CCOC[C@@H]1F MCULE-1493875164 [0,1,0,0,0,1|1,0,1]=4 5294 B8R1.5 N[C@H]1CCOC[C@@H]1F MCULE-2102376472 [0,1,0,0,0,1|1,0,1]=4 5295 B8R1.5 N[C@H]1CCOC[C@@H]1F MCULE-6109633704 [0,1,0,0,0,1|1,0,1]=4 5296 B8R1.5 N[C@H]1CCOC[C@@H]1F MCULE-7337274868 [0,1,0,0,0,1|1,0,1]=4 5297 B8R1.5 N[C@H]1CCOC[C@@H]1F MCULE-9740357152 [0,1,0,0,0,1|1,0,1]=4 5298 B8R1.5 N[C@H]1CCOC[C@@H]1F MCULE-9831607120 [0,1,0,0,0,1|1,0,1]=4 5299 B8R1.5 N[C@H]1CCOC[C@@H]1O MCULE-1217623714 [0,1,0,0,0,1|0,0,2]=4 5300 B8R1.5 N[C@H]1CCOC[C@@H]1O MCULE-4607259008 [0,1,0,0,0,1|0,0,2]=4 5301 B8R1.5 N[C@H]1CCOC[C@@H]1O MCULE-4749541215 [0,1,0,0,0,1|0,0,2]=4 5302 B8R1.5 N[C@H]1CCOC[C@@H]1O MCULE-9683658087 [0,1,0,0,0,1|0,0,2]=4 5303 B8R1.5 N[C@H]1CCOC[C@H]1F MCULE-1550590585 [0,1,0,0,0,1|1,0,1]=4 5304 B8R1.5 N[C@H]1CCOC[C@H]1F MCULE-4067592428 [0,1,0,0,0,1|1,0,1]=4 5305 B8R1.5 N[C@H]1CCOC[C@H]1F MCULE-4649837852 [0,1,0,0,0,1|1,0,1]=4 5306 B8R1.5 N[C@H]1CCOC[C@H]1F MCULE-6334068028 [0,1,0,0,0,1|1,0,1]=4 5307 B8R1.5 N[C@H]1CCOC[C@H]1O MCULE-1807586879 [0,1,0,0,0,1|0,0,2]=4 5308 B8R1.5 N[C@H]1CCOC[C@H]1O MCULE-1937023434 [0,1,0,0,0,1|0,0,2]=4 5309 B8R1.5 N[C@H]1CCOC[C@H]1O MCULE-4374635229 [0,1,0,0,0,1|0,0,2]=4 5310 B8R1.5 N[C@H]1CCOC[C@H]1O MCULE-4873019238 [0,1,0,0,0,1|0,0,2]=4 5311 B8R1.5 N[C@H]1COCC[C@@H]1O MCULE-1937054893 [0,1,0,0,0,1|0,0,2]=4 5312 B8R1.5 N[C@H]1COCC[C@@H]1O MCULE-4877924283 [0,1,0,0,0,1|0,0,2]=4 5313 B8R1.5 N[C@H]1COCC[C@@H]1O MCULE-6674323819 [0,1,0,0,0,1|0,0,2]=4 5314 B8R1.5 N[C@H]1COCC[C@H]1O MCULE-7305089306 [0,1,0,0,0,1|0,0,2]=4 5315 B8R1.5 N[C@H]1COCC[C@H]1O MCULE-8372108333 [0,1,0,0,0,1|0,0,2]=4 5316 B8R1.5 O=C1CCCC=C1Br MCULE-3661382076 [0,1,0,0,0,1|0,0,1]=3 5317 B8R1.5 O=C1CCCC=C1I MCULE-5006563152 [0,1,0,0,0,1|0,0,1]=3 5318 B8R1.5 O=C1CCCCC1=O MCULE-5770827130 [0,1,0,0,0,1|0,0,0]=2 5319 B8R1.5 O=C1CCCCC1Br MCULE-9356057483 [0,1,0,0,0,1|0,0,0]=2 5320 B8R1.5 O=C1CCCCC1Cl MCULE-1580566298 [0,1,0,0,0,1|0,0,0]=2 5321 B8R1.5 O=C1CCCCC1F MCULE-6406930837 [0,1,0,0,0,1|0,0,0]=2 5322 B8R1.5 O=C1CCCCC1O MCULE-7509366699 [0,1,0,0,0,1|0,0,0]=2 5323 B8R1.5 O=C1CCCNC1=O MCULE-3369124759 [0,1,0,0,0,1|0,0,1]=3 5324 B8R1.5 O=C1CCNCC1Br MCULE-1607524353 [0,1,0,0,0,1|0,0,0]=2 5325 B8R1.5 O=C1CCNCC1Br MCULE-2623420651 [0,1,0,0,0,1|0,0,0]=2 5326 B8R1.5 O=C1CCNCC1Br MCULE-9921456309 [0,1,0,0,0,1|0,0,0]=2 5327 B8R1.5 O=C1CCNCC1F MCULE-4156323292 [0,1,0,0,0,1|0,0,0]=2 5328 B8R1.5 O=C1CCNCC1F MCULE-5488977269 [0,1,0,0,0,1|0,0,0]=2 5329 B8R1.5 O=C1CCNC[C@@H]1F MCULE-1703177711 [0,1,0,0,0,1|0,0,0]=2 5330 B8R1.5 O=C1CCNC[C@@H]1F MCULE-2722101377 [0,1,0,0,0,1|0,0,0]=2 5331 B8R1.5 O=C1CCNC[C@@H]1F MCULE-3843083136 [0,1,0,0,0,1|0,0,0]=2 5332 B8R1.5 O=C1CCNC[C@@H]1F MCULE-8423259867 [0,1,0,0,0,1|0,0,0]=2 5333 B8R1.5 O=C1CCNC[C@H]1F MCULE-4893691455 [0,1,0,0,0,1|0,0,0]=2 5334 B8R1.5 O=C1CCNC[C@H]1F MCULE-7014608979 [0,1,0,0,0,1|0,0,0]=2 5335 B8R1.5 O=C1CCOCC1Br MCULE-1103002154 [0,1,0,0,0,1|0,0,0]=2 5336 B8R1.5 O=C1CCOCC1Cl MCULE-6926183930 [0,1,0,0,0,1|0,0,0]=2 5337 B8R1.5 O=C1CCOCC1F MCULE-8590362767 [0,1,0,0,0,1|0,0,0]=2 5338 B8R1.5 O=C1CCOCC1O MCULE-7032874317 [0,1,0,0,0,1|0,0,0]=2 5339 B8R1.5 O=C1CCOC[C@@H]1Br MCULE-8729201111 [0,1,0,0,0,1|0,0,0]=2 5340 B8R1.5 O=C1CCOC[C@@H]1F MCULE-3075219245 [0,1,0,0,0,1|0,0,0]=2 5341 B8R1.5 O=C1NCCC=C1Br MCULE-7421402456 [0,1,0,0,0,1|0,0,2]=4 5342 B8R1.5 O=C1NCCC=C1Cl MCULE-9026882449 [0,1,0,0,0,1|0,0,2]=4 5343 B8R1.5 O=C1NCCCC1Br MCULE-1860833784 [0,1,0,0,0,1|0,0,0]=2 5344 B8R1.5 O=C1NCCCC1O MCULE-4922755542 [0,1,0,0,0,1|0,0,0]=2 5345 B8R1.5 O=C1NCCC[C@@H]1O MCULE-2813817931 [0,1,0,0,0,1|0,0,0]=2 5346 B8R1.5 O=C1NCCC[C@@H]1O MCULE-3354550946 [0,1,0,0,0,1|0,0,0]=2 5347 B8R1.5 O=C1NCCC[C@H]1O MCULE-2892218765 [0,1,0,0,0,1|0,0,0]=2 5348 B8R1.5 O=C1NCCC[C@H]1O MCULE-8394704933 [0,1,0,0,0,1|0,0,0]=2 5349 B8R1.5 O=C1NCCNC1=O MCULE-5492631108 [0,1,0,0,0,1|1,0,1]=4 5350 B8R1.5 O=C1NCCOC1=O MCULE-5092732656 [0,1,0,0,0,1|1,0,1]=4 5351 B8R1.5 O=C1OCCC=C1Br MCULE-6619697801 [0,1,0,0,0,1|0,0,2]=4 5352 B8R1.5 O=C1OCCCC1Br MCULE-4407787541 [0,1,0,0,0,1|0,0,0]=2 5353 B8R1.5 O=C1OCCCC1O MCULE-3021418071 [0,1,0,0,0,1|0,0,0]=2 5354 B8R1.5 OC1CCCC=C1Br MCULE-1040444564 [0,1,0,0,0,1|1,0,0]=3 5355 B8R1.5 OC1CCCCC1Cl MCULE-8650942069 [0,1,0,0,0,1|0,0,2]=4 5356 B8R1.5 OC1CCCCC1F MCULE-7634543650 [0,1,0,0,0,1|0,0,2]=4 5357 B8R1.5 OC1CCCCC1O MCULE-2967360901 [0,1,0,0,0,1|0,0,2]=4 5358 B8R1.5 OC1CCNCC1F MCULE-3466397366 [0,1,0,0,0,1|0,0,2]=4 5359 B8R1.5 OC1CCNCC1F MCULE-8065194779 [0,1,0,0,0,1|0,0,2]=4 5360 B8R1.5 OC1CCNCC1O MCULE-3039573850 [0,1,0,0,0,1|0,0,2]=4 5361 B8R1.5 OC1CCNCC1O MCULE-8828122539 [0,1,0,0,0,1|0,0,2]=4 5362 B8R1.5 OC1CCOCC1F MCULE-6531880501 [0,1,0,0,0,1|0,0,2]=4 5363 B8R1.5 OC1CNCCC1F MCULE-2946280821 [0,1,0,0,0,1|0,0,2]=4 5364 B8R1.5 OC1CNCCC1F MCULE-3493148821 [0,1,0,0,0,1|0,0,2]=4 5365 B8R1.5 O[C@@H]1CCCC=C1Br MCULE-9847748740 [0,1,0,0,0,1|1,0,0]=3 5366 B8R1.5 O[C@@H]1CCCC[C@H]1F MCULE-2305949625 [0,1,0,0,0,1|0,0,2]=4 5367 B8R1.5 O[C@@H]1CCCC[C@H]1O MCULE-3067807104 [0,1,0,0,0,1|0,0,2]=4 5368 B8R1.5 O[C@@H]1CCCC[C@H]1O MCULE-3429096841 [0,1,0,0,0,1|0,0,2]=4 5369 B8R1.5 O[C@@H]1CCCC[C@H]1O MCULE-9892753066 [0,1,0,0,0,1|0,0,2]=4 5370 B8R1.5 O[C@@H]1CCCC[C@H]1S MCULE-6222162383 [0,1,0,0,0,1|0,0,2]=4 5371 B8R1.5 O[C@@H]1CCNC[C@@H]1F MCULE-3951980250 [0,1,0,0,0,1|0,0,2]=4 5372 B8R1.5 O[C@@H]1CCNC[C@@H]1F MCULE-4022160407 [0,1,0,0,0,1|0,0,2]=4 5373 B8R1.5 O[C@@H]1CCNC[C@@H]1F MCULE-7163743424 [0,1,0,0,0,1|0,0,2]=4 5374 B8R1.5 O[C@@H]1CCNC[C@@H]1F MCULE-9380154478 [0,1,0,0,0,1|0,0,2]=4 5375 B8R1.5 O[C@@H]1CCNC[C@H]1F MCULE-2399390264 [0,1,0,0,0,1|0,0,2]=4 5376 B8R1.5 O[C@@H]1CCNC[C@H]1F MCULE-6405573375 [0,1,0,0,0,1|0,0,2]=4 5377 B8R1.5 O[C@@H]1CCNC[C@H]1F MCULE-7590255724 [0,1,0,0,0,1|0,0,2]=4 5378 B8R1.5 O[C@@H]1CCNC[C@H]1F MCULE-8845231230 [0,1,0,0,0,1|0,0,2]=4 5379 B8R1.5 O[C@@H]1CCNC[C@H]1O MCULE-3688872623 [0,1,0,0,0,1|0,0,2]=4 5380 B8R1.5 O[C@@H]1CCNC[C@H]1O MCULE-5098984807 [0,1,0,0,0,1|0,0,2]=4 5381 B8R1.5 O[C@@H]1CCOC[C@@H]1F MCULE-1035298575 [0,1,0,0,0,1|0,0,2]=4 5382 B8R1.5 O[C@@H]1CCOC[C@@H]1F MCULE-7549327189 [0,1,0,0,0,1|0,0,2]=4 5383 B8R1.5 O[C@@H]1CCOC[C@H]1F MCULE-5919881662 [0,1,0,0,0,1|0,0,2]=4 5384 B8R1.5 O[C@@H]1CNCC[C@@H]1F MCULE-1622561753 [0,1,0,0,0,1|0,0,2]=4 5385 B8R1.5 O[C@@H]1CNCC[C@@H]1F MCULE-6945313787 [0,1,0,0,0,1|0,0,2]=4 5386 B8R1.5 O[C@@H]1CNCC[C@H]1F MCULE-3612777118 [0,1,0,0,0,1|0,0,2]=4 5387 B8R1.5 O[C@@H]1CNCC[C@H]1F MCULE-5621905223 [0,1,0,0,0,1|0,0,2]=4 5388 B8R1.5 O[C@@H]1CNCC[C@H]1F MCULE-6188298332 [0,1,0,0,0,1|0,0,2]=4 5389 B8R1.5 O[C@@H]1CNCC[C@H]1F MCULE-7586426338 [0,1,0,0,0,1|0,0,2]=4 5390 B8R1.5 O[C@H]1CCCC[C@@H]1F MCULE-7833708338 [0,1,0,0,0,1|0,0,2]=4 5391 B8R1.5 O[C@H]1CCCC[C@@H]1O MCULE-7078207162 [0,1,0,0,0,1|0,0,2]=4 5392 B8R1.5 O[C@H]1CCCC[C@@H]1O MCULE-9836847707 [0,1,0,0,0,1|0,0,2]=4 5393 B8R1.5 O[C@H]1CCCC[C@H]1Br MCULE-8133807743 [0,1,0,0,0,1|0,0,2]=4 5394 B8R1.5 O[C@H]1CCCC[C@H]1O MCULE-3539097516 [0,1,0,0,0,1|0,0,2]=4 5395 B8R1.5 O[C@H]1CCNC[C@@H]1F MCULE-1808200479 [0,1,0,0,0,1|0,0,2]=4 5396 B8R1.5 O[C@H]1CCNC[C@@H]1F MCULE-5879546904 [0,1,0,0,0,1|0,0,2]=4 5397 B8R1.5 O[C@H]1CCNC[C@@H]1F MCULE-7720582046 [0,1,0,0,0,1|0,0,2]=4 5398 B8R1.5 O[C@H]1CCNC[C@@H]1F MCULE-9733376385 [0,1,0,0,0,1|0,0,2]=4 5399 B8R1.5 O[C@H]1CCNC[C@@H]1O MCULE-1740802653 [0,1,0,0,0,1|0,0,2]=4 5400 B8R1.5 O[C@H]1CCNC[C@@H]1O MCULE-5396588753 [0,1,0,0,0,1|0,0,2]=4 5401 B8R1.5 O[C@H]1CCNC[C@@H]1O MCULE-6762598540 [0,1,0,0,0,1|0,0,2]=4 5402 B8R1.5 O[C@H]1CCNC[C@@H]1O MCULE-9747818285 [0,1,0,0,0,1|0,0,2]=4 5403 B8R1.5 O[C@H]1CCNC[C@H]1F MCULE-2742864171 [0,1,0,0,0,1|0,0,2]=4 5404 B8R1.5 O[C@H]1CCNC[C@H]1F MCULE-4720397627 [0,1,0,0,0,1|0,0,2]=4 5405 B8R1.5 O[C@H]1CCNC[C@H]1F MCULE-7747536704 [0,1,0,0,0,1|0,0,2]=4 5406 B8R1.5 O[C@H]1CCNC[C@H]1F MCULE-9341492038 [0,1,0,0,0,1|0,0,2]=4 5407 B8R1.5 O[C@H]1CCNC[C@H]1O MCULE-2865586489 [0,1,0,0,0,1|0,0,2]=4 5408 B8R1.5 O[C@H]1CCNC[C@H]1O MCULE-6097537639 [0,1,0,0,0,1|0,0,2]=4 5409 B8R1.5 O[C@H]1CCNC[C@H]1O MCULE-8152004203 [0,1,0,0,0,1|0,0,2]=4 5410 B8R1.5 O[C@H]1CCNC[C@H]1O MCULE-8500578666 [0,1,0,0,0,1|0,0,2]=4 5411 B8R1.5 O[C@H]1CCOC[C@@H]1F MCULE-6227313100 [0,1,0,0,0,1|0,0,2]=4 5412 B8R1.5 O[C@H]1CCOC[C@@H]1F MCULE-8454301102 [0,1,0,0,0,1|0,0,2]=4 5413 B8R1.5 O[C@H]1CCOC[C@H]1F MCULE-6598998730 [0,1,0,0,0,1|0,0,2]=4 5414 B8R1.5 O[C@H]1CCOC[C@H]1F MCULE-7224746770 [0,1,0,0,0,1|0,0,2]=4 5415 B8R1.5 O[C@H]1CCOC[C@H]1F MCULE-7648243504 [0,1,0,0,0,1|0,0,2]=4 5416 B8R1.5 O[C@H]1CNCC[C@@H]1F MCULE-1003695930 [0,1,0,0,0,1|0,0,2]=4 5417 B8R1.5 O[C@H]1CNCC[C@@H]1F MCULE-2595427193 [0,1,0,0,0,1|0,0,2]=4 5418 B8R1.5 O[C@H]1CNCC[C@@H]1F MCULE-4420509139 [0,1,0,0,0,1|0,0,2]=4 5419 B8R1.5 O[C@H]1CNCC[C@H]1F MCULE-1178411420 [0,1,0,0,0,1|0,0,2]=4 5420 B8R1.5 O[C@H]1CNCC[C@H]1F MCULE-1550810398 [0,1,0,0,0,1|0,0,2]=4 5421 B8R1.5 O[C@H]1CNCC[C@H]1F MCULE-9461941348 [0,1,0,0,0,1|0,0,2]=4 5422 B8R1.5 O[C@H]1CNCC[C@H]1F MCULE-9787124381 [0,1,0,0,0,1|0,0,2]=4 5423 B8R1.5 O[C@H]1CNCC[C@H]1O MCULE-2884977174 [0,1,0,0,0,1|0,0,2]=4 5424 B8R1.5 O[C@H]1CNCC[C@H]1O MCULE-4059971580 [0,1,0,0,0,1|0,0,2]=4 5425 B8R1.5 O[C@H]1CNCC[C@H]1O MCULE-4860264041 [0,1,0,0,0,1|0,0,2]=4 5426 B8R1.5 O[C@H]1CNCC[C@H]1O MCULE-5794552949 [0,1,0,0,0,1|0,0,2]=4 5427 B8R1.5 [C@@H]1(CCNC[C@@H]1F)O MCULE-4552431818 [0,1,0,0,0,1|0,0,2]=4 5428 B8R1.5 [C@@H]1(CCNC[C@@H]1F)O MCULE-6293331305 [0,1,0,0,0,1|0,0,2]=4 5429 B8R1.5 [C@@H]1(CCNC[C@H]1F)F MCULE-3406818126 [0,1,0,0,0,1|1,0,1]=4 5430 B8R1.5 [C@@H]1(CCNC[C@H]1F)F MCULE-4647745585 [0,1,0,0,0,1|1,0,1]=4 5431 B8R1.5 [C@@H]1(CCNC[C@H]1F)F MCULE-8430119550 [0,1,0,0,0,1|1,0,1]=4 5432 B8R1.5 [C@@H]1(CCNC[C@H]1F)F MCULE-9944740207 [0,1,0,0,0,1|1,0,1]=4 5433 B8R1.5 [C@@H]1(CCNC[C@H]1F)O MCULE-2598494094 [0,1,0,0,0,1|0,0,2]=4 5434 B8R1.5 [C@@H]1(CCNC[C@H]1F)O MCULE-9897987946 [0,1,0,0,0,1|0,0,2]=4 5435 B8R1.5 [C@@H]1(CCNC[C@H]1O)C MCULE-2307148539 [0,1,0,0,0,1|0,0,2]=4 5436 B8R1.5 [C@@H]1(CCNC[C@H]1O)C MCULE-7550947729 [0,1,0,0,0,1|0,0,2]=4 5437 B8R1.5 [C@@H]1(CCOC[C@@H]1O)N MCULE-2201413833 [0,1,0,0,0,1|0,0,2]=4 5438 B8R1.5 [C@@H]1(CCOC[C@H]1N)O MCULE-7745052941 [0,1,0,0,0,1|0,0,2]=4 5439 B8R1.5 [C@@H]1(CNCC[C@@H]1F)O MCULE-6806325155 [0,1,0,0,0,1|0,0,2]=4 5440 B8R1.5 [C@@H]1(CNCC[C@@H]1F)O MCULE-8351727587 [0,1,0,0,0,1|0,0,2]=4 5441 B8R1.5 [C@@H]1(CNCC[C@@H]1F)O MCULE-9141886243 [0,1,0,0,0,1|0,0,2]=4 5442 B8R1.5 [C@@H]1(CNCC[C@H]1O)O MCULE-7522153539 [0,1,0,0,0,1|0,0,2]=4 5443 B8R1.5 [C@@H]1(CNCC[C@H]1O)O MCULE-8922491067 [0,1,0,0,0,1|0,0,2]=4 5444 B8R1.5 [C@@H]1(COCC[C@@H]1O)N MCULE-2864950342 [0,1,0,0,0,1|0,0,2]=4 5445 B8R1.5 [C@H]1(CCCC[C@H]1F)O MCULE-7751753244 [0,1,0,0,0,1|0,0,2]=4 5446 B8R1.5 [C@H]1(CCNC[C@H]1F)F MCULE-1090696163 [0,1,0,0,0,1|1,0,1]=4 5447 B8R1.5 [C@H]1(CCNC[C@H]1F)F MCULE-4240939724 [0,1,0,0,0,1|1,0,1]=4 5448 B8R1.5 [C@H]1(CCNC[C@H]1F)F MCULE-5876100632 [0,1,0,0,0,1|1,0,1]=4 5449 B8R1.5 [C@H]1(CCNC[C@H]1F)F MCULE-8358389020 [0,1,0,0,0,1|1,0,1]=4 5450 B8R1.5 [C@H]1(CCNC[C@H]1O)O MCULE-2825513554 [0,1,0,0,0,1|0,0,2]=4 5451 B8R1.5 [C@H]1(CCNC[C@H]1O)O MCULE-3902017522 [0,1,0,0,0,1|0,0,2]=4 5452 B8R1.5 [C@H]1(CCOC[C@@H]1O)N MCULE-3291339796 [0,1,0,0,0,1|0,0,2]=4 5453 B8R1.5 [C@H]1(CCOC[C@@H]1O)N MCULE-5641035715 [0,1,0,0,0,1|0,0,2]=4 5454 B8R1.5 [C@H]1(CNCC[C@H]1C)F MCULE-5914413594 [0,1,0,0,0,1|1,0,1]=4 5455 B8R1.5 [C@H]1(CNCC[C@H]1C)F MCULE-6184399583 [0,1,0,0,0,1|1,0,1]=4 5456 B8R1.5 [C@H]1(CNCC[C@H]1C)O MCULE-8053222550 [0,1,0,0,0,1|0,0,2]=4 5457 B8R1.5 [C@H]1(CNCC[C@H]1C)O MCULE-9640568177 [0,1,0,0,0,1|0,0,2]=4 5458 B8R1.5 [C@H]1(CNCC[C@H]1O)C MCULE-1419969909 [0,1,0,0,0,1|0,0,2]=4 5459 B8R1.5 [C@H]1(CNCC[C@H]1O)C MCULE-1584116117 [0,1,0,0,0,1|0,0,2]=4 5460 B8R1.5 [C@H]1(CNCC[C@H]1O)C MCULE-2275992252 [0,1,0,0,0,1|0,0,2]=4 5461 B8R1.5 [C@H]1(CNCC[C@H]1O)C MCULE-4151833845 [0,1,0,0,0,1|0,0,2]=4 5462 B8R1.5 [C@H]1(COCC[C@H]1N)C MCULE-2786096186 [0,1,0,0,0,1|1,0,1]=4 5463 B8R1.5 [C@H]1(COCC[C@H]1N)C MCULE-3516272365 [0,1,0,0,0,1|1,0,1]=4 5464 B8R1.5 [C@H]1(COCC[C@H]1N)O MCULE-2088495989 [0,1,0,0,0,1|0,0,2]=4 5465 B8R1.5 [C@H]1(COCC[C@H]1O)N MCULE-5409068801 [0,1,0,0,0,1|0,0,2]=4 5466 B8R1.72 CC1(CCCCC1)Br MCULE-7638162883 [0,1,0,0,0,1|1,0,1]=4 5467 B8R1.72 CC1(CCCCC1)C MCULE-1034948429 [0,1,0,0,0,1|1,0,1]=4 5468 B8R1.72 CC1(CCCCC1)Cl MCULE-9694989677 [0,1,0,0,0,1|1,0,1]=4 5469 B8R1.72 CC1(CCCCC1)N MCULE-4578526281 [0,1,0,0,0,1|1,0,1]=4 5470 B8R1.72 CC1(CCCCC1)N MCULE-7255401200 [0,1,0,0,0,1|1,0,1]=4 5471 B8R1.72 CC1(CCCCC1)O MCULE-9091358177 [0,1,0,0,0,1|0,0,2]=4 5472 B8R1.72 CC1(CCCCN1)C MCULE-2685191354 [0,1,0,0,0,1|1,0,1]=4 5473 B8R1.72 CC1(CCCCN1)C MCULE-5186772635 [0,1,0,0,0,1|1,0,1]=4 5474 B8R1.72 CC1(CCCNC1)C MCULE-1520606122 [0,1,0,0,0,1|1,0,1]=4 5475 B8R1.72 CC1(CCCNC1)C MCULE-1566131847 [0,1,0,0,0,1|1,0,1]=4 5476 B8R1.72 CC1(CCCNC1)F MCULE-3330567861 [0,1,0,0,0,1|1,0,1]=4 5477 B8R1.72 CC1(CCCNC1)F MCULE-6560412441 [0,1,0,0,0,1|1,0,1]=4 5478 B8R1.72 CC1(CCCNC1)O MCULE-5451972522 [0,1,0,0,0,1|0,0,2]=4 5479 B8R1.72 CC1(CCCNC1)O MCULE-8102952158 [0,1,0,0,0,1|0,0,2]=4 5480 B8R1.72 CC1(CCCOC1)N MCULE-3473263481 [0,1,0,0,0,1|1,0,1]=4 5481 B8R1.72 CC1(CCCOC1)N MCULE-9650675850 [0,1,0,0,0,1|1,0,1]=4 5482 B8R1.72 CC1(CCNCC1)C MCULE-7337251134 [0,1,0,0,0,1|1,0,1]=4 5483 B8R1.72 CC1(CCNCC1)C MCULE-8963260224 [0,1,0,0,0,1|1,0,1]=4 5484 B8R1.72 CC1(CCNCC1)F MCULE-6260232530 [0,1,0,0,0,1|1,0,1]=4 5485 B8R1.72 CC1(CCNCC1)F MCULE-7921954485 [0,1,0,0,0,1|1,0,1]=4 5486 B8R1.72 CC1(CCNCC1)N MCULE-5607404765 [0,1,0,0,0,1|1,0,1]=4 5487 B8R1.72 CC1(CCNCC1)N MCULE-9218523511 [0,1,0,0,0,1|1,0,1]=4 5488 B8R1.72 CC1(CCNCC1)O MCULE-9361316232 [0,1,0,0,0,1|0,0,2]=4 5489 B8R1.72 CC1(CCNCC1)O MCULE-9693067330 [0,1,0,0,0,1|0,0,2]=4 5490 B8R1.72 CC1(CCOCC1)Br MCULE-5432776276 [0,1,0,0,0,1|1,0,1]=4 5491 B8R1.72 CC1(CCOCC1)N MCULE-3034294114 [0,1,0,0,0,1|1,0,1]=4 5492 B8R1.72 CC1(CCOCC1)N MCULE-3421238451 [0,1,0,0,0,1|1,0,1]=4 5493 B8R1.72 CC1(CCOCC1)O MCULE-8543825418 [0,1,0,0,0,1|0,0,2]=4 5494 B8R1.72 CC1(CCSCC1)O MCULE-2057155888 [0,1,0,0,0,1|0,0,2]=4 5495 B8R1.72 CP1(=O)CCNCC1 MCULE-2481700354 [0,1,0,0,0,1|1,0,0]=3 5496 B8R1.72 CP1(=O)CCNCC1 MCULE-7659597614 [0,1,0,0,0,1|1,0,0]=3 5497 B8R1.72 C[C@@]1(CCCNC1)O MCULE-4258412383 [0,1,0,0,0,1|0,0,2]=4 5498 B8R1.72 C[C@@]1(CCCNC1)O MCULE-4809428117 [0,1,0,0,0,1|0,0,2]=4 5499 B8R1.72 C[C@@]1(CCCNC1)O MCULE-5529196606 [0,1,0,0,0,1|0,0,2]=4 5500 B8R1.72 C[C@@]1(CCCOC1)N MCULE-6911571931 [0,1,0,0,0,1|1,0,1]=4 5501 B8R1.72 C[C@@]1(CCCOC1)N MCULE-7022092346 [0,1,0,0,0,1|1,0,1]=4 5502 B8R1.72 C[C@]1(CCCNC1)O MCULE-1848066803 [0,1,0,0,0,1|0,0,2]=4 5503 B8R1.72 C[C@]1(CCCNC1)O MCULE-4327624120 [0,1,0,0,0,1|0,0,2]=4 5504 B8R1.72 C[C@]1(CCCNC1)O MCULE-4586680651 [0,1,0,0,0,1|0,0,2]=4 5505 B8R1.72 C[C@]1(CCCNC1)O MCULE-5076504348 [0,1,0,0,0,1|0,0,2]=4 5506 B8R1.72 C[C@]1(CCCOC1)N MCULE-2192532317 [0,1,0,0,0,1|1,0,1]=4 5507 B8R1.72 C[C@]1(CCCOC1)N MCULE-9979909776 [0,1,0,0,0,1|1,0,1]=4 5508 B8R1.72 C[N+]1(CCCCC1)C MCULE-6801078398 [0,1,0,0,0,1|2,0,0]=4 5509 B8R1.72 C[N+]1(CCCCC1)C MCULE-8577219444 [0,1,0,0,0,1|2,0,0]=4 5510 B8R1.72 C[N+]1(CCCCC1)C MCULE-8985387079 [0,1,0,0,0,1|2,0,0]=4 5511 B8R1.72 C[N+]1(CCCCC1)[O-] MCULE-5049215438 [0,1,0,0,0,1|1,0,1]=4 5512 B8R1.72 C[N+]1(CCNCC1)C MCULE-4445155532 [0,1,0,0,0,1|2,0,0]=4 5513 B8R1.72 C[N+]1(CCNCC1)C MCULE-6305096635 [0,1,0,0,0,1|2,0,0]=4 5514 B8R1.72 C[N+]1(CCNCC1)C MCULE-9913162377 [0,1,0,0,0,1|2,0,0]=4 5515 B8R1.72 C[N+]1(CCNCC1)[O-] MCULE-1024843495 [0,1,0,0,0,1|1,0,1]=4 5516 B8R1.72 C[N+]1(CCNCC1)[O-] MCULE-2101970296 [0,1,0,0,0,1|1,0,1]=4 5517 B8R1.72 C[N+]1(CCOCC1)C MCULE-1342822828 [0,1,0,0,0,1|2,0,0]=4 5518 B8R1.72 C[N+]1(CCOCC1)C MCULE-1523317682 [0,1,0,0,0,1|2,0,0]=4 5519 B8R1.72 C[N+]1(CCOCC1)C MCULE-9524802069 [0,1,0,0,0,1|2,0,0]=4 5520 B8R1.72 C[N+]1(CCOCC1)[O-] MCULE-1003717708 [0,1,0,0,0,1|1,0,1]=4 5521 B8R1.72 C[Si]1(CCCCC1)C MCULE-1044445418 [0,1,0,0,0,1|1,1,0]=4 5522 B8R1.72 C[Si]1(CCCCO1)C MCULE-8051030048 [0,1,0,0,0,1|1,1,0]=4 5523 B8R1.72 C[Si]1(CCNCC1)C MCULE-2532491736 [0,1,0,0,0,1|1,1,0]=4 5524 B8R1.72 C[Si]1(CCNCC1)C MCULE-9194930068 [0,1,0,0,0,1|1,1,0]=4 5525 B8R1.72 Cl[Si]1(CCCCC1)Cl MCULE-4169597389 [0,1,0,0,0,1|1,1,0]=4 5526 B8R1.72 FC1(CCCCC1)F MCULE-7225537600 [0,1,0,0,0,1|1,0,1]=4 5527 B8R1.72 FC1(CCCNC1)F MCULE-3683809779 [0,1,0,0,0,1|1,0,1]=4 5528 B8R1.72 FC1(CCCNC1)F MCULE-6449175878 [0,1,0,0,0,1|1,0,1]=4 5529 B8R1.72 FC1(CCNCC1)F MCULE-7262028772 [0,1,0,0,0,1|1,0,1]=4 5530 B8R1.72 FC1(CC[NH2+]CC1)F MCULE-7465822620 [0,1,0,0,0,1|1,0,1]=4 5531 B8R1.72 N=S1(=O)CCCCC1 MCULE-8920208485 [0,1,0,0,0,1|1,0,0]=3 5532 B8R1.72 N=S1(=O)CCNCC1 MCULE-1687258331 [0,1,0,0,0,1|1,0,0]=3 5533 B8R1.72 N=S1(=O)CCNCC1 MCULE-5609385682 [0,1,0,0,0,1|1,0,0]=3 5534 B8R1.72 N=S1(=O)CCOCC1 MCULE-6078283647 [0,1,0,0,0,1|1,0,0]=3 5535 B8R1.72 O=S1(=O)C=CCCC1 MCULE-1954116946 [0,1,0,0,0,1|1,0,1]=4 5536 B8R1.72 O=S1(=O)CCCCN1 MCULE-6296400181 [0,1,0,0,0,1|1,0,0]=3 5537 B8R1.72 O=S1(=O)CCCCO1 MCULE-8722166220 [0,1,0,0,0,1|1,0,0]=3 5538 B8R1.72 O=S1(=O)CCNCC1 MCULE-5588926347 [0,1,0,0,0,1|1,0,0]=3 5539 B8R1.72 O=S1(=O)CCNCC1 MCULE-9457378592 [0,1,0,0,0,1|1,0,0]=3 5540 B8R1.72 O=S1(=O)CCNCN1 MCULE-8434732517 [0,1,0,0,0,1|2,0,0]=4 5541 B8R1.72 O=S1(=O)CCOCC1 MCULE-6954282764 [0,1,0,0,0,1|1,0,0]=3 5542 B8R1.72 O=S1(=O)CCOCN1 MCULE-2240726798 [0,1,0,0,0,1|2,0,0]=4 5543 B8R1.72 O=S1(=O)COCCN1 MCULE-7383759320 [0,1,0,0,0,1|2,0,0]=4 5544 B8R1.72 O=S1(=O)NCCCN1 MCULE-7962279459 [0,1,0,0,0,1|2,0,0]=4 5545 B8R1.72 O=S1(=O)OCCCO1 MCULE-8391650877 [0,1,0,0,0,1|2,0,0]=4 5546 B8R1.72 OC1(CCNCC1)O MCULE-8628233615 [0,1,0,0,0,1|0,0,2]=4 5547 B8R1.72 OC1(CCNCC1)O MCULE-9932298071 [0,1,0,0,0,1|0,0,2]=4 5548 B8R1.1 C#CC1COC(=O)N1 MCULE-7019791209 [0,2,0,0,0,0|2,0,0]=4 5549 B8R1.1 C#C[C@@H]1COC(=O)N1 MCULE-3103635703 [0,2,0,0,0,0|2,0,0]=4 5550 B8R1.1 C#C[C@@H]1COC(=O)N1 MCULE-7796064143 [0,2,0,0,0,0|2,0,0]=4 5551 B8R1.1 C#C[C@H]1COC(=O)N1 MCULE-4375742729 [0,2,0,0,0,0|2,0,0]=4 5552 B8R1.1 C#C[C@H]1COC(=O)N1 MCULE-5542662617 [0,2,0,0,0,0|2,0,0]=4 5553 B8R1.1 C1(CCC(=O)N1)CBr MCULE-4451864575 [0,2,0,0,0,0|1,0,0]=3 5554 B8R1.1 C1(CCC(=O)N1)CN MCULE-3169700074 [0,2,0,0,0,0|1,0,0]=3 5555 B8R1.1 C1(CCC(=O)N1)CO MCULE-8513534447 [0,2,0,0,0,0|1,0,0]=3 5556 B8R1.1 C1(CCN(C1)C)CN MCULE-1228423029 [0,2,0,0,0,0|2,0,0]=4 5557 B8R1.1 C1(CCN(C1)C)CO MCULE-8028593286 [0,2,0,0,0,0|2,0,0]=4 5558 B8R1.1 C1(CCN(C1)C)NC MCULE-6695451960 [0,2,0,0,0,0|2,0,0]=4 5559 B8R1.1 C1(CCN(C1)CC)N MCULE-1660628363 [0,2,0,0,0,0|2,0,0]=4 5560 B8R1.1 C1(CCN(C1)CC)N MCULE-4362704213 [0,2,0,0,0,0|2,0,0]=4 5561 B8R1.1 C1(CNC(=O)C1)CN MCULE-6663370335 [0,2,0,0,0,0|1,0,0]=3 5562 B8R1.1 C1(CNC(=O)C1)CN MCULE-8237162259 [0,2,0,0,0,0|1,0,0]=3 5563 B8R1.1 C1(CNC(=O)O1)CO MCULE-2451079587 [0,2,0,0,0,0|2,0,0]=4 5564 B8R1.1 C=C1CN[C@@H](C1)CO MCULE-2356105510 [0,2,0,0,0,0|2,0,0]=4 5565 B8R1.1 C=C1CN[C@@H](C1)CO MCULE-8856338816 [0,2,0,0,0,0|2,0,0]=4 5566 B8R1.1 C=CC1CCC(=O)N1 MCULE-7994900822 [0,2,0,0,0,0|1,0,0]=3 5567 B8R1.1 C=CC1COC(=O)C1 MCULE-5888906344 [0,2,0,0,0,0|1,0,0]=3 5568 B8R1.1 C=CC1COC(=O)C1 MCULE-8602073759 [0,2,0,0,0,0|1,0,0]=3 5569 B8R1.1 C=CC1COC(=O)O1 MCULE-3470962220 [0,2,0,0,0,0|2,0,0]=4 5570 B8R1.1 C=C[C@@H]1COC(=O)C1 MCULE-1274088394 [0,2,0,0,0,0|1,0,0]=3 5571 B8R1.1 C=C[C@@H]1COC(=O)C1 MCULE-3162707973 [0,2,0,0,0,0|1,0,0]=3 5572 B8R1.1 C=C[C@@H]1COC(=O)N1 MCULE-1532767336 [0,2,0,0,0,0|2,0,0]=4 5573 B8R1.1 C=C[C@@H]1COC(=O)N1 MCULE-3932839401 [0,2,0,0,0,0|2,0,0]=4 5574 B8R1.1 C=C[C@H]1COC(=O)N1 MCULE-3492854139 [0,2,0,0,0,0|2,0,0]=4 5575 B8R1.1 C=C[C@H]1COC(=O)N1 MCULE-9796474747 [0,2,0,0,0,0|2,0,0]=4 5576 B8R1.1 CC1CCC(C1)C#N MCULE-2178859708 [0,2,0,0,0,0|1,0,1]=4 5577 B8R1.1 CC1CCC(C1)C=O MCULE-9381232427 [0,2,0,0,0,0|0,0,1]=3 5578 B8R1.1 CC1CCC(C1)CN MCULE-9731521461 [0,2,0,0,0,0|1,0,1]=4 5579 B8R1.1 CC1CCC(C1)CO MCULE-3130047677 [0,2,0,0,0,0|0,0,2]=4 5580 B8R1.1 CCC1=CC(=O)CC1 MCULE-6681801286 [0,2,0,0,0,0|0,0,2]=4 5581 B8R1.1 CCC1CC(=O)CO1 MCULE-7105024194 [0,2,0,0,0,0|1,0,0]=3 5582 B8R1.1 CCC1CCC(=O)C1 MCULE-8455504217 [0,2,0,0,0,0|0,0,0]=2 5583 B8R1.1 CCC1CCC(=O)N1 MCULE-6150249637 [0,2,0,0,0,0|1,0,0]=3 5584 B8R1.1 CCC1CCC(=O)O1 MCULE-5161861312 [0,2,0,0,0,0|1,0,0]=3 5585 B8R1.1 CCC1CNC(=O)C1 MCULE-1800672545 [0,2,0,0,0,0|1,0,0]=3 5586 B8R1.1 CCC1CNC(=O)O1 MCULE-9388725409 [0,2,0,0,0,0|2,0,0]=4 5587 B8R1.1 CCC1COC(=O)C1 MCULE-1996435734 [0,2,0,0,0,0|1,0,0]=3 5588 B8R1.1 CCC1COC(=O)N1 MCULE-4345668230 [0,2,0,0,0,0|2,0,0]=4 5589 B8R1.1 CCC1COC(=O)O1 MCULE-5743084846 [0,2,0,0,0,0|2,0,0]=4 5590 B8R1.1 CCN1CCC(=O)C1 MCULE-5806094458 [0,2,0,0,0,0|1,0,0]=3 5591 B8R1.1 CCN1CCC(C1)Cl MCULE-3754861466 [0,2,0,0,0,0|2,0,0]=4 5592 B8R1.1 CCN1CCC(C1)N MCULE-4061638126 [0,2,0,0,0,0|2,0,0]=4 5593 B8R1.1 CCN1CCC(C1)N MCULE-6209041020 [0,2,0,0,0,0|2,0,0]=4 5594 B8R1.1 CCN1CCC(C1)O MCULE-5692205926 [0,2,0,0,0,0|2,0,0]=4 5595 B8R1.1 CCN1CC[C@@H](C1)N MCULE-1272657040 [0,2,0,0,0,0|2,0,0]=4 5596 B8R1.1 CCN1CC[C@@H](C1)N MCULE-2076213751 [0,2,0,0,0,0|2,0,0]=4 5597 B8R1.1 CCN1CC[C@@H](C1)N MCULE-3909985708 [0,2,0,0,0,0|2,0,0]=4 5598 B8R1.1 CCN1CC[C@@H](C1)N MCULE-3962927462 [0,2,0,0,0,0|2,0,0]=4 5599 B8R1.1 CCN1CC[C@H](C1)N MCULE-2016194886 [0,2,0,0,0,0|2,0,0]=4 5600 B8R1.1 CCN1CC[C@H](C1)N MCULE-2026494181 [0,2,0,0,0,0|2,0,0]=4 5601 B8R1.1 CCN1CC[C@H](C1)N MCULE-7234991861 [0,2,0,0,0,0|2,0,0]=4 5602 B8R1.1 CCN1CC[C@H](C1)N MCULE-7446688547 [0,2,0,0,0,0|2,0,0]=4 5603 B8R1.1 CC[C@@H]1CCC(=O)C1 MCULE-7687801028 [0,2,0,0,0,0|0,0,0]=2 5604 B8R1.1 CC[C@@H]1CCC(=O)O1 MCULE-9831904901 [0,2,0,0,0,0|1,0,0]=3 5605 B8R1.1 CC[C@H]1CCC(=O)C1 MCULE-6479003670 [0,2,0,0,0,0|0,0,0]=2 5606 B8R1.1 CC[C@H]1COC(=O)N1 MCULE-2443615902 [0,2,0,0,0,0|2,0,0]=4 5607 B8R1.1 CC[C@H]1COC(=O)N1 MCULE-9191549724 [0,2,0,0,0,0|2,0,0]=4 5608 B8R1.1 CN1CCC(C1)C#N MCULE-6246708360 [0,2,0,0,0,0|2,0,0]=4 5609 B8R1.1 CN1CCC(C1)CBr MCULE-3254744278 [0,2,0,0,0,0|2,0,0]=4 5610 B8R1.1 CN1CCC(C1)CBr MCULE-7875661007 [0,2,0,0,0,0|2,0,0]=4 5611 B8R1.1 CN1CCC(C1)CCl MCULE-1838271760 [0,2,0,0,0,0|2,0,0]=4 5612 B8R1.1 CN1CCC(C1)CCl MCULE-7017741490 [0,2,0,0,0,0|2,0,0]=4 5613 B8R1.1 CN1CCC(C1)CI MCULE-5901809049 [0,2,0,0,0,0|2,0,0]=4 5614 B8R1.1 CN1CCC(C1)CN MCULE-1055157717 [0,2,0,0,0,0|2,0,0]=4 5615 B8R1.1 CN1CCC(C1)CN MCULE-4961802986 [0,2,0,0,0,0|2,0,0]=4 5616 B8R1.1 CN1CCC(C1)CN MCULE-7134331201 [0,2,0,0,0,0|2,0,0]=4 5617 B8R1.1 CN1CCC(C1)CO MCULE-8101582241 [0,2,0,0,0,0|2,0,0]=4 5618 B8R1.1 CN1CC[C@@H](C1)CN MCULE-4682250431 [0,2,0,0,0,0|2,0,0]=4 5619 B8R1.1 CN1CC[C@@H](C1)CN MCULE-7978590046 [0,2,0,0,0,0|2,0,0]=4 5620 B8R1.1 CN1CC[C@@H](C1)CN MCULE-9059685471 [0,2,0,0,0,0|2,0,0]=4 5621 B8R1.1 CN1CC[C@@H](C1)CO MCULE-3904654758 [0,2,0,0,0,0|2,0,0]=4 5622 B8R1.1 CN1CC[C@@H](C1)CO MCULE-5091184467 [0,2,0,0,0,0|2,0,0]=4 5623 B8R1.1 CN1CC[C@H](C1)CN MCULE-1864968995 [0,2,0,0,0,0|2,0,0]=4 5624 B8R1.1 CN1CC[C@H](C1)CN MCULE-3495270300 [0,2,0,0,0,0|2,0,0]=4 5625 B8R1.1 CN1CC[C@H](C1)CN MCULE-6029010150 [0,2,0,0,0,0|2,0,0]=4 5626 B8R1.1 CN1CC[C@H](C1)CN MCULE-7061479346 [0,2,0,0,0,0|2,0,0]=4 5627 B8R1.1 CN1CC[C@H](C1)CO MCULE-7548866217 [0,2,0,0,0,0|2,0,0]=4 5628 B8R1.1 CN1CC[C@H](C1)CO MCULE-9206143876 [0,2,0,0,0,0|2,0,0]=4 5629 B8R1.1 CNC1CCC(C1)C MCULE-2606421374 [0,2,0,0,0,0|1,0,1]=4 5630 B8R1.1 CNC1CCC(C1)O MCULE-1177292585 [0,2,0,0,0,0|0,0,2]=4 5631 B8R1.1 CNC1CCC(C1)O MCULE-5259471149 [0,2,0,0,0,0|0,0,2]=4 5632 B8R1.1 CNC1CCN(C1)C MCULE-6508268802 [0,2,0,0,0,0|2,0,0]=4 5633 B8R1.1 CNC1CCN(C1)C MCULE-8530285406 [0,2,0,0,0,0|2,0,0]=4 5634 B8R1.1 CNC1CNC(=O)C1 MCULE-1673491824 [0,2,0,0,0,0|1,0,0]=3 5635 B8R1.1 CN[C@@H]1CCN(C1)C MCULE-4467826567 [0,2,0,0,0,0|2,0,0]=4 5636 B8R1.1 CN[C@@H]1CCN(C1)C MCULE-6754872836 [0,2,0,0,0,0|2,0,0]=4 5637 B8R1.1 CN[C@@H]1CCN(C1)C MCULE-8022505695 [0,2,0,0,0,0|2,0,0]=4 5638 B8R1.1 CN[C@@H]1CC[C@@H](C1)O MCULE-3921744037 [0,2,0,0,0,0|0,0,2]=4 5639 B8R1.1 CN[C@H]1CCN(C1)C MCULE-3244360831 [0,2,0,0,0,0|2,0,0]=4 5640 B8R1.1 CN[C@H]1CCN(C1)C MCULE-9444911110 [0,2,0,0,0,0|2,0,0]=4 5641 B8R1.1 CN[C@H]1CCN(C1)C MCULE-9663015668 [0,2,0,0,0,0|2,0,0]=4 5642 B8R1.1 CN[C@H]1CNC(=O)C1 MCULE-7859463391 [0,2,0,0,0,0|1,0,0]=3 5643 B8R1.1 COC1=CC(=O)CC1 MCULE-7963656232 [0,2,0,0,0,0|0,0,2]=4 5644 B8R1.1 COC1C=CC(=O)C1 MCULE-3904672515 [0,2,0,0,0,0|0,0,2]=4 5645 B8R1.1 COC1CCC(=O)C1 MCULE-3259977239 [0,2,0,0,0,0|0,0,0]=2 5646 B8R1.1 COC1CCC(=O)N1 MCULE-9661875090 [0,2,0,0,0,0|1,0,0]=3 5647 B8R1.1 COC1CCC(C1)Br MCULE-2042021360 [0,2,0,0,0,0|0,0,2]=4 5648 B8R1.1 COC1CCC(C1)N MCULE-4717179971 [0,2,0,0,0,0|0,0,2]=4 5649 B8R1.1 COC1CCC(C1)N MCULE-6288105544 [0,2,0,0,0,0|0,0,2]=4 5650 B8R1.1 COC1CCC(C1)O MCULE-3531007988 [0,2,0,0,0,0|0,0,2]=4 5651 B8R1.1 COC1CCN(C1)N MCULE-3497385185 [0,2,0,0,0,0|2,0,0]=4 5652 B8R1.1 COC1CNC(=O)C1 MCULE-2023546447 [0,2,0,0,0,0|1,0,0]=3 5653 B8R1.1 CO[C@@H]1CC[C@@H](C1)N MCULE-2875608408 [0,2,0,0,0,0|0,0,2]=4 5654 B8R1.1 CO[C@@H]1CC[C@@H](C1)N MCULE-8416754512 [0,2,0,0,0,0|0,0,2]=4 5655 B8R1.1 CO[C@@H]1CC[C@@H](C1)O MCULE-5232016028 [0,2,0,0,0,0|0,0,2]=4 5656 B8R1.1 CO[C@@H]1CC[C@H](C1)N MCULE-1888407079 [0,2,0,0,0,0|0,0,2]=4 5657 B8R1.1 CO[C@@H]1CC[C@H](C1)N MCULE-2445501949 [0,2,0,0,0,0|0,0,2]=4 5658 B8R1.1 CO[C@@H]1CC[C@H](C1)N MCULE-6019984409 [0,2,0,0,0,0|0,0,2]=4 5659 B8R1.1 CO[C@@H]1CC[C@H](C1)N MCULE-6778321044 [0,2,0,0,0,0|0,0,2]=4 5660 B8R1.1 CO[C@H]1CCN(C1)C MCULE-3202078388 [0,2,0,0,0,0|2,0,0]=4 5661 B8R1.1 CO[C@H]1CC[C@@H](C1)N MCULE-1126971030 [0,2,0,0,0,0|0,0,2]=4 5662 B8R1.1 CO[C@H]1CC[C@@H](C1)N MCULE-2897044722 [0,2,0,0,0,0|0,0,2]=4 5663 B8R1.1 CO[C@H]1CC[C@@H](C1)N MCULE-5627949204 [0,2,0,0,0,0|0,0,2]=4 5664 B8R1.1 CO[C@H]1CC[C@@H](C1)N MCULE-8060845967 [0,2,0,0,0,0|0,0,2]=4 5665 B8R1.1 CO[C@H]1CC[C@H](C1)N MCULE-1601734575 [0,2,0,0,0,0|0,0,2]=4 5666 B8R1.1 CO[C@H]1CC[C@H](C1)N MCULE-1920912186 [0,2,0,0,0,0|0,0,2]=4 5667 B8R1.1 CO[C@H]1CC[C@H](C1)N MCULE-3006479304 [0,2,0,0,0,0|0,0,2]=4 5668 B8R1.1 CO[C@H]1CC[C@H](C1)N MCULE-4560375617 [0,2,0,0,0,0|0,0,2]=4 5669 B8R1.1 CSC1CCC(C1)N MCULE-5954197639 [0,2,0,0,0,0|0,1,1]=4 5670 B8R1.1 N#CC1CCC(=O)C1 MCULE-3783981366 [0,2,0,0,0,0|0,0,0]=2 5671 B8R1.1 N#CC1CCC(C1)Br MCULE-5877362752 [0,2,0,0,0,0|1,0,1]=4 5672 B8R1.1 N#CC1CCC(C1)F MCULE-3350790149 [0,2,0,0,0,0|1,0,1]=4 5673 B8R1.1 N#CC1CCC(C1)N MCULE-2198709005 [0,2,0,0,0,0|1,0,1]=4 5674 B8R1.1 N#CC1CCC(C1)N MCULE-6609758385 [0,2,0,0,0,0|1,0,1]=4 5675 B8R1.1 N#CC1CCC(C1)O MCULE-5905406850 [0,2,0,0,0,0|0,0,2]=4 5676 B8R1.1 N#CC1CNC(=O)C1 MCULE-7040868747 [0,2,0,0,0,0|1,0,0]=3 5677 B8R1.1 N#CC1COC(=O)O1 MCULE-7635108167 [0,2,0,0,0,0|2,0,0]=4 5678 B8R1.1 N#C[C@@H]1CCC(=O)C1 MCULE-1506687355 [0,2,0,0,0,0|0,0,0]=2 5679 B8R1.1 N#C[C@@H]1CC[C@@H](C1)O MCULE-8121411873 [0,2,0,0,0,0|0,0,2]=4 5680 B8R1.1 N#C[C@@H]1CC[C@H](C1)N MCULE-6680858493 [0,2,0,0,0,0|1,0,1]=4 5681 B8R1.1 N#C[C@@H]1CC[C@H](C1)N MCULE-8030285913 [0,2,0,0,0,0|1,0,1]=4 5682 B8R1.1 N#C[C@@H]1CC[C@H](C1)O MCULE-3581437653 [0,2,0,0,0,0|0,0,2]=4 5683 B8R1.1 N#C[C@@H]1CC[C@H](C1)O MCULE-5514135227 [0,2,0,0,0,0|0,0,2]=4 5684 B8R1.1 N#C[C@H]1CCC(=O)C1 MCULE-3791390646 [0,2,0,0,0,0|0,0,0]=2 5685 B8R1.1 N#C[C@H]1CC[C@H](C1)N MCULE-4757515162 [0,2,0,0,0,0|1,0,1]=4 5686 B8R1.1 N#C[C@H]1CC[C@H](C1)N MCULE-5696064799 [0,2,0,0,0,0|1,0,1]=4 5687 B8R1.1 N#C[C@H]1CC[C@H](C1)O MCULE-5018154932 [0,2,0,0,0,0|0,0,2]=4 5688 B8R1.1 N#C[C@H]1CC[C@H](C1)O MCULE-9804475995 [0,2,0,0,0,0|0,0,2]=4 5689 B8R1.1 NCC1CCC(=O)N1 MCULE-2195138544 [0,2,0,0,0,0|1,0,0]=3 5690 B8R1.1 NCC1CCC(=O)N1 MCULE-5064964559 [0,2,0,0,0,0|1,0,0]=3 5691 B8R1.1 NCC1CCC(=O)N1 MCULE-9686422256 [0,2,0,0,0,0|1,0,0]=3 5692 B8R1.1 NCC1CCC(=O)N1 MCULE-9973113927 [0,2,0,0,0,0|1,0,0]=3 5693 B8R1.1 NCC1CCC(=O)O1 MCULE-5413792723 [0,2,0,0,0,0|1,0,0]=3 5694 B8R1.1 NCC1CCC(=O)O1 MCULE-8312895206 [0,2,0,0,0,0|1,0,0]=3 5695 B8R1.1 NCC1CCC(C1)F MCULE-2506364284 [0,2,0,0,0,0|1,0,1]=4 5696 B8R1.1 NCC1CCC(C1)F MCULE-9762668275 [0,2,0,0,0,0|1,0,1]=4 5697 B8R1.1 NCC1CCC(C1)O MCULE-1780130995 [0,2,0,0,0,0|0,0,2]=4 5698 B8R1.1 NCC1CCC(C1)O MCULE-5002398342 [0,2,0,0,0,0|0,0,2]=4 5699 B8R1.1 NCC1CNC(=O)C1 MCULE-2522987651 [0,2,0,0,0,0|1,0,0]=3 5700 B8R1.1 NCC1CNC(=O)C1 MCULE-7249550892 [0,2,0,0,0,0|1,0,0]=3 5701 B8R1.1 NCC1CNC(=O)C1 MCULE-7253893960 [0,2,0,0,0,0|1,0,0]=3 5702 B8R1.1 NCC1CNC(=O)O1 MCULE-3940030823 [0,2,0,0,0,0|2,0,0]=4 5703 B8R1.1 NCC1CNC(=O)O1 MCULE-7671055394 [0,2,0,0,0,0|2,0,0]=4 5704 B8R1.1 NCC1COC(=O)N1 MCULE-8454292565 [0,2,0,0,0,0|2,0,0]=4 5705 B8R1.1 NCC1COC(=O)N1 MCULE-9068275563 [0,2,0,0,0,0|2,0,0]=4 5706 B8R1.1 NC[C@@H]1CCC(=O)N1 MCULE-5772277021 [0,2,0,0,0,0|1,0,0]=3 5707 B8R1.1 NC[C@@H]1CCC(=O)N1 MCULE-6147061481 [0,2,0,0,0,0|1,0,0]=3 5708 B8R1.1 NC[C@@H]1CCC(=O)N1 MCULE-7644508115 [0,2,0,0,0,0|1,0,0]=3 5709 B8R1.1 NC[C@@H]1CCC(=O)N1 MCULE-7782108755 [0,2,0,0,0,0|1,0,0]=3 5710 B8R1.1 NC[C@@H]1CC[C@@H](C1)O MCULE-2662561877 [0,2,0,0,0,0|0,0,2]=4 5711 B8R1.1 NC[C@@H]1CC[C@H](C1)F MCULE-1669600965 [0,2,0,0,0,0|1,0,1]=4 5712 B8R1.1 NC[C@@H]1CC[C@H](C1)F MCULE-5430633197 [0,2,0,0,0,0|1,0,1]=4 5713 B8R1.1 NC[C@@H]1CC[C@H](C1)O MCULE-9258933196 [0,2,0,0,0,0|0,0,2]=4 5714 B8R1.1 NC[C@@H]1CNC(=O)C1 MCULE-1184474214 [0,2,0,0,0,0|1,0,0]=3 5715 B8R1.1 NC[C@@H]1CNC(=O)C1 MCULE-2421452869 [0,2,0,0,0,0|1,0,0]=3 5716 B8R1.1 NC[C@@H]1CNC(=O)C1 MCULE-3903743084 [0,2,0,0,0,0|1,0,0]=3 5717 B8R1.1 NC[C@@H]1CNC(=O)C1 MCULE-9080425518 [0,2,0,0,0,0|1,0,0]=3 5718 B8R1.1 NC[C@@H]1CNC(=O)O1 MCULE-1463241001 [0,2,0,0,0,0|2,0,0]=4 5719 B8R1.1 NC[C@@H]1CNC(=O)O1 MCULE-3217887113 [0,2,0,0,0,0|2,0,0]=4 5720 B8R1.1 NC[C@@H]1CNC(=O)O1 MCULE-5423398321 [0,2,0,0,0,0|2,0,0]=4 5721 B8R1.1 NC[C@@H]1CNC(=O)O1 MCULE-9322185538 [0,2,0,0,0,0|2,0,0]=4 5722 B8R1.1 NC[C@H]1CCC(=O)N1 MCULE-1485902199 [0,2,0,0,0,0|1,0,0]=3 5723 B8R1.1 NC[C@H]1CCC(=O)N1 MCULE-1751255260 [0,2,0,0,0,0|1,0,0]=3 5724 B8R1.1 NC[C@H]1CCC(=O)N1 MCULE-3641870628 [0,2,0,0,0,0|1,0,0]=3 5725 B8R1.1 NC[C@H]1CCC(=O)N1 MCULE-9839264859 [0,2,0,0,0,0|1,0,0]=3 5726 B8R1.1 NC[C@H]1CC[C@@H](C1)O MCULE-1995293557 [0,2,0,0,0,0|0,0,2]=4 5727 B8R1.1 NC[C@H]1CC[C@@H](C1)O MCULE-9517253792 [0,2,0,0,0,0|0,0,2]=4 5728 B8R1.1 NC[C@H]1CC[C@H](C1)O MCULE-5659749587 [0,2,0,0,0,0|0,0,2]=4 5729 B8R1.1 NC[C@H]1CC[C@H](C1)O MCULE-9056303043 [0,2,0,0,0,0|0,0,2]=4 5730 B8R1.1 NC[C@H]1CNC(=O)C1 MCULE-7212975165 [0,2,0,0,0,0|1,0,0]=3 5731 B8R1.1 NC[C@H]1CNC(=O)C1 MCULE-8203034485 [0,2,0,0,0,0|1,0,0]=3 5732 B8R1.1 NC[C@H]1CNC(=O)C1 MCULE-8803246698 [0,2,0,0,0,0|1,0,0]=3 5733 B8R1.1 NC[C@H]1CNC(=O)C1 MCULE-9580224880 [0,2,0,0,0,0|1,0,0]=3 5734 B8R1.1 NC[C@H]1CNC(=O)O1 MCULE-1224919034 [0,2,0,0,0,0|2,0,0]=4 5735 B8R1.1 NC[C@H]1CNC(=O)O1 MCULE-6003746665 [0,2,0,0,0,0|2,0,0]=4 5736 B8R1.1 NC[C@H]1CNC(=O)O1 MCULE-6937146715 [0,2,0,0,0,0|2,0,0]=4 5737 B8R1.1 NC[C@H]1CNC(=O)O1 MCULE-9419881517 [0,2,0,0,0,0|2,0,0]=4 5738 B8R1.1 NC[C@H]1COC(=O)N1 MCULE-1988909942 [0,2,0,0,0,0|2,0,0]=4 5739 B8R1.1 NC[C@H]1COC(=O)N1 MCULE-9340310155 [0,2,0,0,0,0|2,0,0]=4 5740 B8R1.1 O=C1CC(CN1)CBr MCULE-1780879209 [0,2,0,0,0,0|1,0,0]=3 5741 B8R1.1 O=C1CC(CN1)CO MCULE-8619053563 [0,2,0,0,0,0|1,0,0]=3 5742 B8R1.1 O=C1CC(CO1)CO MCULE-7403068263 [0,2,0,0,0,0|1,0,0]=3 5743 B8R1.1 O=C1CCC(C1)CF MCULE-9077358027 [0,2,0,0,0,0|0,0,0]=2 5744 B8R1.1 O=C1CCC(C1)CO MCULE-7524267942 [0,2,0,0,0,0|0,0,0]=2 5745 B8R1.1 O=C1CCC(N1)CBr MCULE-7024022934 [0,2,0,0,0,0|1,0,0]=3 5746 B8R1.1 O=C1CCC(N1)CI MCULE-6956070937 [0,2,0,0,0,0|1,0,0]=3 5747 B8R1.1 O=C1CCC(N1)CO MCULE-1498000761 [0,2,0,0,0,0|1,0,0]=3 5748 B8R1.1 O=C1CCC(O1)CBr MCULE-9370722806 [0,2,0,0,0,0|1,0,0]=3 5749 B8R1.1 O=C1CCC(O1)CCl MCULE-3199749385 [0,2,0,0,0,0|1,0,0]=3 5750 B8R1.1 O=C1CCC(O1)CI MCULE-4432096360 [0,2,0,0,0,0|1,0,0]=3 5751 B8R1.1 O=C1CCC(O1)CO MCULE-3178999726 [0,2,0,0,0,0|1,0,0]=3 5752 B8R1.1 O=C1CCC(O1)CO MCULE-4390773734 [0,2,0,0,0,0|1,0,0]=3 5753 B8R1.1 O=C1CC[C@@H](C1)CO MCULE-2590805877 [0,2,0,0,0,0|0,0,0]=2 5754 B8R1.1 O=C1CC[C@@H](C1)CO MCULE-7134607780 [0,2,0,0,0,0|0,0,0]=2 5755 B8R1.1 O=C1CC[C@@H](N1)CBr MCULE-4537645558 [0,2,0,0,0,0|1,0,0]=3 5756 B8R1.1 O=C1CC[C@@H](N1)CBr MCULE-6830001458 [0,2,0,0,0,0|1,0,0]=3 5757 B8R1.1 O=C1CC[C@@H](N1)CO MCULE-3021506643 [0,2,0,0,0,0|1,0,0]=3 5758 B8R1.1 O=C1CC[C@@H](N1)CO MCULE-3659077476 [0,2,0,0,0,0|1,0,0]=3 5759 B8R1.1 O=C1CC[C@@H](O1)CO MCULE-1532290348 [0,2,0,0,0,0|1,0,0]=3 5760 B8R1.1 O=C1CC[C@@H](O1)CO MCULE-3600746831 [0,2,0,0,0,0|1,0,0]=3 5761 B8R1.1 O=C1CC[C@H](N1)CBr MCULE-1684731751 [0,2,0,0,0,0|1,0,0]=3 5762 B8R1.1 O=C1CC[C@H](N1)CBr MCULE-4479348379 [0,2,0,0,0,0|1,0,0]=3 5763 B8R1.1 O=C1CC[C@H](N1)CO MCULE-4532009930 [0,2,0,0,0,0|1,0,0]=3 5764 B8R1.1 O=C1CC[C@H](N1)CO MCULE-6466848372 [0,2,0,0,0,0|1,0,0]=3 5765 B8R1.1 O=C1CC[C@H](O1)CO MCULE-1675076625 [0,2,0,0,0,0|1,0,0]=3 5766 B8R1.1 O=C1CC[C@H](O1)CO MCULE-6265569115 [0,2,0,0,0,0|1,0,0]=3 5767 B8R1.1 O=C1C[C@@H](CN1)CO MCULE-5572559100 [0,2,0,0,0,0|1,0,0]=3 5768 B8R1.1 O=C1C[C@H](CN1)CO MCULE-4450345453 [0,2,0,0,0,0|1,0,0]=3 5769 B8R1.1 O=C1NC(CO1)CI MCULE-3725463438 [0,2,0,0,0,0|2,0,0]=4 5770 B8R1.1 O=C1NC(CO1)CI MCULE-8271591026 [0,2,0,0,0,0|2,0,0]=4 5771 B8R1.1 O=C1NC(CO1)CO MCULE-8296379772 [0,2,0,0,0,0|2,0,0]=4 5772 B8R1.1 O=C1NC(CO1)CO MCULE-9797812862 [0,2,0,0,0,0|2,0,0]=4 5773 B8R1.1 O=C1NCC(O1)CBr MCULE-3294572412 [0,2,0,0,0,0|2,0,0]=4 5774 B8R1.1 O=C1NCC(O1)CCl MCULE-6711754093 [0,2,0,0,0,0|2,0,0]=4 5775 B8R1.1 O=C1NCC(O1)CCl MCULE-6847066968 [0,2,0,0,0,0|2,0,0]=4 5776 B8R1.1 O=C1NCC(O1)CO MCULE-8225938772 [0,2,0,0,0,0|2,0,0]=4 5777 B8R1.1 O=C1NCC(S1)CBr MCULE-9963419555 [0,2,0,0,0,0|2,0,0]=4 5778 B8R1.1 O=C1NC[C@@H](O1)CCl MCULE-4606501061 [0,2,0,0,0,0|2,0,0]=4 5779 B8R1.1 O=C1NC[C@@H](O1)CO MCULE-4749906822 [0,2,0,0,0,0|2,0,0]=4 5780 B8R1.1 O=C1NC[C@@H](O1)CO MCULE-7879354917 [0,2,0,0,0,0|2,0,0]=4 5781 B8R1.1 O=C1NC[C@H](O1)CCl MCULE-1912687608 [0,2,0,0,0,0|2,0,0]=4 5782 B8R1.1 O=C1NC[C@H](O1)CO MCULE-2698871687 [0,2,0,0,0,0|2,0,0]=4 5783 B8R1.1 O=C1NC[C@H](O1)CO MCULE-5771560221 [0,2,0,0,0,0|2,0,0]=4 5784 B8R1.1 O=C1N[C@@H](CO1)CO MCULE-2270288938 [0,2,0,0,0,0|2,0,0]=4 5785 B8R1.1 O=C1N[C@@H](CO1)CO MCULE-5533745846 [0,2,0,0,0,0|2,0,0]=4 5786 B8R1.1 O=C1N[C@H](CO1)CI MCULE-5817468950 [0,2,0,0,0,0|2,0,0]=4 5787 B8R1.1 O=C1N[C@H](CO1)CI MCULE-6940377154 [0,2,0,0,0,0|2,0,0]=4 5788 B8R1.1 O=C1N[C@H](CO1)CO MCULE-3186572246 [0,2,0,0,0,0|2,0,0]=4 5789 B8R1.1 O=C1N[C@H](CO1)CO MCULE-4534112642 [0,2,0,0,0,0|2,0,0]=4 5790 B8R1.1 O=C1OCC(O1)CCl MCULE-7212643481 [0,2,0,0,0,0|2,0,0]=4 5791 B8R1.1 O=C1OCC(O1)CF MCULE-2066386250 [0,2,0,0,0,0|2,0,0]=4 5792 B8R1.1 O=C1OCC(O1)CO MCULE-1831262013 [0,2,0,0,0,0|2,0,0]=4 5793 B8R1.1 O=CC1COC(=O)C1 MCULE-7312168752 [0,2,0,0,0,0|1,0,0]=3 5794 B8R1.1 O=C[C@@H]1CC(CN1)F MCULE-5331901113 [0,2,0,0,0,0|1,0,1]=4 5795 B8R1.1 O=C[C@@H]1CC(CN1)F MCULE-6102557843 [0,2,0,0,0,0|1,0,1]=4 5796 B8R1.1 OCC1CCC(C1)F MCULE-4786923020 [0,2,0,0,0,0|0,0,2]=4 5797 B8R1.1 OCC1CCC(C1)O MCULE-5225292788 [0,2,0,0,0,0|0,0,2]=4 5798 B8R1.1 OC[C@@H]1CC[C@@H](C1)O MCULE-7117159358 [0,2,0,0,0,0|0,0,2]=4 5799 B8R1.1 OC[C@@H]1CC[C@H](C1)F MCULE-4252726732 [0,2,0,0,0,0|0,0,2]=4 5800 B8R1.1 OC[C@H]1CC[C@@H](C1)O MCULE-7760122854 [0,2,0,0,0,0|0,0,2]=4 5801 B8R1.1 OC[C@H]1CC[C@@H](C1)O MCULE-9132554470 [0,2,0,0,0,0|0,0,2]=4 5802 B8R1.1 [C@@H]1(COC(=O)C1)C=C MCULE-1356778810 [0,2,0,0,0,0|1,0,0]=3 5803 B8R1.1 [C@H]1(CC[C@H](C1)CN)F MCULE-4146565646 [0,2,0,0,0,0|1,0,1]=4 5804 B8R1.1 [C@H]1(CC[C@H](C1)CN)F MCULE-5300714166 [0,2,0,0,0,0|1,0,1]=4 5805 B8R1.1 [C@H]1(CNC(=O)O1)CCl MCULE-6032247892 [0,2,0,0,0,0|2,0,0]=4 5806 B8R1.7 C1(CCCN1)C(=O)N MCULE-2539007211 [0,2,0,0,0,0|1,0,1]=4 5807 B8R1.7 C1(CCCN1)C(=O)N MCULE-7289713183 [0,2,0,0,0,0|1,0,1]=4 5808 B8R1.7 C1(CCNC1)C(=O)N MCULE-4476688014 [0,2,0,0,0,0|1,0,1]=4 5809 B8R1.7 C1(CCNC1)C(=O)N MCULE-8592806332 [0,2,0,0,0,0|1,0,1]=4 5810 B8R1.7 C1(CCNC1)C(=O)O MCULE-3210241958 [0,2,0,0,0,0|1,0,1]=4 5811 B8R1.7 C1(CCNC1)C(=O)O MCULE-6517290754 [0,2,0,0,0,0|1,0,1]=4 5812 B8R1.7 C1(CCOC1)C(=O)O MCULE-4859263225 [0,2,0,0,0,0|1,0,1]=4 5813 B8R1.7 CC(=O)C1=CCCC1 MCULE-9623046872 [0,2,0,0,0,0|0,0,1]=3 5814 B8R1.7 CC(=O)C1=NCCS1 MCULE-8548990347 [0,2,0,0,0,0|2,0,0]=4 5815 B8R1.7 CC(=O)C1CCCC1 MCULE-7952211819 [0,2,0,0,0,0|0,0,1]=3 5816 B8R1.7 CC(=O)C1CCCN1 MCULE-2528977871 [0,2,0,0,0,0|1,0,1]=4 5817 B8R1.7 CC(=O)C1CCCN1 MCULE-9222880225 [0,2,0,0,0,0|1,0,1]=4 5818 B8R1.7 CC(=O)C1CCCO1 MCULE-7518147693 [0,2,0,0,0,0|1,0,1]=4 5819 B8R1.7 CC(=O)C1CCNC1 MCULE-2147779518 [0,2,0,0,0,0|1,0,1]=4 5820 B8R1.7 CC(=O)C1CCNC1 MCULE-2964372059 [0,2,0,0,0,0|1,0,1]=4 5821 B8R1.7 CC(=O)C1CCOC1 MCULE-2105633909 [0,2,0,0,0,0|1,0,1]=4 5822 B8R1.7 CC(=O)N1CCCC1 MCULE-6839528034 [0,2,0,0,0,0|1,0,0]=3 5823 B8R1.7 CC(=O)[C@@H]1CCCN1 MCULE-1290635339 [0,2,0,0,0,0|1,0,1]=4 5824 B8R1.7 CC(=O)[C@@H]1CCCN1 MCULE-2855198659 [0,2,0,0,0,0|1,0,1]=4 5825 B8R1.7 CC(=O)[C@@H]1CCCN1 MCULE-2944662012 [0,2,0,0,0,0|1,0,1]=4 5826 B8R1.7 CC(=O)[C@@H]1CCCN1 MCULE-4806473466 [0,2,0,0,0,0|1,0,1]=4 5827 B8R1.7 CC(=O)[C@@H]1CCCO1 MCULE-2015960170 [0,2,0,0,0,0|1,0,1]=4 5828 B8R1.7 CC(=O)[C@@H]1CCCO1 MCULE-3381319090 [0,2,0,0,0,0|1,0,1]=4 5829 B8R1.7 CC(=O)[C@H]1CCCN1 MCULE-2095368644 [0,2,0,0,0,0|1,0,1]=4 5830 B8R1.7 CC(=O)[C@H]1CCCN1 MCULE-5460066005 [0,2,0,0,0,0|1,0,1]=4 5831 B8R1.7 CC(=O)[C@H]1CCCO1 MCULE-5637204370 [0,2,0,0,0,0|1,0,1]=4 5832 B8R1.7 CC(Br)C1CCCC1 MCULE-9104958283 [0,2,0,0,0,0|1,0,1]=4 5833 B8R1.7 CC(C)C1CCCC1 MCULE-4905120936 [0,2,0,0,0,0|1,0,1]=4 5834 B8R1.7 CC(C)N1CCCC1 MCULE-6446387241 [0,2,0,0,0,0|2,0,0]=4 5835 B8R1.7 CC(N)C1CCCC1 MCULE-1576719851 [0,2,0,0,0,0|1,0,1]=4 5836 B8R1.7 CC(N)C1CCCC1 MCULE-9047229690 [0,2,0,0,0,0|1,0,1]=4 5837 B8R1.7 CC(O)C1CCCC1 MCULE-6730583511 [0,2,0,0,0,0|0,0,2]=4 5838 B8R1.7 CN(C)C1CCCC1 MCULE-2157359156 [0,2,0,0,0,0|1,0,1]=4 5839 B8R1.7 C[C@@H](N)C1CCCC1 MCULE-2532670333 [0,2,0,0,0,0|1,0,1]=4 5840 B8R1.7 C[C@@H](N)C1CCCC1 MCULE-7828853056 [0,2,0,0,0,0|1,0,1]=4 5841 B8R1.7 C[C@@H](N)C1CCCC1 MCULE-8150036197 [0,2,0,0,0,0|1,0,1]=4 5842 B8R1.7 C[C@@H](N)C1CCCC1 MCULE-8243361407 [0,2,0,0,0,0|1,0,1]=4 5843 B8R1.7 C[C@@H](O)C1CCCC1 MCULE-2530250478 [0,2,0,0,0,0|0,0,2]=4 5844 B8R1.7 C[C@H](N)C1CCCC1 MCULE-4224874512 [0,2,0,0,0,0|1,0,1]=4 5845 B8R1.7 C[C@H](N)C1CCCC1 MCULE-6435654240 [0,2,0,0,0,0|1,0,1]=4 5846 B8R1.7 C[C@H](N)C1CCCC1 MCULE-8124130642 [0,2,0,0,0,0|1,0,1]=4 5847 B8R1.7 C[C@H](N)C1CCCC1 MCULE-9554309821 [0,2,0,0,0,0|1,0,1]=4 5848 B8R1.7 C[C@H](O)C1CCCC1 MCULE-9054245488 [0,2,0,0,0,0|0,0,2]=4 5849 B8R1.7 N=C(N)C1CCCC1 MCULE-3526902612 [0,2,0,0,0,0|1,0,1]=4 5850 B8R1.7 N=C(N)C1CCCC1 MCULE-7613986881 [0,2,0,0,0,0|1,0,1]=4 5851 B8R1.7 N=C(N)N1CCCC1 MCULE-1081237301 [0,2,0,0,0,0|2,0,0]=4 5852 B8R1.7 N=C(N)N1CCCC1 MCULE-2310711826 [0,2,0,0,0,0|2,0,0]=4 5853 B8R1.7 N=C(N)N1CCCC1 MCULE-5860683743 [0,2,0,0,0,0|2,0,0]=4 5854 B8R1.7 N=C(N)N1CCCC1 MCULE-9334495491 [0,2,0,0,0,0|2,0,0]=4 5855 B8R1.7 NC(=O)C1=NCCN1 MCULE-8784849906 [0,2,0,0,0,0|2,0,0]=4 5856 B8R1.7 NC(=O)C1CCCC1 MCULE-3900666396 [0,2,0,0,0,0|0,0,1]=3 5857 B8R1.7 NC(=O)C1CCCN1 MCULE-4159463416 [0,2,0,0,0,0|1,0,1]=4 5858 B8R1.7 NC(=O)C1CCCN1 MCULE-4804910089 [0,2,0,0,0,0|1,0,1]=4 5859 B8R1.7 NC(=O)C1CCCO1 MCULE-9101921416 [0,2,0,0,0,0|1,0,1]=4 5860 B8R1.7 NC(=O)C1CCNC1 MCULE-6035608651 [0,2,0,0,0,0|1,0,1]=4 5861 B8R1.7 NC(=O)C1CCNC1 MCULE-8602888952 [0,2,0,0,0,0|1,0,1]=4 5862 B8R1.7 NC(=O)C1CCOC1 MCULE-7120435380 [0,2,0,0,0,0|1,0,1]=4 5863 B8R1.7 NC(=O)N1CCCC1 MCULE-2282948234 [0,2,0,0,0,0|1,0,0]=3 5864 B8R1.7 NC(=O)[C@@H]1CCCN1 MCULE-2635874022 [0,2,0,0,0,0|1,0,1]=4 5865 B8R1.7 NC(=O)[C@@H]1CCCN1 MCULE-2652734118 [0,2,0,0,0,0|1,0,1]=4 5866 B8R1.7 NC(=O)[C@@H]1CCCN1 MCULE-4692992308 [0,2,0,0,0,0|1,0,1]=4 5867 B8R1.7 NC(=O)[C@@H]1CCCN1 MCULE-6463625531 [0,2,0,0,0,0|1,0,1]=4 5868 B8R1.7 NC(=O)[C@@H]1CCCO1 MCULE-3181755658 [0,2,0,0,0,0|1,0,1]=4 5869 B8R1.7 NC(=O)[C@@H]1CCCO1 MCULE-9348376356 [0,2,0,0,0,0|1,0,1]=4 5870 B8R1.7 NC(=O)[C@@H]1CCNC1 MCULE-1320057579 [0,2,0,0,0,0|1,0,1]=4 5871 B8R1.7 NC(=O)[C@@H]1CCNC1 MCULE-1678228480 [0,2,0,0,0,0|1,0,1]=4 5872 B8R1.7 NC(=O)[C@@H]1CCNC1 MCULE-3340066069 [0,2,0,0,0,0|1,0,1]=4 5873 B8R1.7 NC(=O)[C@@H]1CCNC1 MCULE-8833406496 [0,2,0,0,0,0|1,0,1]=4 5874 B8R1.7 NC(=O)[C@H]1CCCN1 MCULE-1391877694 [0,2,0,0,0,0|1,0,1]=4 5875 B8R1.7 NC(=O)[C@H]1CCCN1 MCULE-2636422628 [0,2,0,0,0,0|1,0,1]=4 5876 B8R1.7 NC(=O)[C@H]1CCCN1 MCULE-3135852117 [0,2,0,0,0,0|1,0,1]=4 5877 B8R1.7 NC(=O)[C@H]1CCCN1 MCULE-9661392945 [0,2,0,0,0,0|1,0,1]=4 5878 B8R1.7 NC(=O)[C@H]1CCNC1 MCULE-1673594093 [0,2,0,0,0,0|1,0,1]=4 5879 B8R1.7 NC(=O)[C@H]1CCNC1 MCULE-6725123306 [0,2,0,0,0,0|1,0,1]=4 5880 B8R1.7 NC(=O)[C@H]1CCNC1 MCULE-7222756259 [0,2,0,0,0,0|1,0,1]=4 5881 B8R1.7 NC(=O)[C@H]1CCNC1 MCULE-8100234071 [0,2,0,0,0,0|1,0,1]=4 5882 B8R1.7 NC(=O)[C@H]1CCOC1 MCULE-1231475693 [0,2,0,0,0,0|1,0,1]=4 5883 B8R1.7 NC(=S)C1CCCC1 MCULE-8081902896 [0,2,0,0,0,0|0,1,1]=4 5884 B8R1.7 NC(=S)N1CCCC1 MCULE-1483517657 [0,2,0,0,0,0|1,1,0]=4 5885 B8R1.7 O=C(Cl)C1CCCC1 MCULE-1337538941 [0,2,0,0,0,0|0,0,1]=3 5886 B8R1.7 O=C(Cl)C1CCCO1 MCULE-9691919934 [0,2,0,0,0,0|1,0,1]=4 5887 B8R1.7 O=C(Cl)C1CCOC1 MCULE-9071234830 [0,2,0,0,0,0|1,0,1]=4 5888 B8R1.7 O=C(Cl)N1CCCC1 MCULE-2201729080 [0,2,0,0,0,0|1,0,0]=3 5889 B8R1.7 O=C(O)C1=CCCC1 MCULE-2928571993 [0,2,0,0,0,0|0,0,1]=3 5890 B8R1.7 O=C(O)C1=CCCO1 MCULE-8380391200 [0,2,0,0,0,0|1,0,1]=4 5891 B8R1.7 O=C(O)C1=CCCS1 MCULE-9231409703 [0,2,0,0,0,0|1,0,1]=4 5892 B8R1.7 O=C(O)C1=CCNC1 MCULE-2391284266 [0,2,0,0,0,0|1,0,1]=4 5893 B8R1.7 O=C(O)C1=CCNC1 MCULE-5725335930 [0,2,0,0,0,0|1,0,1]=4 5894 B8R1.7 O=C(O)C1=CCOC1 MCULE-3209603870 [0,2,0,0,0,0|1,0,1]=4 5895 B8R1.7 O=C(O)C1=CCSC1 MCULE-3187835692 [0,2,0,0,0,0|1,0,1]=4 5896 B8R1.7 O=C(O)C1=COCC1 MCULE-7263072561 [0,2,0,0,0,0|1,0,1]=4 5897 B8R1.7 O=C(O)C1=NCCC1 MCULE-2664768755 [0,2,0,0,0,0|1,0,0]=3 5898 B8R1.7 O=C(O)C1=NOCC1 MCULE-3126584315 [0,2,0,0,0,0|2,0,0]=4 5899 B8R1.7 O=C(O)C1CCCC1 MCULE-6415159340 [0,2,0,0,0,0|0,0,1]=3 5900 B8R1.7 O=C(O)C1CCCN1 MCULE-2229401513 [0,2,0,0,0,0|1,0,1]=4 5901 B8R1.7 O=C(O)C1CCCN1 MCULE-6305507014 [0,2,0,0,0,0|1,0,1]=4 5902 B8R1.7 O=C(O)C1CCCN1 MCULE-8387491590 [0,2,0,0,0,0|1,0,1]=4 5903 B8R1.7 O=C(O)C1CCCN1 MCULE-8611160929 [0,2,0,0,0,0|1,0,1]=4 5904 B8R1.7 O=C(O)C1CCCO1 MCULE-1952289090 [0,2,0,0,0,0|1,0,1]=4 5905 B8R1.7 O=C(O)C1CCCO1 MCULE-5387481824 [0,2,0,0,0,0|1,0,1]=4 5906 B8R1.7 O=C(O)C1CCCS1 MCULE-7760686042 [0,2,0,0,0,0|1,0,1]=4 5907 B8R1.7 O=C(O)C1CCNC1 MCULE-4976520029 [0,2,0,0,0,0|1,0,1]=4 5908 B8R1.7 O=C(O)C1CCNC1 MCULE-5937045785 [0,2,0,0,0,0|1,0,1]=4 5909 B8R1.7 O=C(O)C1CCNC1 MCULE-6983695276 [0,2,0,0,0,0|1,0,1]=4 5910 B8R1.7 O=C(O)C1CCOC1 MCULE-3567941338 [0,2,0,0,0,0|1,0,1]=4 5911 B8R1.7 O=C(O)C1CCSC1 MCULE-7898686734 [0,2,0,0,0,0|1,0,1]=4 5912 B8R1.7 O=C(O)N1CCCC1 MCULE-7984061130 [0,2,0,0,0,0|1,0,0]=3 5913 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-1020921088 [0,2,0,0,0,0|1,0,1]=4 5914 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-6398060480 [0,2,0,0,0,0|1,0,1]=4 5915 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-6772131264 [0,2,0,0,0,0|1,0,1]=4 5916 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-8415049837 [0,2,0,0,0,0|1,0,1]=4 5917 B8R1.7 O=C(O)[C@@H]1CCCO1 MCULE-5193388500 [0,2,0,0,0,0|1,0,1]=4 5918 B8R1.7 O=C(O)[C@@H]1CCCO1 MCULE-8181760406 [0,2,0,0,0,0|1,0,1]=4 5919 B8R1.7 O=C(O)[C@@H]1CCNC1 MCULE-3068007507 [0,2,0,0,0,0|1,0,1]=4 5920 B8R1.7 O=C(O)[C@@H]1CCNC1 MCULE-4477578687 [0,2,0,0,0,0|1,0,1]=4 5921 B8R1.7 O=C(O)[C@@H]1CCNC1 MCULE-4524201006 [0,2,0,0,0,0|1,0,1]=4 5922 B8R1.7 O=C(O)[C@@H]1CCNC1 MCULE-4868292658 [0,2,0,0,0,0|1,0,1]=4 5923 B8R1.7 O=C(O)[C@@H]1CCOC1 MCULE-4807765276 [0,2,0,0,0,0|1,0,1]=4 5924 B8R1.7 O=C(O)[C@@H]1CCOC1 MCULE-7912413581 [0,2,0,0,0,0|1,0,1]=4 5925 B8R1.7 O=C(O)[C@H]1CCCN1 MCULE-5856142508 [0,2,0,0,0,0|1,0,1]=4 5926 B8R1.7 O=C(O)[C@H]1CCCN1 MCULE-7748032436 [0,2,0,0,0,0|1,0,1]=4 5927 B8R1.7 O=C(O)[C@H]1CCCO1 MCULE-2258024439 [0,2,0,0,0,0|1,0,1]=4 5928 B8R1.7 O=C(O)[C@H]1CCCO1 MCULE-5143953192 [0,2,0,0,0,0|1,0,1]=4 5929 B8R1.7 O=C(O)[C@H]1CCNC1 MCULE-2003400674 [0,2,0,0,0,0|1,0,1]=4 5930 B8R1.7 O=C(O)[C@H]1CCNC1 MCULE-2851087395 [0,2,0,0,0,0|1,0,1]=4 5931 B8R1.7 O=C(O)[C@H]1CCNC1 MCULE-7223432888 [0,2,0,0,0,0|1,0,1]=4 5932 B8R1.7 O=C(O)[C@H]1CCNC1 MCULE-7610384670 [0,2,0,0,0,0|1,0,1]=4 5933 B8R1.7 O=C(O)[C@H]1CCOC1 MCULE-3213766488 [0,2,0,0,0,0|1,0,1]=4 5934 B8R1.7 O=C(O)[C@H]1CCOC1 MCULE-9627397250 [0,2,0,0,0,0|1,0,1]=4 5935 B8R1.7 O=C([O-])C1CCCN1 MCULE-9155494525 [0,2,0,0,0,0|1,0,1]=4 5936 B8R1.7 O=C([O-])[C@@H]1CCCN1 MCULE-2694821396 [0,2,0,0,0,0|1,0,1]=4 5937 B8R1.7 O=C([O-])[C@@H]1CCCN1 MCULE-8353601451 [0,2,0,0,0,0|1,0,1]=4 5938 B8R1.7 O=N(=O)C1=NOCC1 MCULE-6252838525 [0,2,0,0,0,0|2,0,0]=4 5939 B8R1.7 O=N(=O)C1CCCC1 MCULE-6499665829 [0,2,0,0,0,0|0,0,1]=3 5940 B8R1.7 O=S([O-])C1CCCC1 MCULE-4973639131 [0,2,0,0,0,0|0,0,1]=3 5941 B8R1.7 O=S([O-])C1CCCC1 MCULE-9227389818 [0,2,0,0,0,0|0,0,1]=3 5942 B8R1.7 O=S([O-])C1CCOC1 MCULE-2574399704 [0,2,0,0,0,0|1,0,1]=4 5943 B8R1.7 O=S([O-])C1CCOC1 MCULE-8651987419 [0,2,0,0,0,0|1,0,1]=4 5944 B8R1.7 OB(O)C1=CCCC1 MCULE-9719215712 [0,2,0,0,0,0|0,0,2]=4 5945 B8R1.7 OB(O)C1CCCC1 MCULE-7101191940 [0,2,0,0,0,0|0,0,2]=4 5946 B8R1.7 S=C(S)N1CCCC1 MCULE-1085952223 [0,2,0,0,0,0|1,1,0]=4 5947 B8R1.7 S=C([S-])N1CCCC1 MCULE-9299211770 [0,2,0,0,0,0|1,1,0]=4 5948 B8R1.7 S=C([S-])N1CCCC1 MCULE-9637056918 [0,2,0,0,0,0|1,1,0]=4 5949 B8R1.7 [NH2+]=C(N)N1CCCC1 MCULE-9887365479 [0,2,0,0,0,0|2,0,0]=4 5950 B8R1.8 BrCCC1CCCC1 MCULE-2388060322 [0,2,0,0,0,0|1,0,1]=4 5951 B8R1.8 BrCCN1CCCC1 MCULE-2990538836 [0,2,0,0,0,0|2,0,0]=4 5952 B8R1.8 BrCCN1CCCC1 MCULE-5221056964 [0,2,0,0,0,0|2,0,0]=4 5953 B8R1.8 BrCCN1CCCC1 MCULE-6489204087 [0,2,0,0,0,0|2,0,0]=4 5954 B8R1.8 C#CCC1CCCC1 MCULE-4429206625 [0,2,0,0,0,0|1,0,1]=4 5955 B8R1.8 C#CCN1CCCC1 MCULE-5162903851 [0,2,0,0,0,0|2,0,0]=4 5956 B8R1.8 C#CCN1CCCC1 MCULE-6581212444 [0,2,0,0,0,0|2,0,0]=4 5957 B8R1.8 C=CCC1CCCC1 MCULE-6306576171 [0,2,0,0,0,0|1,0,1]=4 5958 B8R1.8 CC#CC1CCCC1 MCULE-6831401252 [0,2,0,0,0,0|1,0,1]=4 5959 B8R1.8 CCC=C1CCNC1 MCULE-9512609772 [0,2,0,0,0,0|2,0,0]=4 5960 B8R1.8 CCNC1CCCC1 MCULE-2445860551 [0,2,0,0,0,0|1,0,1]=4 5961 B8R1.8 CCNC1CCCC1 MCULE-7166348416 [0,2,0,0,0,0|1,0,1]=4 5962 B8R1.8 CCOC1=NCCC1 MCULE-7392104128 [0,2,0,0,0,0|1,0,1]=4 5963 B8R1.8 CNCC1CCCC1 MCULE-4663524039 [0,2,0,0,0,0|1,0,1]=4 5964 B8R1.8 CNCC1CCCC1 MCULE-9254222767 [0,2,0,0,0,0|1,0,1]=4 5965 B8R1.8 CNOC1CCCC1 MCULE-4982755353 [0,2,0,0,0,0|0,0,2]=4 5966 B8R1.8 CONC1CCCC1 MCULE-2334525824 [0,2,0,0,0,0|0,0,2]=4 5967 B8R1.8 CONC1CCCC1 MCULE-8234744945 [0,2,0,0,0,0|0,0,2]=4 5968 B8R1.8 ClCCC1CCCC1 MCULE-1599799155 [0,2,0,0,0,0|1,0,1]=4 5969 B8R1.8 ClCCN1CCCC1 MCULE-4566854185 [0,2,0,0,0,0|2,0,0]=4 5970 B8R1.8 ClCCN1CCCC1 MCULE-4726707884 [0,2,0,0,0,0|2,0,0]=4 5971 B8R1.8 ClCOC1CCCC1 MCULE-5114597793 [0,2,0,0,0,0|0,0,2]=4 5972 B8R1.8 ICCC1CCCC1 MCULE-8881590696 [0,2,0,0,0,0|1,0,1]=4 5973 B8R1.8 ICCN1CCCC1 MCULE-8312907762 [0,2,0,0,0,0|2,0,0]=4 5974 B8R1.8 ICCN1CCCC1 MCULE-9169612289 [0,2,0,0,0,0|2,0,0]=4 5975 B8R1.8 N#C/N=C\1/CCCN1 MCULE-7996201780 [0,2,0,0,0,0|2,0,0]=4 5976 B8R1.8 N#CC=C1CCCC1 MCULE-5651918690 [0,2,0,0,0,0|1,0,0]=3 5977 B8R1.8 N#CCC1=CCCC1 MCULE-6127163874 [0,2,0,0,0,0|1,0,1]=4 5978 B8R1.8 N#CCC1CCCC1 MCULE-2061207221 [0,2,0,0,0,0|1,0,1]=4 5979 B8R1.8 N#CCN1CCCC1 MCULE-9606685840 [0,2,0,0,0,0|2,0,0]=4 5980 B8R1.8 N#CC[NH+]1CCCC1 MCULE-2383085132 [0,2,0,0,0,0|2,0,0]=4 5981 B8R1.8 N#CSC1CCCC1 MCULE-6344647634 [0,2,0,0,0,0|0,1,1]=4 5982 B8R1.8 N#N=NC1CCCC1 MCULE-7440565286 [0,2,0,0,0,0|1,0,1]=4 5983 B8R1.8 NCCC1CCCC1 MCULE-1321612615 [0,2,0,0,0,0|1,0,1]=4 5984 B8R1.8 NCCC1CCCC1 MCULE-2815985200 [0,2,0,0,0,0|1,0,1]=4 5985 B8R1.8 NCCC1CCCC1 MCULE-4452900288 [0,2,0,0,0,0|1,0,1]=4 5986 B8R1.8 NCCN1CCCC1 MCULE-3440987582 [0,2,0,0,0,0|2,0,0]=4 5987 B8R1.8 NCCN1CCCC1 MCULE-7056026855 [0,2,0,0,0,0|2,0,0]=4 5988 B8R1.8 NNCC1CCCC1 MCULE-2668762237 [0,2,0,0,0,0|1,0,1]=4 5989 B8R1.8 NNCC1CCCC1 MCULE-3562283620 [0,2,0,0,0,0|1,0,1]=4 5990 B8R1.8 NNCC1CCCC1 MCULE-4656086960 [0,2,0,0,0,0|1,0,1]=4 5991 B8R1.8 NOCC1CCCC1 MCULE-4591181284 [0,2,0,0,0,0|0,0,2]=4 5992 B8R1.8 NOCC1CCCC1 MCULE-5675248010 [0,2,0,0,0,0|0,0,2]=4 5993 B8R1.8 O=C=NC1CCCC1 MCULE-6237253816 [0,2,0,0,0,0|0,0,1]=3 5994 B8R1.8 O=C=NC1CCOC1 MCULE-3657755611 [0,2,0,0,0,0|1,0,1]=4 5995 B8R1.8 O=CCC1CCCC1 MCULE-1337960294 [0,2,0,0,0,0|0,0,1]=3 5996 B8R1.8 O=CCC1CCOC1 MCULE-3891672561 [0,2,0,0,0,0|1,0,1]=4 5997 B8R1.8 O=CCN1CCCC1 MCULE-4391534239 [0,2,0,0,0,0|1,0,0]=3 5998 B8R1.8 O=CNC1CCCC1 MCULE-1453368274 [0,2,0,0,0,0|0,0,1]=3 5999 B8R1.8 OCCC1CCCC1 MCULE-3680571056 [0,2,0,0,0,0|0,0,2]=4 6000 B8R1.8 OCCN1CCCC1 MCULE-5922471274 [0,2,0,0,0,0|1,0,1]=4 6001 B8R1.8 OCCN1CCCC1 MCULE-7598437595 [0,2,0,0,0,0|1,0,1]=4 6002 B8R1.8 S=C=NC1CCCC1 MCULE-6629793875 [0,2,0,0,0,0|0,1,1]=4 6003 B8R1.8 SCCN1CCCC1 MCULE-6946048852 [0,2,0,0,0,0|1,1,0]=4 6004 B8R1.11 C#CC1CCCC1O MCULE-6037624903 [0,2,0,0,0,0|0,0,2]=4 6005 B8R1.11 C#CC1CCCN1C MCULE-7506064982 [0,2,0,0,0,0|2,0,0]=4 6006 B8R1.11 C#C[C@@H]1CCC[C@H]1O MCULE-7417393541 [0,2,0,0,0,0|0,0,2]=4 6007 B8R1.11 C#C[C@H]1CCC[C@@H]1O MCULE-6017503361 [0,2,0,0,0,0|0,0,2]=4 6008 B8R1.11 C#C[C@H]1CCC[C@H]1O MCULE-2764710000 [0,2,0,0,0,0|0,0,2]=4 6009 B8R1.11 C1(CCCN1C)CN MCULE-3823756764 [0,2,0,0,0,0|2,0,0]=4 6010 B8R1.11 C1(CCCN1C)CO MCULE-1790699840 [0,2,0,0,0,0|2,0,0]=4 6011 B8R1.11 C=CN1CCCC1=O MCULE-3025814103 [0,2,0,0,0,0|1,0,0]=3 6012 B8R1.11 CC1CCCC1C#N MCULE-4638858957 [0,2,0,0,0,0|1,0,1]=4 6013 B8R1.11 CC1CCCC1CN MCULE-3896736641 [0,2,0,0,0,0|1,0,1]=4 6014 B8R1.11 CC1CCCC1CN MCULE-8678978716 [0,2,0,0,0,0|1,0,1]=4 6015 B8R1.11 CC1CCCC1CO MCULE-9356546543 [0,2,0,0,0,0|0,0,2]=4 6016 B8R1.11 CC1OCCC1C=O MCULE-5505705817 [0,2,0,0,0,0|1,0,1]=4 6017 B8R1.11 CCC1CCCC1=O MCULE-1884299455 [0,2,0,0,0,0|0,0,0]=2 6018 B8R1.11 CCC1CCCC1N MCULE-3368757457 [0,2,0,0,0,0|1,0,1]=4 6019 B8R1.11 CCC1CCNC1=O MCULE-8307536027 [0,2,0,0,0,0|1,0,0]=3 6020 B8R1.11 CCC1CCOC1=O MCULE-2375464273 [0,2,0,0,0,0|1,0,0]=3 6021 B8R1.11 CCC1COCC1=O MCULE-5486171882 [0,2,0,0,0,0|1,0,0]=3 6022 B8R1.11 CCN1CCCC1=O MCULE-7206309773 [0,2,0,0,0,0|1,0,0]=3 6023 B8R1.11 CCN1CCCC1=O MCULE-7415495937 [0,2,0,0,0,0|1,0,0]=3 6024 B8R1.11 CCN1CCNC1=O MCULE-8168665695 [0,2,0,0,0,0|2,0,0]=4 6025 B8R1.11 CCN1CNCC1=O MCULE-2327338525 [0,2,0,0,0,0|2,0,0]=4 6026 B8R1.11 CC[C@@H]1CCC[C@H]1N MCULE-6461151240 [0,2,0,0,0,0|1,0,1]=4 6027 B8R1.11 CN1CCCC1C#N MCULE-2088134019 [0,2,0,0,0,0|2,0,0]=4 6028 B8R1.11 CN1CCCC1CBr MCULE-6207314013 [0,2,0,0,0,0|2,0,0]=4 6029 B8R1.11 CN1CCCC1CBr MCULE-7003172406 [0,2,0,0,0,0|2,0,0]=4 6030 B8R1.11 CN1CCCC1CBr MCULE-8572986373 [0,2,0,0,0,0|2,0,0]=4 6031 B8R1.11 CN1CCCC1CCl MCULE-8890705455 [0,2,0,0,0,0|2,0,0]=4 6032 B8R1.11 CN1CCCC1CCl MCULE-9540416464 [0,2,0,0,0,0|2,0,0]=4 6033 B8R1.11 CN1CCCC1CI MCULE-3626178331 [0,2,0,0,0,0|2,0,0]=4 6034 B8R1.11 CN1CCCC1CN MCULE-2455567320 [0,2,0,0,0,0|2,0,0]=4 6035 B8R1.11 CN1CCCC1CN MCULE-4385272553 [0,2,0,0,0,0|2,0,0]=4 6036 B8R1.11 CN1CCCC1CN MCULE-6012303918 [0,2,0,0,0,0|2,0,0]=4 6037 B8R1.11 CN1CCCC1CO MCULE-9904095173 [0,2,0,0,0,0|2,0,0]=4 6038 B8R1.11 CN1CCC[C@@H]1CCl MCULE-5528936211 [0,2,0,0,0,0|2,0,0]=4 6039 B8R1.11 CN1CCC[C@@H]1CCl MCULE-9043086094 [0,2,0,0,0,0|2,0,0]=4 6040 B8R1.11 CN1CCC[C@@H]1CN MCULE-6894579934 [0,2,0,0,0,0|2,0,0]=4 6041 B8R1.11 CN1CCC[C@@H]1CN MCULE-9545868600 [0,2,0,0,0,0|2,0,0]=4 6042 B8R1.11 CN1CCC[C@@H]1CN MCULE-9979136465 [0,2,0,0,0,0|2,0,0]=4 6043 B8R1.11 CN1CCC[C@@H]1CO MCULE-1873370971 [0,2,0,0,0,0|2,0,0]=4 6044 B8R1.11 CN1CCC[C@@H]1CO MCULE-5652991406 [0,2,0,0,0,0|2,0,0]=4 6045 B8R1.11 CN1CCC[C@H]1C=O MCULE-5852490757 [0,2,0,0,0,0|1,0,1]=4 6046 B8R1.11 CN1CCC[C@H]1CBr MCULE-2559727654 [0,2,0,0,0,0|2,0,0]=4 6047 B8R1.11 CN1CCC[C@H]1CBr MCULE-7318507406 [0,2,0,0,0,0|2,0,0]=4 6048 B8R1.11 CN1CCC[C@H]1CCl MCULE-3099742983 [0,2,0,0,0,0|2,0,0]=4 6049 B8R1.11 CN1CCC[C@H]1CCl MCULE-4078147384 [0,2,0,0,0,0|2,0,0]=4 6050 B8R1.11 CN1CCC[C@H]1CCl MCULE-4291983682 [0,2,0,0,0,0|2,0,0]=4 6051 B8R1.11 CN1CCC[C@H]1CI MCULE-5761103319 [0,2,0,0,0,0|2,0,0]=4 6052 B8R1.11 CN1CCC[C@H]1CN MCULE-5808625886 [0,2,0,0,0,0|2,0,0]=4 6053 B8R1.11 CN1CCC[C@H]1CN MCULE-7551556135 [0,2,0,0,0,0|2,0,0]=4 6054 B8R1.11 CN1CCC[C@H]1CN MCULE-8399390985 [0,2,0,0,0,0|2,0,0]=4 6055 B8R1.11 CN1CCC[C@H]1CN MCULE-9386333411 [0,2,0,0,0,0|2,0,0]=4 6056 B8R1.11 CN1CCC[C@H]1CO MCULE-4291089054 [0,2,0,0,0,0|2,0,0]=4 6057 B8R1.11 CN1CCC[C@H]1CO MCULE-8245872227 [0,2,0,0,0,0|2,0,0]=4 6058 B8R1.11 CNC1CCCC1O MCULE-9589316744 [0,2,0,0,0,0|0,0,2]=4 6059 B8R1.11 CNC1CCNC1=O MCULE-1302732570 [0,2,0,0,0,0|1,0,0]=3 6060 B8R1.11 CNC1CCNC1=O MCULE-7065523709 [0,2,0,0,0,0|1,0,0]=3 6061 B8R1.11 CN[C@@H]1CCC[C@@H]1O MCULE-5540430832 [0,2,0,0,0,0|0,0,2]=4 6062 B8R1.11 CN[C@@H]1CCC[C@H]1O MCULE-5681644013 [0,2,0,0,0,0|0,0,2]=4 6063 B8R1.11 CN[C@H]1CCC[C@@H]1O MCULE-2896940586 [0,2,0,0,0,0|0,0,2]=4 6064 B8R1.11 CN[C@H]1CCC[C@@H]1O MCULE-4568895508 [0,2,0,0,0,0|0,0,2]=4 6065 B8R1.11 CN[C@H]1CCC[C@H]1O MCULE-3676766170 [0,2,0,0,0,0|0,0,2]=4 6066 B8R1.11 COC1=CCCC1=O MCULE-2849263860 [0,2,0,0,0,0|0,0,2]=4 6067 B8R1.11 COC1CCCC1=O MCULE-2741778082 [0,2,0,0,0,0|0,0,0]=2 6068 B8R1.11 COC1CCCC1Br MCULE-2771155480 [0,2,0,0,0,0|0,0,2]=4 6069 B8R1.11 COC1CCCC1N MCULE-8362175674 [0,2,0,0,0,0|0,0,2]=4 6070 B8R1.11 COC1CCCC1N MCULE-9069118012 [0,2,0,0,0,0|0,0,2]=4 6071 B8R1.11 COC1CCOC1=O MCULE-6321591157 [0,2,0,0,0,0|1,0,0]=3 6072 B8R1.11 COC1COCC1=O MCULE-2097991610 [0,2,0,0,0,0|1,0,0]=3 6073 B8R1.11 CO[C@@H]1CCC[C@@H]1N MCULE-4692120885 [0,2,0,0,0,0|0,0,2]=4 6074 B8R1.11 CO[C@@H]1CCC[C@@H]1N MCULE-5926423252 [0,2,0,0,0,0|0,0,2]=4 6075 B8R1.11 CO[C@@H]1CCC[C@@H]1N MCULE-7482120389 [0,2,0,0,0,0|0,0,2]=4 6076 B8R1.11 CO[C@@H]1CCC[C@@H]1N MCULE-8564106437 [0,2,0,0,0,0|0,0,2]=4 6077 B8R1.11 CO[C@@H]1CCC[C@H]1N MCULE-3230499380 [0,2,0,0,0,0|0,0,2]=4 6078 B8R1.11 CO[C@@H]1CCC[C@H]1N MCULE-3289874569 [0,2,0,0,0,0|0,0,2]=4 6079 B8R1.11 CO[C@@H]1CCC[C@H]1N MCULE-6247013104 [0,2,0,0,0,0|0,0,2]=4 6080 B8R1.11 CO[C@@H]1CCC[C@H]1O MCULE-8222306700 [0,2,0,0,0,0|0,0,2]=4 6081 B8R1.11 CO[C@H]1CCC[C@@H]1N MCULE-2030514470 [0,2,0,0,0,0|0,0,2]=4 6082 B8R1.11 CO[C@H]1CCC[C@@H]1N MCULE-7221434150 [0,2,0,0,0,0|0,0,2]=4 6083 B8R1.11 CO[C@H]1CCC[C@H]1N MCULE-5694225216 [0,2,0,0,0,0|0,0,2]=4 6084 B8R1.11 CO[C@H]1CCC[C@H]1N MCULE-6324790556 [0,2,0,0,0,0|0,0,2]=4 6085 B8R1.11 CO[C@H]1CCC[C@H]1N MCULE-7994033941 [0,2,0,0,0,0|0,0,2]=4 6086 B8R1.11 CO[C@H]1CCC[C@H]1N MCULE-9253743808 [0,2,0,0,0,0|0,0,2]=4 6087 B8R1.11 CSC1CCCC1N MCULE-2843614842 [0,2,0,0,0,0|0,1,1]=4 6088 B8R1.11 N#CC1=C(CCC1)N MCULE-8457887126 [0,2,0,0,0,0|1,0,1]=4 6089 B8R1.11 N#CC1=C(CCC1)O MCULE-3061739573 [0,2,0,0,0,0|0,0,2]=4 6090 B8R1.11 N#CC1CCCC1=O MCULE-6254621629 [0,2,0,0,0,0|0,0,0]=2 6091 B8R1.11 N#CC1CCCC1N MCULE-2657790377 [0,2,0,0,0,0|1,0,1]=4 6092 B8R1.11 N#CC1CCCC1N MCULE-3586283447 [0,2,0,0,0,0|1,0,1]=4 6093 B8R1.11 N#CC1CCCC1O MCULE-8441776059 [0,2,0,0,0,0|0,0,2]=4 6094 B8R1.11 N#CC1CCOC1=O MCULE-4716981850 [0,2,0,0,0,0|1,0,0]=3 6095 B8R1.11 N#CC1COCC1=O MCULE-8235489299 [0,2,0,0,0,0|1,0,0]=3 6096 B8R1.11 N#CC1CSCC1=O MCULE-5156436630 [0,2,0,0,0,0|1,0,0]=3 6097 B8R1.11 N#C[C@@H]1CCC[C@@H]1N MCULE-3868705638 [0,2,0,0,0,0|1,0,1]=4 6098 B8R1.11 N#C[C@@H]1CCC[C@@H]1N MCULE-5875539247 [0,2,0,0,0,0|1,0,1]=4 6099 B8R1.11 N#C[C@@H]1CCC[C@@H]1N MCULE-8719885109 [0,2,0,0,0,0|1,0,1]=4 6100 B8R1.11 N#C[C@@H]1CCC[C@@H]1N MCULE-9418838624 [0,2,0,0,0,0|1,0,1]=4 6101 B8R1.11 N#C[C@@H]1CCC[C@H]1O MCULE-4467355190 [0,2,0,0,0,0|0,0,2]=4 6102 B8R1.11 N#C[C@@H]1CCC[C@H]1O MCULE-8795058387 [0,2,0,0,0,0|0,0,2]=4 6103 B8R1.11 N#C[C@H]1CCC[C@H]1N MCULE-3483623297 [0,2,0,0,0,0|1,0,1]=4 6104 B8R1.11 N#C[C@H]1CCC[C@H]1N MCULE-3989890564 [0,2,0,0,0,0|1,0,1]=4 6105 B8R1.11 N#C[C@H]1CCC[C@H]1N MCULE-8145436082 [0,2,0,0,0,0|1,0,1]=4 6106 B8R1.11 N#C[C@H]1CCC[C@H]1N MCULE-8299410277 [0,2,0,0,0,0|1,0,1]=4 6107 B8R1.11 N#C[C@H]1COCC1=O MCULE-3727267765 [0,2,0,0,0,0|1,0,0]=3 6108 B8R1.11 N#C[C@H]1CSCC1=O MCULE-1823296344 [0,2,0,0,0,0|1,0,0]=3 6109 B8R1.11 NC1CCCC1CO MCULE-9652022908 [0,2,0,0,0,0|0,0,2]=4 6110 B8R1.11 NCC1CCCC1=O MCULE-4144323636 [0,2,0,0,0,0|0,0,0]=2 6111 B8R1.11 NCC1CCCC1=O MCULE-8761719757 [0,2,0,0,0,0|0,0,0]=2 6112 B8R1.11 NCC1CCCC1F MCULE-6144218913 [0,2,0,0,0,0|1,0,1]=4 6113 B8R1.11 NCC1CCCC1F MCULE-6567537087 [0,2,0,0,0,0|1,0,1]=4 6114 B8R1.11 NCC1CCCC1N MCULE-8430269654 [0,2,0,0,0,0|1,0,1]=4 6115 B8R1.11 NCC1CCCC1O MCULE-6648305550 [0,2,0,0,0,0|0,0,2]=4 6116 B8R1.11 NCC1CCOC1=O MCULE-5843107965 [0,2,0,0,0,0|1,0,0]=3 6117 B8R1.11 NCC1CCOC1=O MCULE-6077637171 [0,2,0,0,0,0|1,0,0]=3 6118 B8R1.11 NC[C@@H]1CCC[C@H]1F MCULE-1610227273 [0,2,0,0,0,0|1,0,1]=4 6119 B8R1.11 NC[C@@H]1CCC[C@H]1F MCULE-1834909475 [0,2,0,0,0,0|1,0,1]=4 6120 B8R1.11 NC[C@@H]1CCC[C@H]1F MCULE-2170917176 [0,2,0,0,0,0|1,0,1]=4 6121 B8R1.11 NC[C@@H]1CCC[C@H]1F MCULE-2741482456 [0,2,0,0,0,0|1,0,1]=4 6122 B8R1.11 NN1CCCC1CO MCULE-1842894120 [0,2,0,0,0,0|2,0,0]=4 6123 B8R1.11 NN1CCC[C@H]1CO MCULE-2058705707 [0,2,0,0,0,0|2,0,0]=4 6124 B8R1.11 NNC1CCCC1O MCULE-4679888412 [0,2,0,0,0,0|0,0,2]=4 6125 B8R1.11 NN[C@@H]1CCC[C@H]1O MCULE-6631597748 [0,2,0,0,0,0|0,0,2]=4 6126 B8R1.11 NN[C@@H]1CCC[C@H]1O MCULE-9568290705 [0,2,0,0,0,0|0,0,2]=4 6127 B8R1.11 NOC1CCOC1=O MCULE-1912651031 [0,2,0,0,0,0|1,0,0]=3 6128 B8R1.11 N[C@@H]1CCC[C@H]1CO MCULE-7218353328 [0,2,0,0,0,0|0,0,2]=4 6129 B8R1.11 N[C@H]1CCC[C@H]1CO MCULE-3793323277 [0,2,0,0,0,0|0,0,2]=4 6130 B8R1.11 N[C@H]1CCC[C@H]1CO MCULE-5297422093 [0,2,0,0,0,0|0,0,2]=4 6131 B8R1.11 O=C1CCC=C1CO MCULE-5949194155 [0,2,0,0,0,0|0,0,2]=4 6132 B8R1.11 O=C1CCCC1CO MCULE-9171970685 [0,2,0,0,0,0|0,0,0]=2 6133 B8R1.11 O=C1CCCN1CBr MCULE-1337183945 [0,2,0,0,0,0|1,0,0]=3 6134 B8R1.11 O=C1CCCN1CCl MCULE-6204630639 [0,2,0,0,0,0|1,0,0]=3 6135 B8R1.11 O=C1CCCN1CO MCULE-6508920438 [0,2,0,0,0,0|1,0,0]=3 6136 B8R1.11 O=C1CNCN1CO MCULE-1880077159 [0,2,0,0,0,0|2,0,0]=4 6137 B8R1.11 O=C1CNCN1CO MCULE-4265247225 [0,2,0,0,0,0|2,0,0]=4 6138 B8R1.11 O=C1NCCC1CO MCULE-8442279545 [0,2,0,0,0,0|1,0,0]=3 6139 B8R1.11 O=C1NCC[C@@H]1CO MCULE-5339343040 [0,2,0,0,0,0|1,0,0]=3 6140 B8R1.11 O=C1OCCC1=NO MCULE-1241579763 [0,2,0,0,0,0|1,0,1]=4 6141 B8R1.11 O=CC1=C(CCC1)Cl MCULE-2468041387 [0,2,0,0,0,0|0,0,1]=3 6142 B8R1.11 O=CC1CCOC1=O MCULE-6358043470 [0,2,0,0,0,0|1,0,0]=3 6143 B8R1.11 O=CN1CCCC1=O MCULE-1097328464 [0,2,0,0,0,0|1,0,0]=3 6144 B8R1.11 OCC1CCCC1O MCULE-7244611817 [0,2,0,0,0,0|0,0,2]=4 6145 B8R1.11 [C@H]1(CCC[C@H]1CO)N MCULE-8523302139 [0,2,0,0,0,0|0,0,2]=4 6146 B8R1.52 C#CC1(CCCC1)C MCULE-9671261567 [0,2,0,0,0,0|1,0,1]=4 6147 B8R1.52 C#CC1(CCCC1)N MCULE-2932081709 [0,2,0,0,0,0|1,0,1]=4 6148 B8R1.52 C#CC1(CCCC1)N MCULE-9707098843 [0,2,0,0,0,0|1,0,1]=4 6149 B8R1.52 C#CC1(CCCC1)O MCULE-7428088952 [0,2,0,0,0,0|0,0,2]=4 6150 B8R1.52 C=C[Si]1(CCCC1)C MCULE-3298566075 [0,2,0,0,0,0|1,1,0]=4 6151 B8R1.52 CC1(CCCC1)C#N MCULE-2721276425 [0,2,0,0,0,0|1,0,1]=4 6152 B8R1.52 CC1(CCCC1)C=O MCULE-2794420297 [0,2,0,0,0,0|0,0,1]=3 6153 B8R1.52 CC1(CCCC1)CBr MCULE-8731175743 [0,2,0,0,0,0|1,0,1]=4 6154 B8R1.52 CC1(CCCC1)CN MCULE-5367013560 [0,2,0,0,0,0|1,0,1]=4 6155 B8R1.52 CC1(CCCC1)CN MCULE-5646661577 [0,2,0,0,0,0|1,0,1]=4 6156 B8R1.52 CC1(CCCC1)CO MCULE-5781311918 [0,2,0,0,0,0|0,0,2]=4 6157 B8R1.52 CC1(CCCO1)C=O MCULE-4619641299 [0,2,0,0,0,0|1,0,1]=4 6158 B8R1.52 CC1(CCCS1)C=O MCULE-9560124012 [0,2,0,0,0,0|1,0,1]=4 6159 B8R1.52 CCC1(CCCC1)C MCULE-5104658069 [0,2,0,0,0,0|1,0,1]=4 6160 B8R1.52 CCC1(CCCC1)N MCULE-6321282069 [0,2,0,0,0,0|1,0,1]=4 6161 B8R1.52 CCC1(CCCC1)N MCULE-9310297702 [0,2,0,0,0,0|1,0,1]=4 6162 B8R1.52 CCC1(CCCC1)O MCULE-2200843488 [0,2,0,0,0,0|0,0,2]=4 6163 B8R1.52 CC[N+]1(CCCC1)C MCULE-1996992656 [0,2,0,0,0,0|2,0,0]=4 6164 B8R1.52 CC[N+]1(CCCC1)C MCULE-5468205365 [0,2,0,0,0,0|2,0,0]=4 6165 B8R1.52 CC[N+]1(CCCC1)C MCULE-6004225859 [0,2,0,0,0,0|2,0,0]=4 6166 B8R1.52 CNC1(CCCC1)C MCULE-5523013258 [0,2,0,0,0,0|1,0,1]=4 6167 B8R1.52 CNC1(CCCC1)C MCULE-5558514698 [0,2,0,0,0,0|1,0,1]=4 6168 B8R1.52 FC1(CCCC1)CBr MCULE-5544045757 [0,2,0,0,0,0|1,0,1]=4 6169 B8R1.52 N#CC1(CCCC1)F MCULE-9519990946 [0,2,0,0,0,0|1,0,1]=4 6170 B8R1.52 N#CC1(CCCC1)N MCULE-2771828085 [0,2,0,0,0,0|1,0,1]=4 6171 B8R1.52 N#CC1(CCCC1)N MCULE-9817793665 [0,2,0,0,0,0|1,0,1]=4 6172 B8R1.52 N#CC1(CCCC1)O MCULE-6757441617 [0,2,0,0,0,0|0,0,2]=4 6173 B8R1.52 NC1(CCCC1)CO MCULE-6075612462 [0,2,0,0,0,0|0,0,2]=4 6174 B8R1.52 NC1(CCCC1)CO MCULE-6080383421 [0,2,0,0,0,0|0,0,2]=4 6175 B8R1.52 NC1(CCCC1)CO MCULE-9669923041 [0,2,0,0,0,0|0,0,2]=4 6176 B8R1.52 NCC1(CCCC1)F MCULE-5401302824 [0,2,0,0,0,0|1,0,1]=4 6177 B8R1.52 NCC1(CCCC1)F MCULE-7203857001 [0,2,0,0,0,0|1,0,1]=4 6178 B8R1.52 NCC1(CCCC1)N MCULE-1134056027 [0,2,0,0,0,0|1,0,1]=4 6179 B8R1.52 NCC1(CCCC1)N MCULE-5743820145 [0,2,0,0,0,0|1,0,1]=4 6180 B8R1.52 NCC1(CCCC1)O MCULE-7890258140 [0,2,0,0,0,0|0,0,2]=4 6181 B8R1.52 NCC1(CCCC1)O MCULE-7985204108 [0,2,0,0,0,0|0,0,2]=4 6182 B8R1.52 O=CC1(CCCC1)F MCULE-6748021302 [0,2,0,0,0,0|0,0,1]=3 6183 B8R1.52 OCC1(CCCC1)F MCULE-3500711576 [0,2,0,0,0,0|0,0,2]=4 6184 B8R1.52 OCC1(CCCC1)O MCULE-2433996412 [0,2,0,0,0,0|0,0,2]=4 6185 B8R1.18 C=C1CC(OC1=O)C MCULE-4610228867 [0,2,0,0,0,0|1,0,1]=4 6186 B8R1.18 CC1=CC(=O)CC1C MCULE-9587444246 [0,2,0,0,0,0|0,0,2]=4 6187 B8R1.18 CC1=CC(CC1=O)O MCULE-6348285774 [0,2,0,0,0,0|0,0,2]=4 6188 B8R1.18 CC1CC(=O)C(O1)C MCULE-9648127298 [0,2,0,0,0,0|1,0,0]=3 6189 B8R1.18 CC1CC(=O)CN1C MCULE-3142275674 [0,2,0,0,0,0|1,0,0]=3 6190 B8R1.18 CC1CC(=O)N(C1)C MCULE-2164356802 [0,2,0,0,0,0|1,0,0]=3 6191 B8R1.18 CC1CC(=O)N(N1)C MCULE-3951114099 [0,2,0,0,0,0|2,0,0]=4 6192 B8R1.18 CC1CC(=O)NC1=O MCULE-2962850802 [0,2,0,0,0,0|1,0,1]=4 6193 B8R1.18 CC1CC(=O)OC1=O MCULE-6043315810 [0,2,0,0,0,0|1,0,1]=4 6194 B8R1.18 CC1CC(=O)OC1C MCULE-3906254123 [0,2,0,0,0,0|1,0,0]=3 6195 B8R1.18 CC1CC(=O)OC1O MCULE-7140241012 [0,2,0,0,0,0|1,0,0]=3 6196 B8R1.18 CC1CC(C(=O)O1)Br MCULE-3628819780 [0,2,0,0,0,0|1,0,0]=3 6197 B8R1.18 CC1CC(C(=O)O1)N MCULE-4414809681 [0,2,0,0,0,0|1,0,0]=3 6198 B8R1.18 CC1CC(C(=O)O1)N MCULE-7247771680 [0,2,0,0,0,0|1,0,0]=3 6199 B8R1.18 CC1CN(CC1=O)C MCULE-3780339739 [0,2,0,0,0,0|1,0,0]=3 6200 B8R1.18 CC1CN(CC1N)C MCULE-4537736727 [0,2,0,0,0,0|2,0,0]=4 6201 B8R1.18 CC1NC(=O)CC1=O MCULE-3973500509 [0,2,0,0,0,0|1,0,1]=4 6202 B8R1.18 CC1NC(=O)CC1O MCULE-6370955032 [0,2,0,0,0,0|1,0,0]=3 6203 B8R1.18 CC1NC(=O)OC1C MCULE-5204749893 [0,2,0,0,0,0|2,0,0]=4 6204 B8R1.18 CC1OC(=O)OC1C MCULE-1302025126 [0,2,0,0,0,0|2,0,0]=4 6205 B8R1.18 CN1CC(=O)CC1=O MCULE-9941627549 [0,2,0,0,0,0|1,0,1]=4 6206 B8R1.18 CN1CC(C(C1)O)N MCULE-2599335817 [0,2,0,0,0,0|2,0,0]=4 6207 B8R1.18 CN1CC(C(C1)O)N MCULE-6847369546 [0,2,0,0,0,0|2,0,0]=4 6208 B8R1.18 CN1CC(CC1=O)I MCULE-4945824576 [0,2,0,0,0,0|1,0,0]=3 6209 B8R1.18 CN1CC(CC1=O)N MCULE-2463085778 [0,2,0,0,0,0|1,0,0]=3 6210 B8R1.18 CN1CC(CC1=O)N MCULE-2958084133 [0,2,0,0,0,0|1,0,0]=3 6211 B8R1.18 CN1CC(CC1=O)O MCULE-3900359646 [0,2,0,0,0,0|1,0,0]=3 6212 B8R1.18 CN1C[C@@H](CC1=O)N MCULE-5898871508 [0,2,0,0,0,0|1,0,0]=3 6213 B8R1.18 CN1C[C@@H](CC1=O)O MCULE-6983684031 [0,2,0,0,0,0|1,0,0]=3 6214 B8R1.18 CN1C[C@@H](CC1=O)O MCULE-9036883490 [0,2,0,0,0,0|1,0,0]=3 6215 B8R1.18 CN1C[C@@H]([C@@H](C1)O)F MCULE-1004495465 [0,2,0,0,0,0|2,0,0]=4 6216 B8R1.18 CN1C[C@@H]([C@@H](C1)O)N MCULE-2486938322 [0,2,0,0,0,0|2,0,0]=4 6217 B8R1.18 CN1C[C@@H]([C@@H](C1)O)N MCULE-5836595032 [0,2,0,0,0,0|2,0,0]=4 6218 B8R1.18 CN1C[C@@H]([C@@H](C1)O)N MCULE-6830124811 [0,2,0,0,0,0|2,0,0]=4 6219 B8R1.18 CN1C[C@@H]([C@@H](C1)O)N MCULE-9514040195 [0,2,0,0,0,0|2,0,0]=4 6220 B8R1.18 CN1C[C@H](CC1=O)N MCULE-6260844558 [0,2,0,0,0,0|1,0,0]=3 6221 B8R1.18 CN1C[C@H](CC1=O)N MCULE-9464195407 [0,2,0,0,0,0|1,0,0]=3 6222 B8R1.18 CN1C[C@H](CC1=O)O MCULE-1129246553 [0,2,0,0,0,0|1,0,0]=3 6223 B8R1.18 CN1C[C@H](CC1=O)O MCULE-3762455862 [0,2,0,0,0,0|1,0,0]=3 6224 B8R1.18 CN1C[C@H]([C@@H](C1)O)N MCULE-3812148649 [0,2,0,0,0,0|2,0,0]=4 6225 B8R1.18 CN1C[C@H]([C@@H](C1)O)N MCULE-5853867679 [0,2,0,0,0,0|2,0,0]=4 6226 B8R1.18 CN1C[C@H]([C@@H](C1)O)N MCULE-7840416361 [0,2,0,0,0,0|2,0,0]=4 6227 B8R1.18 CN1C[C@H]([C@@H](C1)O)N MCULE-8395934464 [0,2,0,0,0,0|2,0,0]=4 6228 B8R1.18 C[C@@H]1CC(=O)NC1=O MCULE-9043552998 [0,2,0,0,0,0|1,0,1]=4 6229 B8R1.18 C[C@@H]1NC(=O)C[C@@H]1O MCULE-5647492108 [0,2,0,0,0,0|1,0,0]=3 6230 B8R1.18 C[C@H]1CC(=O)OC1=O MCULE-7764909201 [0,2,0,0,0,0|1,0,1]=4 6231 B8R1.18 C[C@H]1CC(=O)O[C@H]1C MCULE-7756599719 [0,2,0,0,0,0|1,0,0]=3 6232 B8R1.18 NC1CC(=O)NC1=O MCULE-6692452440 [0,2,0,0,0,0|1,0,1]=4 6233 B8R1.18 NC1CC(=O)NC1=O MCULE-8447671567 [0,2,0,0,0,0|1,0,1]=4 6234 B8R1.18 NC1CC(=O)OC1=O MCULE-1406790351 [0,2,0,0,0,0|1,0,1]=4 6235 B8R1.18 NC1CC(=O)OC1=O MCULE-2807590870 [0,2,0,0,0,0|1,0,1]=4 6236 B8R1.18 NC1CC(C(C1)O)O MCULE-4578427017 [0,2,0,0,0,0|0,0,2]=4 6237 B8R1.18 NC1CC(C(C1)O)O MCULE-5175955370 [0,2,0,0,0,0|0,0,2]=4 6238 B8R1.18 NC1C[C@@H]([C@@H](C1)O)O MCULE-6906947518 [0,2,0,0,0,0|0,0,2]=4 6239 B8R1.18 NC1C[C@@H]([C@@H](C1)O)O MCULE-9885099468 [0,2,0,0,0,0|0,0,2]=4 6240 B8R1.18 N[C@@H]1CC(=O)NC1=O MCULE-1292090753 [0,2,0,0,0,0|1,0,1]=4 6241 B8R1.18 N[C@@H]1CC(=O)NC1=O MCULE-9676397018 [0,2,0,0,0,0|1,0,1]=4 6242 B8R1.18 N[C@@H]1CC(=O)OC1=O MCULE-1937927503 [0,2,0,0,0,0|1,0,1]=4 6243 B8R1.18 N[C@@H]1CC(=O)OC1=O MCULE-2080587685 [0,2,0,0,0,0|1,0,1]=4 6244 B8R1.18 N[C@@H]1CC(=O)OC1=O MCULE-8793349665 [0,2,0,0,0,0|1,0,1]=4 6245 B8R1.18 N[C@@H]1CC(=O)OC1=O MCULE-9640337170 [0,2,0,0,0,0|1,0,1]=4 6246 B8R1.18 N[C@@H]1C[C@@H]([C@@H](C1)O)O MCULE-1413629464 [0,2,0,0,0,0|0,0,2]=4 6247 B8R1.18 N[C@@H]1C[C@@H]([C@@H](C1)O)O MCULE-2282806557 [0,2,0,0,0,0|0,0,2]=4 6248 B8R1.18 N[C@H]1CC(=O)NC1=O MCULE-1052396743 [0,2,0,0,0,0|1,0,1]=4 6249 B8R1.18 N[C@H]1CC(=O)NC1=O MCULE-1965803095 [0,2,0,0,0,0|1,0,1]=4 6250 B8R1.18 N[C@H]1CC(=O)OC1=O MCULE-3191926438 [0,2,0,0,0,0|1,0,1]=4 6251 B8R1.18 N[C@H]1CC(=O)OC1=O MCULE-4503342222 [0,2,0,0,0,0|1,0,1]=4 6252 B8R1.18 N[C@H]1C[C@@H]([C@@H](C1)O)O MCULE-1533256813 [0,2,0,0,0,0|0,0,2]=4 6253 B8R1.18 N[C@H]1C[C@@H]([C@@H](C1)O)O MCULE-8968529452 [0,2,0,0,0,0|0,0,2]=4 6254 B8R1.18 O=C1NC(C(N1)O)O MCULE-4925329931 [0,2,0,0,0,0|2,0,0]=4 6255 B8R1.18 O=C1OC(C(O1)Cl)Cl MCULE-2346794223 [0,2,0,0,0,0|2,0,0]=4 6256 B8R1.18 O=C1O[C@@H]([C@H](O1)F)F MCULE-7614704509 [0,2,0,0,0,0|2,0,0]=4 6257 B8R1.50 CC1=C(C(=O)CC1)Br MCULE-4093496442 [0,2,0,0,0,0|0,0,2]=4 6258 B8R1.50 CC1=C(C(=O)CC1)C MCULE-6370073595 [0,2,0,0,0,0|0,0,2]=4 6259 B8R1.50 CC1=C(C(=O)CC1)O MCULE-2968247012 [0,2,0,0,0,0|0,0,2]=4 6260 B8R1.50 CC1=C(C(=O)CC1)O MCULE-9147894168 [0,2,0,0,0,0|0,0,2]=4 6261 B8R1.50 CC1=C(CCC1=O)O MCULE-6367252690 [0,2,0,0,0,0|0,0,2]=4 6262 B8R1.50 CC1C(=O)CCC1=O MCULE-4418458735 [0,2,0,0,0,0|0,0,1]=3 6263 B8R1.50 CC1C(=O)CCN1C MCULE-8191851293 [0,2,0,0,0,0|1,0,0]=3 6264 B8R1.50 CC1C(=O)COC1=O MCULE-4188541096 [0,2,0,0,0,0|1,0,1]=4 6265 B8R1.50 CC1C(CCN1C)N MCULE-9387568843 [0,2,0,0,0,0|2,0,0]=4 6266 B8R1.50 CC1CCC(=O)C1=O MCULE-7649396652 [0,2,0,0,0,0|0,0,1]=3 6267 B8R1.50 CC1CCC(=O)N1C MCULE-7405072604 [0,2,0,0,0,0|1,0,0]=3 6268 B8R1.50 CC1CCC(C1=O)C MCULE-1473375660 [0,2,0,0,0,0|0,0,0]=2 6269 B8R1.50 CC1CCC(C1N)C MCULE-5534270110 [0,2,0,0,0,0|1,0,1]=4 6270 B8R1.50 CC1CCC(C1N)C MCULE-9569539393 [0,2,0,0,0,0|1,0,1]=4 6271 B8R1.50 CC1CCC(C1O)O MCULE-3292232581 [0,2,0,0,0,0|0,0,2]=4 6272 B8R1.50 CC1CCN(C1=O)C MCULE-1499213360 [0,2,0,0,0,0|1,0,0]=3 6273 B8R1.50 CC1CNC(=O)C1C MCULE-7439537346 [0,2,0,0,0,0|1,0,0]=3 6274 B8R1.50 CC1NCN(C1=O)C MCULE-2390134887 [0,2,0,0,0,0|2,0,0]=4 6275 B8R1.50 CC1NCN(C1=O)C MCULE-7463423136 [0,2,0,0,0,0|2,0,0]=4 6276 B8R1.50 CC1OCC(=O)C1C MCULE-5834923125 [0,2,0,0,0,0|1,0,0]=3 6277 B8R1.50 CN1C(=O)CCC1=O MCULE-6726005566 [0,2,0,0,0,0|1,0,1]=4 6278 B8R1.50 CN1C(=O)CCC1O MCULE-1070053575 [0,2,0,0,0,0|1,0,0]=3 6279 B8R1.50 CN1CCC(=O)C1=O MCULE-7541521172 [0,2,0,0,0,0|1,0,1]=4 6280 B8R1.50 CN1CCC(C1=O)Br MCULE-9857530514 [0,2,0,0,0,0|1,0,0]=3 6281 B8R1.50 CN1CCC(C1=O)Cl MCULE-5732339719 [0,2,0,0,0,0|1,0,0]=3 6282 B8R1.50 CN1CCC(C1=O)N MCULE-2896853309 [0,2,0,0,0,0|1,0,0]=3 6283 B8R1.50 CN1CCC(C1=O)N MCULE-5951659989 [0,2,0,0,0,0|1,0,0]=3 6284 B8R1.50 CN1CCC(C1=O)O MCULE-6867263123 [0,2,0,0,0,0|1,0,0]=3 6285 B8R1.50 CN1CCN(C1=O)C MCULE-4012400107 [0,2,0,0,0,0|2,0,0]=4 6286 B8R1.50 CN1CC[C@@H](C1=O)N MCULE-3820062607 [0,2,0,0,0,0|1,0,0]=3 6287 B8R1.50 CN1CC[C@@H](C1=O)N MCULE-7270649984 [0,2,0,0,0,0|1,0,0]=3 6288 B8R1.50 CN1CC[C@@H](C1=O)N MCULE-8015311112 [0,2,0,0,0,0|1,0,0]=3 6289 B8R1.50 CN1CC[C@H](C1=O)N MCULE-1278006515 [0,2,0,0,0,0|1,0,0]=3 6290 B8R1.50 CN1CC[C@H](C1=O)N MCULE-3751335664 [0,2,0,0,0,0|1,0,0]=3 6291 B8R1.50 CN1CC[C@H](C1=O)N MCULE-4883949932 [0,2,0,0,0,0|1,0,0]=3 6292 B8R1.50 CN1CC[C@H](C1=O)N MCULE-7143065464 [0,2,0,0,0,0|1,0,0]=3 6293 B8R1.50 NC1CCC(C1O)O MCULE-2902511864 [0,2,0,0,0,0|0,0,2]=4 6294 B8R1.50 NC1CCC(C1O)O MCULE-2997796956 [0,2,0,0,0,0|0,0,2]=4 6295 B8R1.50 NC1CCN(C1=O)O MCULE-3774736319 [0,2,0,0,0,0|1,0,0]=3 6296 B8R1.50 NN1C(=O)CCC1=O MCULE-4432056181 [0,2,0,0,0,0|1,0,1]=4 6297 B8R1.50 NN1C(=O)CCC1=O MCULE-8224510852 [0,2,0,0,0,0|1,0,1]=4 6298 B8R1.50 N[C@@H]1C(=O)NC[C@H]1O MCULE-6840872048 [0,2,0,0,0,0|1,0,0]=3 6299 B8R1.50 N[C@@H]1CCN(C1=O)O MCULE-1260256164 [0,2,0,0,0,0|1,0,0]=3 6300 B8R1.50 N[C@@H]1CCN(C1=O)O MCULE-9067133595 [0,2,0,0,0,0|1,0,0]=3 6301 B8R1.50 N[C@@H]1CC[C@@H]([C@H]1O)O MCULE-4654712954 [0,2,0,0,0,0|0,0,2]=4 6302 B8R1.50 N[C@@H]1CC[C@@H]([C@H]1O)O MCULE-4756579413 [0,2,0,0,0,0|0,0,2]=4 6303 B8R1.50 N[C@@H]1CC[C@@H]([C@H]1O)O MCULE-5386854672 [0,2,0,0,0,0|0,0,2]=4 6304 B8R1.50 N[C@@H]1CC[C@@H]([C@H]1O)O MCULE-8517121727 [0,2,0,0,0,0|0,0,2]=4 6305 B8R1.50 N[C@@H]1CC[C@H]([C@@H]1O)O MCULE-1001347318 [0,2,0,0,0,0|0,0,2]=4 6306 B8R1.50 N[C@@H]1CC[C@H]([C@@H]1O)O MCULE-3161518566 [0,2,0,0,0,0|0,0,2]=4 6307 B8R1.50 N[C@@H]1CC[C@H]([C@@H]1O)O MCULE-8097854840 [0,2,0,0,0,0|0,0,2]=4 6308 B8R1.50 N[C@@H]1CC[C@H]([C@@H]1O)O MCULE-9614047785 [0,2,0,0,0,0|0,0,2]=4 6309 B8R1.50 N[C@@H]1CC[C@H]([C@H]1O)O MCULE-3397642974 [0,2,0,0,0,0|0,0,2]=4 6310 B8R1.50 N[C@@H]1CC[C@H]([C@H]1O)O MCULE-5620525999 [0,2,0,0,0,0|0,0,2]=4 6311 B8R1.50 N[C@@H]1CC[C@H]([C@H]1O)O MCULE-8393185418 [0,2,0,0,0,0|0,0,2]=4 6312 B8R1.50 N[C@@H]1CC[C@H]([C@H]1O)O MCULE-9763920178 [0,2,0,0,0,0|0,0,2]=4 6313 B8R1.50 N[C@H]1CCN(C1=O)O MCULE-1056806464 [0,2,0,0,0,0|1,0,0]=3 6314 B8R1.50 O=C1CCC(=C1F)O MCULE-4719137849 [0,2,0,0,0,0|0,0,2]=4 6315 B8R1.50 O=C1CCC(=O)C1Br MCULE-7463233898 [0,2,0,0,0,0|0,0,1]=3 6316 B8R1.50 O=C1CCC(=O)C1Cl MCULE-9440848782 [0,2,0,0,0,0|0,0,1]=3 6317 B8R1.50 O=C1CCC(=O)N1Br MCULE-6561724377 [0,2,0,0,0,0|1,0,1]=4 6318 B8R1.50 O=C1CCC(=O)N1Cl MCULE-3093539402 [0,2,0,0,0,0|1,0,1]=4 6319 B8R1.50 O=C1CCC(=O)N1I MCULE-8261967194 [0,2,0,0,0,0|1,0,1]=4 6320 B8R1.50 O=C1CCC(=O)N1O MCULE-5478278340 [0,2,0,0,0,0|1,0,1]=4 6321 B8R1.50 O=C1COC(=O)C1Br MCULE-7458581655 [0,2,0,0,0,0|1,0,1]=4 6322 B8R1.50 O=C1COC(=O)C1Cl MCULE-1326411169 [0,2,0,0,0,0|1,0,1]=4 6323 B8R1.50 O=C1OCC(C1O)O MCULE-9766741798 [0,2,0,0,0,0|1,0,0]=3 6324 B8R1.50 O=C1OC[C@@H]([C@@H]1Br)O MCULE-5447777048 [0,2,0,0,0,0|1,0,0]=3 6325 B8R1.50 O=C1OC[C@@H]([C@@H]1Br)O MCULE-8691985034 [0,2,0,0,0,0|1,0,0]=3 6326 B8R1.50 O=C1OC[C@@H]([C@@H]1O)O MCULE-8629460196 [0,2,0,0,0,0|1,0,0]=3 6327 B8R1.50 O=C1OC[C@@H]([C@H]1O)O MCULE-7303431003 [0,2,0,0,0,0|1,0,0]=3 6328 B8R1.50 O=C1OC[C@H]([C@H]1O)O MCULE-4704805755 [0,2,0,0,0,0|1,0,0]=3 6329 B8R1.50 O=C1OC[C@H]([C@H]1O)O MCULE-7070309718 [0,2,0,0,0,0|1,0,0]=3 6330 B8R1.50 O=C1OC[C@H]([C@H]1O)O MCULE-7824820688 [0,2,0,0,0,0|1,0,0]=3 6331 B8R1.51 C1(CCC(C1)(F)F)N MCULE-1040735912 [0,2,0,0,0,0|1,0,1]=4 6332 B8R1.51 C1(CCC(C1)(F)F)N MCULE-4696917368 [0,2,0,0,0,0|1,0,1]=4 6333 B8R1.51 CC1(C=CC(=O)C1)C MCULE-2691948275 [0,2,0,0,0,0|0,0,2]=4 6334 B8R1.51 CC1(CC(=O)CN1)C MCULE-3002354818 [0,2,0,0,0,0|1,0,0]=3 6335 B8R1.51 CC1(CC(=O)CO1)C MCULE-3813236339 [0,2,0,0,0,0|1,0,0]=3 6336 B8R1.51 CC1(CC(=O)CS1)C MCULE-8119393989 [0,2,0,0,0,0|1,0,0]=3 6337 B8R1.51 CC1(CC(=O)NN1)C MCULE-3949987986 [0,2,0,0,0,0|2,0,0]=4 6338 B8R1.51 CC1(CC(=O)NO1)C MCULE-2107007864 [0,2,0,0,0,0|2,0,0]=4 6339 B8R1.51 CC1(CCC(=O)C1)C MCULE-9814375082 [0,2,0,0,0,0|0,0,0]=2 6340 B8R1.51 CC1(CCC(=O)N1)C MCULE-2538104334 [0,2,0,0,0,0|1,0,0]=3 6341 B8R1.51 CC1(CCC(=O)O1)C MCULE-3069658569 [0,2,0,0,0,0|1,0,0]=3 6342 B8R1.51 CC1(CCC(C1)Br)C MCULE-7648461165 [0,2,0,0,0,0|1,0,1]=4 6343 B8R1.51 CC1(CCC(C1)N)C MCULE-1462634969 [0,2,0,0,0,0|1,0,1]=4 6344 B8R1.51 CC1(CCC(C1)N)C MCULE-7718074169 [0,2,0,0,0,0|1,0,1]=4 6345 B8R1.51 CC1(CCC(C1)N)O MCULE-2662110764 [0,2,0,0,0,0|0,0,2]=4 6346 B8R1.51 CC1(CCC(C1)N)O MCULE-8421528641 [0,2,0,0,0,0|0,0,2]=4 6347 B8R1.51 CC1(CCC(C1)O)N MCULE-1629381772 [0,2,0,0,0,0|0,0,2]=4 6348 B8R1.51 CC1(CN=C(C1)N)C MCULE-2728105590 [0,2,0,0,0,0|2,0,0]=4 6349 B8R1.51 CC1(CN=C(C1)N)C MCULE-9014086278 [0,2,0,0,0,0|2,0,0]=4 6350 B8R1.51 CC1(CNC(=O)C1)C MCULE-1184902754 [0,2,0,0,0,0|1,0,0]=3 6351 B8R1.51 CC1(CNC(=O)C1)O MCULE-3317128471 [0,2,0,0,0,0|1,0,0]=3 6352 B8R1.51 CC1(CNC(=O)N1)C MCULE-2885809296 [0,2,0,0,0,0|2,0,0]=4 6353 B8R1.51 CC1(CNC(=O)O1)C MCULE-9188826896 [0,2,0,0,0,0|2,0,0]=4 6354 B8R1.51 CC1(COC(=O)C1)C MCULE-2810911497 [0,2,0,0,0,0|1,0,0]=3 6355 B8R1.51 CC1(COC(=O)N1)C MCULE-9709457440 [0,2,0,0,0,0|2,0,0]=4 6356 B8R1.51 CC1(NCC(=O)N1)C MCULE-4375597060 [0,2,0,0,0,0|2,0,0]=4 6357 B8R1.51 CC1(OCC(=O)O1)C MCULE-5121540413 [0,2,0,0,0,0|2,0,0]=4 6358 B8R1.51 CC1CCC(C1)(C)O MCULE-5369529521 [0,2,0,0,0,0|0,0,2]=4 6359 B8R1.51 CC1CCS(=O)(=O)C1 MCULE-8205416735 [0,2,0,0,0,0|1,0,0]=3 6360 B8R1.51 CC1CCS(=O)(=O)N1 MCULE-7593233575 [0,2,0,0,0,0|2,0,0]=4 6361 B8R1.51 CC1CCS(=O)(=O)O1 MCULE-3194494728 [0,2,0,0,0,0|2,0,0]=4 6362 B8R1.51 CC1CNS(=O)(=O)C1 MCULE-2299608411 [0,2,0,0,0,0|2,0,0]=4 6363 B8R1.51 CC1COS(=O)(=O)C1 MCULE-3208476537 [0,2,0,0,0,0|2,0,0]=4 6364 B8R1.51 CN1CCC(C1)(C)C MCULE-4501256940 [0,2,0,0,0,0|2,0,0]=4 6365 B8R1.51 CN1CCC(C1)(C)N MCULE-2137989070 [0,2,0,0,0,0|2,0,0]=4 6366 B8R1.51 CN1CCC(C1)(C)N MCULE-6642743142 [0,2,0,0,0,0|2,0,0]=4 6367 B8R1.51 CP1(=O)CCC(=O)O1 MCULE-3689691243 [0,2,0,0,0,0|2,0,0]=4 6368 B8R1.51 CP1(=S)CCC(C1)Cl MCULE-4725605003 [0,2,0,0,0,0|1,1,0]=4 6369 B8R1.51 C[C@]1(CC[C@@H](C1)N)O MCULE-4320731186 [0,2,0,0,0,0|0,0,2]=4 6370 B8R1.51 FC1(CCC(C1)Br)F MCULE-3035088076 [0,2,0,0,0,0|1,0,1]=4 6371 B8R1.51 NC1CCC(C1)(F)F MCULE-1693711411 [0,2,0,0,0,0|1,0,1]=4 6372 B8R1.51 NC1CCC(C1)(F)F MCULE-2855930331 [0,2,0,0,0,0|1,0,1]=4 6373 B8R1.51 NC1CCS(=O)(=O)C1 MCULE-3664794949 [0,2,0,0,0,0|1,0,0]=3 6374 B8R1.51 NC1CCS(=O)(=O)C1 MCULE-4987844102 [0,2,0,0,0,0|1,0,0]=3 6375 B8R1.51 NC1CCS(=O)(=O)C1 MCULE-6173061448 [0,2,0,0,0,0|1,0,0]=3 6376 B8R1.51 NC1CCS(=O)(=O)C1 MCULE-8024346240 [0,2,0,0,0,0|1,0,0]=3 6377 B8R1.51 N[C@@H]1CCC(C1)(F)F MCULE-4293460952 [0,2,0,0,0,0|1,0,1]=4 6378 B8R1.51 N[C@@H]1CCC(C1)(F)F MCULE-5344695629 [0,2,0,0,0,0|1,0,1]=4 6379 B8R1.51 N[C@@H]1CCC(C1)(F)F MCULE-5693318207 [0,2,0,0,0,0|1,0,1]=4 6380 B8R1.51 N[C@@H]1CCC(C1)(F)F MCULE-6139267391 [0,2,0,0,0,0|1,0,1]=4 6381 B8R1.51 N[C@@H]1CCS(=O)(=O)C1 MCULE-5491077502 [0,2,0,0,0,0|1,0,0]=3 6382 B8R1.51 N[C@@H]1CCS(=O)(=O)C1 MCULE-6127452891 [0,2,0,0,0,0|1,0,0]=3 6383 B8R1.51 N[C@@H]1CCS(=O)(=O)C1 MCULE-8245544049 [0,2,0,0,0,0|1,0,0]=3 6384 B8R1.51 N[C@@H]1CCS(=O)(=O)C1 MCULE-8690512997 [0,2,0,0,0,0|1,0,0]=3 6385 B8R1.51 N[C@H]1CCC(C1)(F)F MCULE-3924286835 [0,2,0,0,0,0|1,0,1]=4 6386 B8R1.51 N[C@H]1CCC(C1)(F)F MCULE-6712377146 [0,2,0,0,0,0|1,0,1]=4 6387 B8R1.51 N[C@H]1CCC(C1)(F)F MCULE-8211324254 [0,2,0,0,0,0|1,0,1]=4 6388 B8R1.51 N[C@H]1CCC(C1)(F)F MCULE-8880305459 [0,2,0,0,0,0|1,0,1]=4 6389 B8R1.51 N[C@H]1CCS(=O)(=O)C1 MCULE-2755321215 [0,2,0,0,0,0|1,0,0]=3 6390 B8R1.51 N[C@H]1CCS(=O)(=O)C1 MCULE-3468273378 [0,2,0,0,0,0|1,0,0]=3 6391 B8R1.51 N[C@H]1CCS(=O)(=O)C1 MCULE-7343668152 [0,2,0,0,0,0|1,0,0]=3 6392 B8R1.51 N[C@H]1CCS(=O)(=O)C1 MCULE-9897703297 [0,2,0,0,0,0|1,0,0]=3 6393 B8R1.51 O=C1CC(CN1)(F)F MCULE-5899183897 [0,2,0,0,0,0|1,0,0]=3 6394 B8R1.51 O=C1CCS(=O)(=O)C1 MCULE-8153139552 [0,2,0,0,0,0|1,0,0]=3 6395 B8R1.51 O=C1CCS(=O)(=O)N1 MCULE-4505524753 [0,2,0,0,0,0|2,0,0]=4 6396 B8R1.51 O=C1CCS(=O)(=O)O1 MCULE-1696670151 [0,2,0,0,0,0|2,0,0]=4 6397 B8R1.51 O=S1(=O)CC(CO1)Br MCULE-9410616687 [0,2,0,0,0,0|2,0,0]=4 6398 B8R1.51 O=S1(=O)CCC(C1)Br MCULE-7705924050 [0,2,0,0,0,0|1,0,0]=3 6399 B8R1.51 O=S1(=O)CCC(C1)Cl MCULE-6623260684 [0,2,0,0,0,0|1,0,0]=3 6400 B8R1.51 O=S1(=O)CCC(C1)I MCULE-8157194528 [0,2,0,0,0,0|1,0,0]=3 6401 B8R1.51 O=S1(=O)CCC(C1)O MCULE-3784616685 [0,2,0,0,0,0|1,0,0]=3 6402 B8R1.51 O=S1(=O)CCC(C1)S MCULE-5583339693 [0,2,0,0,0,0|1,0,0]=3 6403 B8R1.51 O=S1(=O)CCC(O1)F MCULE-7853949290 [0,2,0,0,0,0|2,0,0]=4 6404 B8R1.51 OC1CCC(C1)(F)F MCULE-1999450750 [0,2,0,0,0,0|0,0,2]=4 6405 B8R1.51 O[C@@H]1CCC(C1)(F)F MCULE-1706759710 [0,2,0,0,0,0|0,0,2]=4 6406 B8R1.51 O[C@H]1CCC(C1)(F)F MCULE-5850589839 [0,2,0,0,0,0|0,0,2]=4 6407 B8R1.51 O[C@H]1CCC(C1)(F)F MCULE-8927166685 [0,2,0,0,0,0|0,0,2]=4 6408 B8R1.51 [NH3+]C1CCS(=O)(=O)C1 MCULE-9144849902 [0,2,0,0,0,0|1,0,0]=3 6409 B8R1.19 C=C1CCCS1(=O)=O MCULE-5480529825 [0,2,0,0,0,0|1,0,1]=4 6410 B8R1.19 CC1(CC=CC1=O)C MCULE-5478168383 [0,2,0,0,0,0|0,0,2]=4 6411 B8R1.19 CC1(CCC=N1=O)C MCULE-3270262370 [0,2,0,0,0,0|1,0,1]=4 6412 B8R1.19 CC1(CCCC1=O)C MCULE-2010694408 [0,2,0,0,0,0|0,0,0]=2 6413 B8R1.19 CC1(CCCC1=O)F MCULE-5382994089 [0,2,0,0,0,0|0,0,0]=2 6414 B8R1.19 CC1(CCCC1Br)C MCULE-7575471396 [0,2,0,0,0,0|1,0,1]=4 6415 B8R1.19 CC1(CCCC1N)C MCULE-5921379560 [0,2,0,0,0,0|1,0,1]=4 6416 B8R1.19 CC1(CCCC1N)C MCULE-8867080038 [0,2,0,0,0,0|1,0,1]=4 6417 B8R1.19 CC1(CCCC1N)O MCULE-3396541731 [0,2,0,0,0,0|0,0,2]=4 6418 B8R1.19 CC1(CCCC1O)C MCULE-4878410443 [0,2,0,0,0,0|0,0,2]=4 6419 B8R1.19 CC1(CCCC1O)O MCULE-7509860049 [0,2,0,0,0,0|0,0,2]=4 6420 B8R1.19 CC1(CCC[C@@H]1N)C MCULE-2097025606 [0,2,0,0,0,0|1,0,1]=4 6421 B8R1.19 CC1(CCC[C@@H]1O)C MCULE-9402548740 [0,2,0,0,0,0|0,0,2]=4 6422 B8R1.19 CC1(CCC[C@H]1O)C MCULE-3856604720 [0,2,0,0,0,0|0,0,2]=4 6423 B8R1.19 CC1(CCN=C1S)C MCULE-9605141691 [0,2,0,0,0,0|1,1,0]=4 6424 B8R1.19 CC1(CCNC1=O)C MCULE-6714447777 [0,2,0,0,0,0|1,0,0]=3 6425 B8R1.19 CC1(CCNC1=O)C MCULE-7206545498 [0,2,0,0,0,0|1,0,0]=3 6426 B8R1.19 CC1(CCNC1=O)N MCULE-2999548291 [0,2,0,0,0,0|1,0,0]=3 6427 B8R1.19 CC1(CCNC1=O)O MCULE-2802989638 [0,2,0,0,0,0|1,0,0]=3 6428 B8R1.19 CC1(CCOC1=O)Br MCULE-3061445898 [0,2,0,0,0,0|1,0,0]=3 6429 B8R1.19 CC1(CCOC1=O)C MCULE-4294599964 [0,2,0,0,0,0|1,0,0]=3 6430 B8R1.19 CC1(CCOC1=O)N MCULE-5332143573 [0,2,0,0,0,0|1,0,0]=3 6431 B8R1.19 CC1(CCOC1=O)N MCULE-6557455932 [0,2,0,0,0,0|1,0,0]=3 6432 B8R1.19 CC1(COCC1=O)C MCULE-8148059071 [0,2,0,0,0,0|1,0,0]=3 6433 B8R1.19 CC1(CONC1=O)C MCULE-5889106208 [0,2,0,0,0,0|2,0,0]=4 6434 B8R1.19 CC1(NCCC1=O)C MCULE-1973849102 [0,2,0,0,0,0|1,0,0]=3 6435 B8R1.19 CC1(NCCC1=O)C MCULE-6763568764 [0,2,0,0,0,0|1,0,0]=3 6436 B8R1.19 CC1(OCCC1=O)C MCULE-3204846453 [0,2,0,0,0,0|1,0,0]=3 6437 B8R1.19 CC1CCCS1(=O)=O MCULE-2985632984 [0,2,0,0,0,0|1,0,0]=3 6438 B8R1.19 CC1CCNS1(=O)=O MCULE-1254365357 [0,2,0,0,0,0|2,0,0]=4 6439 B8R1.19 CC1CCOS1(=O)=O MCULE-6608589153 [0,2,0,0,0,0|2,0,0]=4 6440 B8R1.19 CN1CCCS1(=O)=O MCULE-2950650087 [0,2,0,0,0,0|2,0,0]=4 6441 B8R1.19 C[C@@]1(CCC[C@@H]1N)O MCULE-4508286005 [0,2,0,0,0,0|0,0,2]=4 6442 B8R1.19 C[C@@]1(CCC[C@@H]1N)O MCULE-9668737274 [0,2,0,0,0,0|0,0,2]=4 6443 B8R1.19 C[C@@]1(CCC[C@H]1N)O MCULE-2369187970 [0,2,0,0,0,0|0,0,2]=4 6444 B8R1.19 C[C@]1(CCC[C@@H]1N)O MCULE-2644040109 [0,2,0,0,0,0|0,0,2]=4 6445 B8R1.19 C[C@]1(CCC[C@H]1N)O MCULE-2446086306 [0,2,0,0,0,0|0,0,2]=4 6446 B8R1.19 C[C@]1(CCC[C@H]1N)O MCULE-8959851594 [0,2,0,0,0,0|0,0,2]=4 6447 B8R1.19 C[C@]1(CCC[C@H]1N)O MCULE-9937788175 [0,2,0,0,0,0|0,0,2]=4 6448 B8R1.19 FC1(CCCC1Br)F MCULE-5918345451 [0,2,0,0,0,0|1,0,1]=4 6449 B8R1.19 NC1CCCC1(F)F MCULE-4099935690 [0,2,0,0,0,0|1,0,1]=4 6450 B8R1.19 NC1CCCC1(F)F MCULE-5850247735 [0,2,0,0,0,0|1,0,1]=4 6451 B8R1.19 O=C1CCCC1(F)F MCULE-7191261042 [0,2,0,0,0,0|0,0,0]=2 6452 B8R1.19 O=C1CNCC1(F)F MCULE-3134434071 [0,2,0,0,0,0|1,0,0]=3 6453 B8R1.19 O=C1CNCC1(F)F MCULE-3329672163 [0,2,0,0,0,0|1,0,0]=3 6454 B8R1.19 O=C1NCCC1(F)F MCULE-6135502988 [0,2,0,0,0,0|1,0,0]=3 6455 B8R1.19 OC1CCCC1(F)F MCULE-8959457751 [0,2,0,0,0,0|0,0,2]=4 6456 B6R1.3 CCCC1CO1 MCULE-5080039224 [0,0,1,1,0,0|0,0,2]=4 6457 B6R1.3 CCC[C@@H]1CO1 MCULE-1815222100 [0,0,1,1,0,0|0,0,2]=4 6458 B6R1.3 CCC[C@H]1CO1 MCULE-9952368131 [0,0,1,1,0,0|0,0,2]=4 6459 B6R1.8 C=C1CC1CO MCULE-4338601055 [0,0,1,1,0,0|2,0,0]=4 6460 B6R1.8 CCC1CC1N MCULE-6304873051 [0,0,1,1,0,0|1,0,1]=4 6461 B6R1.8 CC[C@@H]1C[C@@H]1N MCULE-9218626187 [0,0,1,1,0,0|1,0,1]=4 6462 B6R1.8 CC[C@@H]1C[C@H]1N MCULE-5365117215 [0,0,1,1,0,0|1,0,1]=4 6463 B6R1.8 CC[C@@H]1C[C@H]1N MCULE-9993971387 [0,0,1,1,0,0|1,0,1]=4 6464 B6R1.8 CC[C@H]1C[C@@H]1N MCULE-5971477946 [0,0,1,1,0,0|1,0,1]=4 6465 B6R1.8 CC[C@H]1C[C@H]1N MCULE-4387456908 [0,0,1,1,0,0|1,0,1]=4 6466 B6R1.9 CC1CC1(C)N MCULE-2748884505 [0,0,1,1,0,0|1,0,1]=4 6467 B6R1.9 CC1CC1(C)N MCULE-6309103404 [0,0,1,1,0,0|1,0,1]=4 6468 B6R1.11 C=C(C)C1CO1 MCULE-3656533343 [0,0,1,1,0,0|2,0,0]=4 6469 B6R1.11 CC(=O)C1CC1 MCULE-3846146416 [0,0,1,1,0,0|0,0,0]=2 6470 B6R1.11 CC(=O)C1CO1 MCULE-4329154079 [0,0,1,1,0,0|1,0,0]=3 6471 B6R1.11 CC(Cl)C1CC1 MCULE-7361335709 [0,0,1,1,0,0|1,0,1]=4 6472 B6R1.11 CC(N)C1CC1 MCULE-2052303800 [0,0,1,1,0,0|1,0,1]=4 6473 B6R1.11 CC(N)C1CC1 MCULE-3007763115 [0,0,1,1,0,0|1,0,1]=4 6474 B6R1.11 CC(N)C1CC1 MCULE-3459276996 [0,0,1,1,0,0|1,0,1]=4 6475 B6R1.11 CC(N)C1CC1 MCULE-6761961556 [0,0,1,1,0,0|1,0,1]=4 6476 B6R1.11 CC(O)C1CC1 MCULE-8628810684 [0,0,1,1,0,0|0,0,2]=4 6477 B6R1.11 CN(C)C1CC1 MCULE-5891640069 [0,0,1,1,0,0|2,0,0]=4 6478 B6R1.11 CN(C)C1CC1 MCULE-6751529979 [0,0,1,1,0,0|2,0,0]=4 6479 B6R1.11 CN(N)C1CC1 MCULE-4590166937 [0,0,1,1,0,0|2,0,0]=4 6480 B6R1.11 CN(N)C1CC1 MCULE-7317282450 [0,0,1,1,0,0|2,0,0]=4 6481 B6R1.11 C[C@@H](N)C1CC1 MCULE-2097889079 [0,0,1,1,0,0|1,0,1]=4 6482 B6R1.11 C[C@@H](N)C1CC1 MCULE-3667125695 [0,0,1,1,0,0|1,0,1]=4 6483 B6R1.11 C[C@@H](N)C1CC1 MCULE-4529741221 [0,0,1,1,0,0|1,0,1]=4 6484 B6R1.11 C[C@@H](N)C1CC1 MCULE-4996656085 [0,0,1,1,0,0|1,0,1]=4 6485 B6R1.11 C[C@@H](O)C1CC1 MCULE-8359847821 [0,0,1,1,0,0|0,0,2]=4 6486 B6R1.11 C[C@H](N)C1CC1 MCULE-5080052640 [0,0,1,1,0,0|1,0,1]=4 6487 B6R1.11 C[C@H](N)C1CC1 MCULE-8331040870 [0,0,1,1,0,0|1,0,1]=4 6488 B6R1.11 C[C@H](N)C1CC1 MCULE-8367240790 [0,0,1,1,0,0|1,0,1]=4 6489 B6R1.11 C[C@H](N)C1CC1 MCULE-8726268701 [0,0,1,1,0,0|1,0,1]=4 6490 B6R1.11 C[C@H](O)C1CC1 MCULE-2458075152 [0,0,1,1,0,0|0,0,2]=4 6491 B6R1.11 N=C(N)C1CC1 MCULE-1244673727 [0,0,1,1,0,0|2,0,0]=4 6492 B6R1.11 N=C(N)C1CC1 MCULE-2494860413 [0,0,1,1,0,0|2,0,0]=4 6493 B6R1.11 NC(=O)C1CC1 MCULE-9911054913 [0,0,1,1,0,0|1,0,0]=3 6494 B6R1.11 NC(=O)C1CO1 MCULE-6911744868 [0,0,1,1,0,0|2,0,0]=4 6495 B6R1.11 NC(=S)C1CC1 MCULE-7304936539 [0,0,1,1,0,0|1,1,0]=4 6496 B6R1.11 O=C(Cl)C1CC1 MCULE-8675746452 [0,0,1,1,0,0|1,0,0]=3 6497 B6R1.11 O=C(O)C1CC1 MCULE-4677373694 [0,0,1,1,0,0|1,0,0]=3 6498 B6R1.11 O=C(O)C1CN1 MCULE-3236125597 [0,0,1,1,0,0|2,0,0]=4 6499 B6R1.11 O=C(O)C1CO1 MCULE-2152916793 [0,0,1,1,0,0|2,0,0]=4 6500 B6R1.11 O=C(O)[C@@H]1CN1 MCULE-4363753412 [0,0,1,1,0,0|2,0,0]=4 6501 B6R1.11 O=C(O)[C@H]1CN1 MCULE-4830347195 [0,0,1,1,0,0|2,0,0]=4 6502 B6R1.11 O=C(O)[C@H]1CO1 MCULE-5204459723 [0,0,1,1,0,0|2,0,0]=4 6503 B6R1.11 O=C(O)[C@H]1CO1 MCULE-6983707093 [0,0,1,1,0,0|2,0,0]=4 6504 B6R1.11 O=C([O-])C1CN1 MCULE-6490437892 [0,0,1,1,0,0|2,0,0]=4 6505 B6R1.11 O=C([O-])C1CO1 MCULE-4586459966 [0,0,1,1,0,0|2,0,0]=4 6506 B6R1.11 O=C([O-])[C@@H]1CO1 MCULE-1647975669 [0,0,1,1,0,0|2,0,0]=4 6507 B6R1.11 O=C([O-])[C@@H]1CO1 MCULE-1906997950 [0,0,1,1,0,0|2,0,0]=4 6508 B6R1.11 O=C([O-])[C@@H]1CO1 MCULE-4899800766 [0,0,1,1,0,0|2,0,0]=4 6509 B6R1.11 O=C([O-])[C@@H]1CO1 MCULE-9148170094 [0,0,1,1,0,0|2,0,0]=4 6510 B6R1.11 O=C([O-])[C@H]1CO1 MCULE-6663734494 [0,0,1,1,0,0|2,0,0]=4 6511 B6R1.11 O=C([O-])[C@H]1CO1 MCULE-8580451361 [0,0,1,1,0,0|2,0,0]=4 6512 B6R1.11 O=S(O)C1CC1 MCULE-1616243918 [0,0,1,1,0,0|2,0,0]=4 6513 B6R1.11 O=S([O-])C1CC1 MCULE-9446364072 [0,0,1,1,0,0|2,0,0]=4 6514 B6R1.1 C1=CCCCC1 MCULE-3564016252 [0,0,1,1,0,0|1,0,0]=3 6515 B6R1.1 C1=CCNCC1 MCULE-4850984502 [0,0,1,1,0,0|2,0,0]=4 6516 B6R1.1 C1=CCNCC1 MCULE-9744767398 [0,0,1,1,0,0|2,0,0]=4 6517 B6R1.1 C1=CCOCC1 MCULE-7723901693 [0,0,1,1,0,0|2,0,0]=4 6518 B6R1.1 C1=COCCC1 MCULE-1260841717 [0,0,1,1,0,0|0,0,2]=4 6519 B6R1.1 C1=NCCCC1 MCULE-7101012273 [0,0,1,1,0,0|1,0,0]=3 6520 B6R1.1 C1=NCCCN1 MCULE-8199642953 [0,0,1,1,0,0|2,0,0]=4 6521 B6R1.1 C1CCCCC1 MCULE-3136361765 [0,0,1,1,0,0|1,0,1]=4 6522 B6R1.1 C1CCNCC1 MCULE-4094049864 [0,0,1,1,0,0|1,0,1]=4 6523 B6R1.1 C1CCNNC1 MCULE-6440414301 [0,0,1,1,0,0|2,0,0]=4 6524 B6R1.1 C1CCNNC1 MCULE-6764314654 [0,0,1,1,0,0|2,0,0]=4 6525 B6R1.1 C1CCOCC1 MCULE-6904583049 [0,0,1,1,0,0|0,0,2]=4 6526 B6R1.1 C1CCONC1 MCULE-4106728300 [0,0,1,1,0,0|1,0,1]=4 6527 B6R1.1 C1CCONC1 MCULE-7653057344 [0,0,1,1,0,0|1,0,1]=4 6528 B6R1.1 C1CCSCC1 MCULE-5775966946 [0,0,1,1,0,0|0,1,1]=4 6529 B6R1.7 CCC1(CC1)N MCULE-3440893089 [0,0,1,1,0,0|1,0,1]=4 6530 B6R1.7 CCC1(CC1)N MCULE-8936334501 [0,0,1,1,0,0|1,0,1]=4 6531 B6R1.7 CCC1(CC1)O MCULE-7491011687 [0,0,1,1,0,0|0,0,2]=4 6532 B6R2.4 C1CC2C1O2 MCULE-9211083149 [1,0,0,1,0,0|1,0,0]=3 6533 B8R2.2 CC12CCCC1O2 MCULE-5518981528 [0,0,0,1,0,1|1,0,1]=4 6534 B8R2.2 CC12CNCC1C2 MCULE-2416306604 [0,0,0,1,0,1|1,0,1]=4 6535 B8R2.2 CC12CNCC1C2 MCULE-4789936643 [0,0,0,1,0,1|1,0,1]=4 6536 B8R2.2 OC12CNCC1C2 MCULE-4871733427 [0,0,0,1,0,1|0,0,2]=4 6537 B8R2.2 OC12CNCC1C2 MCULE-9523698203 [0,0,0,1,0,1|0,0,2]=4 6538 B8R2.11 BrC1C2C1COC2 MCULE-1630256442 [0,0,0,1,0,1|1,0,1]=4 6539 B8R2.11 BrC1[C@@H]2[C@@H]1COC2 MCULE-7319391941 [0,0,0,1,0,1|1,0,1]=4 6540 B8R2.11 CC1C2C1CNC2 MCULE-2169198931 [0,0,0,1,0,1|1,0,1]=4 6541 B8R2.11 CC1C2C1CNC2 MCULE-7517200698 [0,0,0,1,0,1|1,0,1]=4 6542 B8R2.11 NC1C2C1CCC2 MCULE-1115616280 [0,0,0,1,0,1|1,0,1]=4 6543 B8R2.11 NC1C2C1CCC2 MCULE-3027034147 [0,0,0,1,0,1|1,0,1]=4 6544 B8R2.11 NC1C2C1CNC2 MCULE-6249305893 [0,0,0,1,0,1|1,0,1]=4 6545 B8R2.11 NC1C2C1CNC2 MCULE-6319746034 [0,0,0,1,0,1|1,0,1]=4 6546 B8R2.11 NC1C2C1COC2 MCULE-3835102479 [0,0,0,1,0,1|1,0,1]=4 6547 B8R2.11 NC1C2C1COC2 MCULE-5514670346 [0,0,0,1,0,1|1,0,1]=4 6548 B8R2.11 NC1[C@@H]2[C@@H]1COC2 MCULE-7533585275 [0,0,0,1,0,1|1,0,1]=4 6549 B8R2.11 N[C@@H]1[C@@H]2[C@H]1COC2 MCULE-1164349211 [0,0,0,1,0,1|1,0,1]=4 6550 B8R2.11 N[C@@H]1[C@@H]2[C@H]1COC2 MCULE-8761714964 [0,0,0,1,0,1|1,0,1]=4 6551 B8R2.11 N[C@H]1[C@@H]2[C@H]1COC2 MCULE-6507860444 [0,0,0,1,0,1|1,0,1]=4 6552 B8R2.11 OC1C2C1CNC2 MCULE-4854043272 [0,0,0,1,0,1|0,0,2]=4 6553 B8R2.11 OC1C2C1CNC2 MCULE-5803407032 [0,0,0,1,0,1|0,0,2]=4 6554 B8R2.11 OC1C2C1CNC2 MCULE-7493725540 [0,0,0,1,0,1|0,0,2]=4 6555 B8R2.11 OC1C2C1COC2 MCULE-6659901259 [0,0,0,1,0,1|0,0,2]=4 6556 B8R2.11 [C@@H]1([C@H]2[C@@H]1CNC2)O MCULE-5453073893 [0,0,0,1,0,1|0,0,2]=4 6557 B8R2.11 [C@@H]1([C@H]2[C@@H]1CNC2)O MCULE-6755042962 [0,0,0,1,0,1|0,0,2]=4 6558 B8R2.11 [C@H]12COC[C@@H]1C2N MCULE-6858518472 [0,0,0,1,0,1|1,0,1]=4 6559 B8R2.11 [C@H]12COC[C@H]1[C@H]2N MCULE-9932243016 [0,0,0,1,0,1|1,0,1]=4 6560 B8R2.18 CN1CC2CC2C1 MCULE-2724053241 [0,0,0,1,0,1|2,0,0]=4 6561 B8R2.18 NC1CC2CC2C1 MCULE-3032680567 [0,0,0,1,0,1|1,0,1]=4 6562 B8R2.18 NC1CC2CC2C1 MCULE-9934458935 [0,0,0,1,0,1|1,0,1]=4 6563 B8R2.18 NC1CC2OC2C1 MCULE-9034620868 [0,0,0,1,0,1|1,0,1]=4 6564 B8R2.18 O=C1CC2CC2C1 MCULE-4411193370 [0,0,0,1,0,1|0,0,0]=2 6565 B8R2.18 O=C1CC2CC2N1 MCULE-6301280583 [0,0,0,1,0,1|0,0,0]=2 6566 B8R2.18 O=C1CC2OC2C1 MCULE-2497020989 [0,0,0,1,0,1|0,0,0]=2 6567 B8R2.18 O=C1C[C@@H]2C[C@@H]2C1 MCULE-3069760916 [0,0,0,1,0,1|0,0,0]=2 6568 B8R2.18 OC1CC2CC2C1 MCULE-8286897753 [0,0,0,1,0,1|0,0,2]=4 6569 B8R2.18 OC1C[C@@H]2C[C@H]2C1 MCULE-5372275932 [0,0,0,1,0,1|0,0,2]=4 6570 B8R2.18 [C@H]12C[C@@H](C[C@H]1C2)N MCULE-8411228973 [0,0,0,1,0,1|1,0,1]=4 6571 B8R2.18 [C@H]12C[C@@H](C[C@H]1C2)O MCULE-6709379275 [0,0,0,1,0,1|0,0,2]=4 6572 B8R2.18 [C@H]12C[C@H](C[C@H]1C2)O MCULE-6265084997 [0,0,0,1,0,1|0,0,2]=4 6573 B8R2.23 C1CC2CC(C1)N2 MCULE-2618982278 [0,0,0,1,0,1|1,0,1]=4 6574 B8R2.23 C1NCC2CC1C2 MCULE-3013400731 [0,0,0,1,0,1|1,0,1]=4 6575 B8R2.23 C1NCC2CC1C2 MCULE-5173851453 [0,0,0,1,0,1|1,0,1]=4 6576 B8R2.23 C1NCC2CC1N2 MCULE-2078319835 [0,0,0,1,0,1|1,0,1]=4 6577 B8R2.23 C1NCC2CC1N2 MCULE-8764528406 [0,0,0,1,0,1|1,0,1]=4 6578 B8R2.23 C1NCC2CC1O2 MCULE-3930964839 [0,0,0,1,0,1|0,0,2]=4 6579 B8R2.23 C1NCC2CC1O2 MCULE-6584286025 [0,0,0,1,0,1|0,0,2]=4 6580 B8R2.23 C1OCC2CC1N2 MCULE-3468077880 [0,0,0,1,0,1|1,0,1]=4 6581 B8R2.23 C1OCC2CC1N2 MCULE-6210778974 [0,0,0,1,0,1|1,0,1]=4 6582 B8R2.23 C1OCC2CC1N2 MCULE-6524524748 [0,0,0,1,0,1|1,0,1]=4 6583 B8R2.23 C1SCC2CC1N2 MCULE-5259589886 [0,0,0,1,0,1|1,0,1]=4 6584 B8R2.25 C1CC2CC2CN1 MCULE-7680612875 [0,0,0,1,0,1|1,0,1]=4 6585 B8R2.25 C1CC2CC2CN1 MCULE-9351306871 [0,0,0,1,0,1|1,0,1]=4 6586 B8R2.25 C1CC2OC2CN1 MCULE-5099290074 [0,0,0,1,0,1|0,0,2]=4 6587 B8R2.25 C1CC2OC2CN1 MCULE-7618321880 [0,0,0,1,0,1|0,0,2]=4 6588 B8R2.25 C1CC2OC2CO1 MCULE-4990291348 [0,0,0,1,0,1|0,0,2]=4 6589 B8R2.25 C1CCC2NC2C1 MCULE-9438389769 [0,0,0,1,0,1|1,0,1]=4 6590 B8R2.25 C1CCC2OC2C1 MCULE-1362146416 [0,0,0,1,0,1|0,0,2]=4 6591 B8R2.25 C1CCC2SC2C1 MCULE-9665134930 [0,0,0,1,0,1|0,1,1]=4 6592 B8R2.25 C1CNC2CC2C1 MCULE-6257575905 [0,0,0,1,0,1|1,0,1]=4 6593 B8R2.25 C1CNC2CC2C1 MCULE-8192804036 [0,0,0,1,0,1|1,0,1]=4 6594 B8R2.34 C12CCC(C1)CC2 MCULE-1355055086 [0,0,0,1,0,1|1,0,1]=4 6595 B8R2.34 C12CCC(N1)CC2 MCULE-1281306416 [0,0,0,1,0,1|1,0,1]=4 6596 B8R2.34 C12CCC(N1)CC2 MCULE-7971232384 [0,0,0,1,0,1|1,0,1]=4 6597 B8R2.34 C12CCC(O1)CC2 MCULE-3311907785 [0,0,0,1,0,1|0,0,2]=4 6598 B8R2.34 C1CC2CC1CN2 MCULE-3108846258 [0,0,0,1,0,1|1,0,1]=4 6599 B8R2.34 C1CC2CC1CN2 MCULE-9423533249 [0,0,0,1,0,1|1,0,1]=4 6600 B8R2.34 C1CC2CCC1C2 MCULE-4823835016 [0,0,0,1,0,1|1,0,1]=4 6601 B8R2.34 C1CC2CCC1N2 MCULE-3442591342 [0,0,0,1,0,1|1,0,1]=4 6602 B8R2.34 C1CC2CCC1N2 MCULE-6907063220 [0,0,0,1,0,1|1,0,1]=4 6603 B8R2.34 C1CC2CCC1O2 MCULE-2448969815 [0,0,0,1,0,1|0,0,2]=4 6604 B8R2.34 C1CN2CCC1C2 MCULE-2842080329 [0,0,0,1,0,1|1,0,1]=4 6605 B8R2.34 C1CN2CCC1C2 MCULE-4482053071 [0,0,0,1,0,1|1,0,1]=4 6606 B8R2.34 C1C[C@@H]2C[C@H]1CN2 MCULE-9652354064 [0,0,0,1,0,1|1,0,1]=4 6607 B8R2.34 [C@H]12CC[C@H](C1)CN2 MCULE-2608477156 [0,0,0,1,0,1|1,0,1]=4 6608 B8R2.34 [C@H]12CC[C@H](C1)CN2 MCULE-3717752357 [0,0,0,1,0,1|1,0,1]=4 6609 B8R2.34 [C@H]12CC[C@H](C1)NC2 MCULE-6796267590 [0,0,0,1,0,1|1,0,1]=4 6610 B8R2.34 [C@H]12CC[C@H](C1)NC2 MCULE-8206189991 [0,0,0,1,0,1|1,0,1]=4 6611 B8R2.38 NC1CCC2C1C2 MCULE-4902375424 [0,0,0,1,0,1|1,0,1]=4 6612 B8R2.38 NC1CCC2C1C2 MCULE-9059443543 [0,0,0,1,0,1|1,0,1]=4 6613 B8R2.38 O=C1CCC2C1C2 MCULE-4714285285 [0,0,0,1,0,1|0,0,0]=2 6614 B8R2.38 O=C1CCC2C1O2 MCULE-5532735099 [0,0,0,1,0,1|0,0,0]=2 6615 B8R2.38 O=C1CC[C@@H]2[C@H]1C2 MCULE-7728867768 [0,0,0,1,0,1|0,0,0]=2 6616 B8R2.38 O=C1CC[C@H]2[C@@H]1C2 MCULE-1007541778 [0,0,0,1,0,1|0,0,0]=2 6617 B8R2.38 O=C1CC[C@H]2[C@@H]1C2 MCULE-8077752466 [0,0,0,1,0,1|0,0,0]=2 6618 B8R2.38 O=C1NCC2C1C2 MCULE-5593114305 [0,0,0,1,0,1|0,0,0]=2 6619 B8R2.38 O=C1NC[C@H]2[C@@H]1C2 MCULE-6438081695 [0,0,0,1,0,1|0,0,0]=2 6620 B8R2.38 OC1CCC2C1C2 MCULE-7193372575 [0,0,0,1,0,1|0,0,2]=4 6621 B8R2.38 O[C@@H]1CC[C@@H]2[C@H]1C2 MCULE-5135101961 [0,0,0,1,0,1|0,0,2]=4 6622 B8R2.22 C1CC2CNC2C1 MCULE-9273643237 [0,1,0,1,0,0|1,0,1]=4 6623 B8R2.22 C1C[C@H]2CN[C@H]2C1 MCULE-5749283674 [0,1,0,1,0,0|1,0,1]=4 6624 B8R2.22 C1C[C@H]2CN[C@H]2C1 MCULE-6220828228 [0,1,0,1,0,0|1,0,1]=4 6625 B8R2.55 C1CCC2(C1)CO2 MCULE-3685762990 [0,1,0,1,0,0|0,0,2]=4 6626 B8R2.4 O=C1CC2CC1C2 MCULE-5372379094 [0,1,0,1,0,0|0,0,0]=2 6627 B8R2.7 NC12CCC(C1)C2 MCULE-6127979464 [0,1,0,1,0,0|1,0,1]=4 6628 B8R2.7 NC12CCC(C1)C2 MCULE-6156688419 [0,1,0,1,0,0|1,0,1]=4 6629 B4R1.1 C1CNC1 MCULE-2817120281 [1,0,0,0,1,0|1,0,0]=3 6630 B4R1.1 C1CNC1 MCULE-5348168818 [1,0,0,0,1,0|1,0,0]=3 6631 B4R1.1 C1COC1 MCULE-4105779148 [1,0,0,0,1,0|1,0,0]=3 6632 B4R1.1 C1CSC1 MCULE-2361125802 [1,0,0,0,1,0|1,0,0]=3 6633 B4R1.2 BrC1CC1 MCULE-3656295609 [0,0,0,0,2,0|1,0,1]=4 6634 B4R1.2 CC1CC1 MCULE-5909419916 [0,0,0,0,2,0|1,0,1]=4 6635 B4R1.2 IC1CC1 MCULE-6043109265 [0,0,0,0,2,0|1,0,1]=4 6636 B4R1.2 NC1CC1 MCULE-1933360330 [0,0,0,0,2,0|1,0,1]=4 6637 B4R1.2 NC1CC1 MCULE-6187070220 [0,0,0,0,2,0|1,0,1]=4 6638 B4R1.2 OC1CC1 MCULE-8237846154 [0,0,0,0,2,0|0,0,2]=4 6639 B4R1.2 SC1CC1 MCULE-1371610395 [0,0,0,0,2,0|0,1,1]=4 6640 B8R1.22 BrC1=CCCCCC1 MCULE-1629255872 [0,0,0,0,0,2|1,0,0]=3 6641 B8R1.22 BrC1C=CCCCC1 MCULE-3305569927 [0,0,0,0,0,2|1,0,1]=4 6642 B8R1.22 BrC1CCCCCC1 MCULE-4670856107 [0,0,0,0,0,2|1,0,1]=4 6643 B8R1.22 BrC1CCCOCC1 MCULE-4342557066 [0,0,0,0,0,2|1,0,1]=4 6644 B8R1.22 C=C1CCCNCC1 MCULE-2798255197 [0,0,0,0,0,2|1,0,0]=3 6645 B8R1.22 C=C1CCCNCC1 MCULE-4874852480 [0,0,0,0,0,2|1,0,0]=3 6646 B8R1.22 C=C1CNCCOC1 MCULE-6114191545 [0,0,0,0,0,2|1,0,0]=3 6647 B8R1.22 C=C1CNCCOC1 MCULE-6722705565 [0,0,0,0,0,2|1,0,0]=3 6648 B8R1.22 C=C1COCCOC1 MCULE-3194930888 [0,0,0,0,0,2|1,0,0]=3 6649 B8R1.22 C=C1OCCCCO1 MCULE-8283334358 [0,0,0,0,0,2|1,0,0]=3 6650 B8R1.22 CC1CCCCCN1 MCULE-2095896439 [0,0,0,0,0,2|1,0,1]=4 6651 B8R1.22 CC1CCCCCN1 MCULE-5848089936 [0,0,0,0,0,2|1,0,1]=4 6652 B8R1.22 CC1CCCCNC1 MCULE-4872471007 [0,0,0,0,0,2|1,0,1]=4 6653 B8R1.22 CC1CCCCNC1 MCULE-6320007925 [0,0,0,0,0,2|1,0,1]=4 6654 B8R1.22 CC1CCCNCC1 MCULE-1361067252 [0,0,0,0,0,2|1,0,1]=4 6655 B8R1.22 CC1CCCNCC1 MCULE-8866871990 [0,0,0,0,0,2|1,0,1]=4 6656 B8R1.22 CC1CCNCCN1 MCULE-2481820949 [0,0,0,0,0,2|1,0,1]=4 6657 B8R1.22 CC1CCNCCN1 MCULE-6114208492 [0,0,0,0,0,2|1,0,1]=4 6658 B8R1.22 CC1CCNCCS1 MCULE-7102025211 [0,0,0,0,0,2|1,0,1]=4 6659 B8R1.22 CC1CCOCCN1 MCULE-5979047775 [0,0,0,0,0,2|1,0,1]=4 6660 B8R1.22 CC1CCOCCN1 MCULE-7762447328 [0,0,0,0,0,2|1,0,1]=4 6661 B8R1.22 CC1CCSCCN1 MCULE-1424931121 [0,0,0,0,0,2|1,0,1]=4 6662 B8R1.22 CC1CCSCCN1 MCULE-7513516501 [0,0,0,0,0,2|1,0,1]=4 6663 B8R1.22 CC1CNCCCN1 MCULE-4765039625 [0,0,0,0,0,2|1,0,1]=4 6664 B8R1.22 CC1CNCCCO1 MCULE-6836650488 [0,0,0,0,0,2|1,0,1]=4 6665 B8R1.22 CC1CNCCCO1 MCULE-8246520743 [0,0,0,0,0,2|1,0,1]=4 6666 B8R1.22 CC1CNCCNC1 MCULE-8657576639 [0,0,0,0,0,2|1,0,1]=4 6667 B8R1.22 CC1CNCCOC1 MCULE-3266198031 [0,0,0,0,0,2|1,0,1]=4 6668 B8R1.22 CC1CNCCOC1 MCULE-7683724120 [0,0,0,0,0,2|1,0,1]=4 6669 B8R1.22 CC1CNCCSC1 MCULE-6522611117 [0,0,0,0,0,2|1,0,1]=4 6670 B8R1.22 CC1COCCCN1 MCULE-5522410500 [0,0,0,0,0,2|1,0,1]=4 6671 B8R1.22 CC1CSCCCN1 MCULE-1217955281 [0,0,0,0,0,2|1,0,1]=4 6672 B8R1.22 CC1CSCCCN1 MCULE-1651941633 [0,0,0,0,0,2|1,0,1]=4 6673 B8R1.22 CN1CCCNCC1 MCULE-6335715537 [0,0,0,0,0,2|2,0,0]=4 6674 B8R1.22 CN1CCCNCC1 MCULE-7300334035 [0,0,0,0,0,2|2,0,0]=4 6675 B8R1.22 CN1COCCOC1 MCULE-7955154550 [0,0,0,0,0,2|2,0,0]=4 6676 B8R1.22 C[C@@H]1CCCCCN1 MCULE-6288089261 [0,0,0,0,0,2|1,0,1]=4 6677 B8R1.22 C[C@@H]1CCCCCN1 MCULE-9958468096 [0,0,0,0,0,2|1,0,1]=4 6678 B8R1.22 C[C@@H]1CCNCCN1 MCULE-8809324856 [0,0,0,0,0,2|1,0,1]=4 6679 B8R1.22 C[C@@H]1CCNCCO1 MCULE-4706490422 [0,0,0,0,0,2|1,0,1]=4 6680 B8R1.22 C[C@@H]1CCNCCO1 MCULE-7769149413 [0,0,0,0,0,2|1,0,1]=4 6681 B8R1.22 C[C@H]1CCCCCN1 MCULE-2291249179 [0,0,0,0,0,2|1,0,1]=4 6682 B8R1.22 C[C@H]1CCCCCN1 MCULE-2695293080 [0,0,0,0,0,2|1,0,1]=4 6683 B8R1.22 C[C@H]1CCNCCN1 MCULE-9762617477 [0,0,0,0,0,2|1,0,1]=4 6684 B8R1.22 ClC1CCCCCC1 MCULE-9172347842 [0,0,0,0,0,2|1,0,1]=4 6685 B8R1.22 FC1CCCCNC1 MCULE-5480487921 [0,0,0,0,0,2|1,0,1]=4 6686 B8R1.22 FC1CCCCNC1 MCULE-5782030002 [0,0,0,0,0,2|1,0,1]=4 6687 B8R1.22 FC1CCCNCC1 MCULE-2724514050 [0,0,0,0,0,2|1,0,1]=4 6688 B8R1.22 FC1CCCNCC1 MCULE-3808617764 [0,0,0,0,0,2|1,0,1]=4 6689 B8R1.22 FC1CNCCNC1 MCULE-6019106998 [0,0,0,0,0,2|1,0,1]=4 6690 B8R1.22 FC1CNCCNC1 MCULE-7988909456 [0,0,0,0,0,2|1,0,1]=4 6691 B8R1.22 F[C@H]1CCCNCC1 MCULE-5787198940 [0,0,0,0,0,2|1,0,1]=4 6692 B8R1.22 F[C@H]1CCCNCC1 MCULE-8736460913 [0,0,0,0,0,2|1,0,1]=4 6693 B8R1.22 NC1=NCCCCC1 MCULE-2757008672 [0,0,0,0,0,2|1,0,0]=3 6694 B8R1.22 NC1=NCCCCC1 MCULE-7781415779 [0,0,0,0,0,2|1,0,0]=3 6695 B8R1.22 NC1C=CCCCC1 MCULE-4893389838 [0,0,0,0,0,2|1,0,1]=4 6696 B8R1.22 NC1CCC=CCC1 MCULE-6008496939 [0,0,0,0,0,2|1,0,1]=4 6697 B8R1.22 NC1CCC=CCC1 MCULE-9914443406 [0,0,0,0,0,2|1,0,1]=4 6698 B8R1.22 NC1CCCCCC1 MCULE-6214185878 [0,0,0,0,0,2|1,0,1]=4 6699 B8R1.22 NC1CCCCNC1 MCULE-9702629623 [0,0,0,0,0,2|1,0,1]=4 6700 B8R1.22 NC1CCCCNC1 MCULE-9973726441 [0,0,0,0,0,2|1,0,1]=4 6701 B8R1.22 NC1CCCNCC1 MCULE-5600391911 [0,0,0,0,0,2|1,0,1]=4 6702 B8R1.22 NC1CCCNCC1 MCULE-7390953649 [0,0,0,0,0,2|1,0,1]=4 6703 B8R1.22 NC1CCCOCC1 MCULE-2817475859 [0,0,0,0,0,2|1,0,1]=4 6704 B8R1.22 NC1CCCSCC1 MCULE-1327827987 [0,0,0,0,0,2|1,0,1]=4 6705 B8R1.22 NC1CNCCNC1 MCULE-4228066155 [0,0,0,0,0,2|1,0,1]=4 6706 B8R1.22 NC1CNCCOC1 MCULE-6645165643 [0,0,0,0,0,2|1,0,1]=4 6707 B8R1.22 NC1CNCCOC1 MCULE-6897171234 [0,0,0,0,0,2|1,0,1]=4 6708 B8R1.22 NC1COCCOC1 MCULE-2081266239 [0,0,0,0,0,2|1,0,1]=4 6709 B8R1.22 NC1COCCOC1 MCULE-8164730318 [0,0,0,0,0,2|1,0,1]=4 6710 B8R1.22 NN1CCCCCC1 MCULE-6118274368 [0,0,0,0,0,2|2,0,0]=4 6711 B8R1.22 N[C@@H]1CCCCNC1 MCULE-4063472101 [0,0,0,0,0,2|1,0,1]=4 6712 B8R1.22 N[C@@H]1CCCCNC1 MCULE-6734296273 [0,0,0,0,0,2|1,0,1]=4 6713 B8R1.22 N[C@@H]1CCCNCC1 MCULE-5614702075 [0,0,0,0,0,2|1,0,1]=4 6714 B8R1.22 N[C@H]1CCCCNC1 MCULE-2962012084 [0,0,0,0,0,2|1,0,1]=4 6715 B8R1.22 N[C@H]1CCCCNC1 MCULE-4348209410 [0,0,0,0,0,2|1,0,1]=4 6716 B8R1.22 N[C@H]1CCCCNC1 MCULE-5018449571 [0,0,0,0,0,2|1,0,1]=4 6717 B8R1.22 N[C@H]1CCCCNC1 MCULE-6428493067 [0,0,0,0,0,2|1,0,1]=4 6718 B8R1.22 N[C@H]1CCCCNC1 MCULE-9621520180 [0,0,0,0,0,2|1,0,1]=4 6719 B8R1.22 N[C@H]1CCCNCC1 MCULE-1653914126 [0,0,0,0,0,2|1,0,1]=4 6720 B8R1.22 O=C1C=CCCCC1 MCULE-5281461360 [0,0,0,0,0,2|0,0,0]=2 6721 B8R1.22 O=C1C=CCCCN1 MCULE-6257739832 [0,0,0,0,0,2|0,0,1]=3 6722 B8R1.22 O=C1CCC=CCC1 MCULE-5704984437 [0,0,0,0,0,2|0,0,0]=2 6723 B8R1.22 O=C1CCCCCC1 MCULE-3507111924 [0,0,0,0,0,2|0,0,0]=2 6724 B8R1.22 O=C1CCCCCN1 MCULE-4544579564 [0,0,0,0,0,2|0,0,0]=2 6725 B8R1.22 O=C1CCCCCO1 MCULE-3051096014 [0,0,0,0,0,2|0,0,0]=2 6726 B8R1.22 O=C1CCCCNC1 MCULE-8257380915 [0,0,0,0,0,2|0,0,0]=2 6727 B8R1.22 O=C1CCCCNC1 MCULE-8344538815 [0,0,0,0,0,2|0,0,0]=2 6728 B8R1.22 O=C1CCCNCC1 MCULE-3201401906 [0,0,0,0,0,2|0,0,0]=2 6729 B8R1.22 O=C1CCCNCC1 MCULE-8264253371 [0,0,0,0,0,2|0,0,0]=2 6730 B8R1.22 O=C1CCCOCC1 MCULE-9595066384 [0,0,0,0,0,2|0,0,0]=2 6731 B8R1.22 O=C1CCCSCC1 MCULE-9359592851 [0,0,0,0,0,2|0,0,0]=2 6732 B8R1.22 O=C1CCNCCN1 MCULE-1678306131 [0,0,0,0,0,2|0,0,0]=2 6733 B8R1.22 O=C1CCNCCN1 MCULE-1867860146 [0,0,0,0,0,2|0,0,0]=2 6734 B8R1.22 O=C1CCOCCN1 MCULE-6881734685 [0,0,0,0,0,2|0,0,0]=2 6735 B8R1.22 O=C1CCOCCO1 MCULE-1433837187 [0,0,0,0,0,2|0,0,0]=2 6736 B8R1.22 O=C1CCSCCN1 MCULE-9445131358 [0,0,0,0,0,2|0,0,0]=2 6737 B8R1.22 O=C1CNCCCN1 MCULE-6106237928 [0,0,0,0,0,2|0,0,0]=2 6738 B8R1.22 O=C1CNCCCN1 MCULE-9943393784 [0,0,0,0,0,2|0,0,0]=2 6739 B8R1.22 O=C1CNCCNC1 MCULE-2450825992 [0,0,0,0,0,2|0,0,0]=2 6740 B8R1.22 O=C1CNCCNC1 MCULE-7379420394 [0,0,0,0,0,2|0,0,0]=2 6741 B8R1.22 O=C1CNCCOC1 MCULE-7546546158 [0,0,0,0,0,2|0,0,0]=2 6742 B8R1.22 O=C1CNCCOC1 MCULE-9183427962 [0,0,0,0,0,2|0,0,0]=2 6743 B8R1.22 O=C1COCCCN1 MCULE-1471963909 [0,0,0,0,0,2|0,0,0]=2 6744 B8R1.22 O=C1COCCOC1 MCULE-4481438739 [0,0,0,0,0,2|0,0,0]=2 6745 B8R1.22 O=C1CSCCSC1 MCULE-5039848738 [0,0,0,0,0,2|0,0,0]=2 6746 B8R1.22 O=C1OCCCCO1 MCULE-1107419276 [0,0,0,0,0,2|0,0,0]=2 6747 B8R1.22 O=S1CCCNCC1 MCULE-1954952183 [0,0,0,0,0,2|1,0,0]=3 6748 B8R1.22 O=S1CCCNCC1 MCULE-2035316359 [0,0,0,0,0,2|1,0,0]=3 6749 B8R1.22 O=S1OCCCCO1 MCULE-6898726705 [0,0,0,0,0,2|1,0,0]=3 6750 B8R1.22 OC1CCCCCC1 MCULE-2514105258 [0,0,0,0,0,2|0,0,2]=4 6751 B8R1.22 OC1CCCCNC1 MCULE-1190427956 [0,0,0,0,0,2|0,0,2]=4 6752 B8R1.22 OC1CCCCNC1 MCULE-1421732173 [0,0,0,0,0,2|0,0,2]=4 6753 B8R1.22 OC1CCCNCC1 MCULE-1004110838 [0,0,0,0,0,2|0,0,2]=4 6754 B8R1.22 OC1CCCNCC1 MCULE-3791515829 [0,0,0,0,0,2|0,0,2]=4 6755 B8R1.22 OC1CCCOCC1 MCULE-6712544119 [0,0,0,0,0,2|0,0,2]=4 6756 B8R1.22 OC1CNCCNC1 MCULE-8325443912 [0,0,0,0,0,2|0,0,2]=4 6757 B8R1.22 OC1CNCCNC1 MCULE-8846087954 [0,0,0,0,0,2|0,0,2]=4 6758 B8R1.22 OC1CNCCNC1 MCULE-9258760029 [0,0,0,0,0,2|0,0,2]=4 6759 B8R1.22 OC1CNCCNC1 MCULE-9598330332 [0,0,0,0,0,2|0,0,2]=4 6760 B8R1.22 OC1CNCCOC1 MCULE-2428391064 [0,0,0,0,0,2|0,0,2]=4 6761 B8R1.22 OC1CNCCOC1 MCULE-5528486665 [0,0,0,0,0,2|0,0,2]=4 6762 B8R1.22 OC1COCCOC1 MCULE-2284989485 [0,0,0,0,0,2|0,0,2]=4 6763 B8R1.22 O[C@@H]1CCCCNC1 MCULE-1012232836 [0,0,0,0,0,2|0,0,2]=4 6764 B8R1.22 O[C@@H]1CCCCNC1 MCULE-8021135676 [0,0,0,0,0,2|0,0,2]=4 6765 B8R1.22 O[C@@H]1CCCNCC1 MCULE-4750880036 [0,0,0,0,0,2|0,0,2]=4 6766 B8R1.22 O[C@@H]1CCCNCC1 MCULE-7818554188 [0,0,0,0,0,2|0,0,2]=4 6767 B8R1.22 O[C@@H]1CNCCOC1 MCULE-5133055470 [0,0,0,0,0,2|0,0,2]=4 6768 B8R1.22 O[C@@H]1CNCCOC1 MCULE-7942990292 [0,0,0,0,0,2|0,0,2]=4 6769 B8R1.22 O[C@H]1CCCCNC1 MCULE-3979929214 [0,0,0,0,0,2|0,0,2]=4 6770 B8R1.22 O[C@H]1CCCCNC1 MCULE-8051415954 [0,0,0,0,0,2|0,0,2]=4 6771 B8R1.22 O[C@H]1CCCNCC1 MCULE-3288930041 [0,0,0,0,0,2|0,0,2]=4 6772 B8R1.22 O[C@H]1CCCNCC1 MCULE-4775727156 [0,0,0,0,0,2|0,0,2]=4 6773 B8R1.22 O[C@H]1CCCNCC1 MCULE-9319578978 [0,0,0,0,0,2|0,0,2]=4 6774 B8R1.22 O[C@H]1CCCNCC1 MCULE-9853151234 [0,0,0,0,0,2|0,0,2]=4 6775 B8R1.22 O[C@H]1CNCCOC1 MCULE-6353150297 [0,0,0,0,0,2|0,0,2]=4 6776 B8R1.22 S=C1CCCCCN1 MCULE-6573611309 [0,0,0,0,0,2|0,1,0]=3 6777 B8R1.22 S=C1NCCCCN1 MCULE-5312414479 [0,0,0,0,0,2|0,1,0]=3 6778 B8R1.22 SC1CCCCCC1 MCULE-7667420050 [0,0,0,0,0,2|0,1,1]=4