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O=C1CC(CN1)NCCO AIFCHEM-6481479666 [0,1,0,0,0,0|3,0,0]=4 15 B10R1.95 CCNC1CCS(=O)(=O)C1 AIFCHEM-94537422330 [0,1,0,0,0,0|3,0,0]=4 16 B10R1.95 CCN[C@@H]1CCS(=O)(=O)C1 AIFCHEM-94537427290 [0,1,0,0,0,0|3,0,0]=4 17 B10R1.95 CCN[C@H]1CCS(=O)(=O)C1 AIFCHEM-94537427291 [0,1,0,0,0,0|3,0,0]=4 18 B10R1.131 CCCN1CC(=O)N(C1)C AIFCHEM-94569012541 [0,1,0,0,0,0|3,0,0]=4 19 B8R0.5 COCC(C)NC(=O)C AIFCHEM-6033665979 [0,0,1,0,0,0|2,0,0]=3 20 B8R0.5 COC[C@@H](C)NC(=O)C AIFCHEM-94601268934 [0,0,1,0,0,0|2,0,0]=3 21 B8R0.5 COC[C@H](C)NC(=O)C AIFCHEM-5679939052 [0,0,1,0,0,0|2,0,0]=3 22 B8R0.6 CCC(=O)NCCOC AIFCHEM-94526499594 [0,0,1,0,0,0|2,0,0]=3 23 B8R0.6 CSCCNC(=O)CO AIFCHEM-94532684957 [0,0,1,0,0,0|3,0,0]=4 24 B8R0.7 COCCCNC(=O)C AIFCHEM-94535593052 [0,0,1,0,0,0|3,0,0]=4 25 B8R0.7 CSCCCNC(=O)C AIFCHEM-94535596324 [0,0,1,0,0,0|3,0,0]=4 26 B7R0.1 CCCCNCCC AIFCHEM-94569018116 [1,0,1,0,0,0|1,0,1]=4 27 B7R0.3 CCCNC(=O)CO AIFCHEM-94532683616 [1,0,1,0,0,0|2,0,0]=4 28 B7R0.3 CCNCC(=O)NC AIFCHEM-94562545297 [1,0,1,0,0,0|2,0,0]=4 29 B9R0.6 COCC(C)N(C)C(=O)C AIFCHEM-94605340310 [0,1,1,0,0,0|2,0,0]=4 30 B9R0.53 CC(=O)NC(C)CN(C)C AIFCHEM-94535599332 [0,1,1,0,0,0|2,0,0]=4 31 B9R0.1 CCC(=O)NCCC(C)C AIFCHEM-94526508254 [0,1,1,0,0,0|1,0,0]=3 32 B9R0.46 CCCCCNC(=O)CO AIFCHEM-94532685258 [0,1,1,0,0,0|2,0,0]=4 33 B9R0.46 CCOCCNC(=O)CO AIFCHEM-94548617327 [0,1,1,0,0,0|2,0,0]=4 34 B9R0.47 COCCNC(=O)C(C)C AIFCHEM-94545041132 [0,1,1,0,0,0|2,0,0]=4 35 B9R0.2 CCCNCCCC(=O)O AIFCHEM-94569019960 [0,1,1,0,0,0|0,0,0]=2 36 B9R0.2 CCCNCCNC(=O)N AIFCHEM-94569014729 [0,1,1,0,0,0|2,0,0]=4 37 B9R0.2 CCCNCCOC(=O)C AIFCHEM-94569015165 [0,1,1,0,0,0|2,0,0]=4 38 B9R0.2 CCNCCCNC(=O)C AIFCHEM-94537421360 [0,1,1,0,0,0|2,0,0]=4 39 B9R0.2 CCNCCOCC(=O)O AIFCHEM-94537411644 [0,1,1,0,0,0|1,0,0]=3 40 B9R0.2 CCNCCSCC(=O)O AIFCHEM-94535042891 [0,1,1,0,0,0|1,0,0]=3 41 B9R0.2 CCOCCCNC(=O)C AIFCHEM-94535598214 [0,1,1,0,0,0|2,0,0]=4 42 B9R0.38 CCNCCCS(=O)(=O)O AIFCHEM-94537420840 [0,1,1,0,0,0|2,0,0]=4 43 B9R1.39 CCCN[C@@H]1CC[C@H]1O AIFCHEM-94569013357 [0,1,0,0,1,0|0,0,2]=4 44 B11R1.1 CCCNC1CCS(=O)CC1 AIFCHEM-94521367617 [0,1,0,0,0,1|2,0,0]=4 45 B11R1.13 CCCN1CCNC(=O)C1C AIFCHEM-94569016072 [0,1,0,0,0,1|2,0,0]=4 46 B11R1.13 CCCN1CCNC(=O)[C@@H]1C AIFCHEM-94569022530 [0,1,0,0,0,1|2,0,0]=4 47 B11R1.13 CCCN1CCNC(=O)[C@H]1C AIFCHEM-94569024217 [0,1,0,0,0,1|2,0,0]=4 48 B11R1.24 CCCNC1CCNC(=O)C1 AIFCHEM-94569013012 [0,1,0,0,0,1|1,0,0]=3 49 B11R1.27 CCCCNC1CNC(=O)C1 AIFCHEM-94570972996 [0,2,0,0,0,0|2,0,0]=4 50 B11R1.27 CCCCN[C@H]1CNC(=O)C1 AIFCHEM-94523033306 [0,2,0,0,0,0|2,0,0]=4 51 B11R1.27 CCCNCC1CCC(=O)N1 AIFCHEM-94569009564 [0,2,0,0,0,0|1,0,0]=3 52 B11R1.27 CCCNC[C@@H]1CCC(=O)N1 AIFCHEM-94569015803 [0,2,0,0,0,0|1,0,0]=3 53 B11R1.27 CCCNC[C@H]1CCC(=O)N1 AIFCHEM-94569013841 [0,2,0,0,0,0|1,0,0]=3 54 B11R1.27 O=C1CC(CN1)NCCCO AIFCHEM-6421329747 [0,2,0,0,0,0|2,0,0]=4 55 B11R1.231 CCNCC1CC(=O)N(C1)C AIFCHEM-94537427268 [0,2,0,0,0,0|2,0,0]=4 56 B9R1.137 CC(=O)NC(C)C1CC1 AIFCHEM-94535596446 [0,0,1,1,0,0|1,0,0]=3 57 B9R1.137 CC(=O)N[C@@H](C)C1CC1 AIFCHEM-94605348586 [0,0,1,1,0,0|1,0,0]=3 58 B9R1.137 CC(=O)N[C@H](C)C1CC1 AIFCHEM-94605348551 [0,0,1,1,0,0|1,0,0]=3 59 B9R1.171 CC(=O)NC1(COC1)C AIFCHEM-5633528295 [0,0,1,1,0,0|2,0,0]=4 60 B9R1.79 CCC(=O)NC1CSC1 AIFCHEM-94526501439 [0,0,1,1,0,0|2,0,0]=4 61 B9R1.96 CCN1CC[C@H]1C(=O)N AIFCHEM-94567088427 [0,0,1,1,0,0|2,0,0]=4 62 B11R2.352 O=C1CC(CN1)N2CCC2 AIFCHEM-94604922161 [0,1,0,1,0,0|2,0,0]=4 63 B11R2.352 O=C1CC(CO1)N2CCC2 AIFCHEM-94604922678 [0,1,0,1,0,0|2,0,0]=4 64 B11R2.16 CCN1CC2CCC(C1)O2 AIFCHEM-94537419650 [0,1,0,1,0,0|1,0,1]=4 65 B11R2.351 O=C1CC(CO1)NC2CC2 AIFCHEM-94573316446 [0,1,0,1,0,0|2,0,0]=4 66 B7R0.5 CCNC(C)C(=O)N AIFCHEM-94537421902 [0,0,1,0,1,0|2,0,0]=4 67 B7R0.5 CCNC(C)C(=O)O AIFCHEM-94537419943 [0,0,1,0,1,0|2,0,0]=4 68 B7R0.5 CCN[C@@H](C)C(=O)N AIFCHEM-94537424903 [0,0,1,0,1,0|2,0,0]=4 69 B7R0.5 CCN[C@@H](C)C(=O)O AIFCHEM-94576654329 [0,0,1,0,1,0|2,0,0]=4 70 B7R0.5 CCN[C@H](C)C(=O)N AIFCHEM-94537424731 [0,0,1,0,1,0|2,0,0]=4 71 B7R0.5 CCN[C@H](C)C(=O)O AIFCHEM-94537420413 [0,0,1,0,1,0|2,0,0]=4 72 B11R1.135 CCCN1CCNC(=O)CC1 AIFCHEM-94569015196 [0,0,0,0,0,2|2,0,0]=4