0 B9R0.48 CCOC(=O)CC[N+](=O)[O-] MB00654 [0,0,0,0,0,0|3,0,0]=3 1 B8R0.1 CCOC(=O)CN=C=O AB00195 [1,0,0,0,0,0|2,0,1]=4 2 B8R0.7 CCO\C=C\C=[N+](C)C AB72038 [1,0,0,0,0,0|1,0,2]=4 3 B10R0.108 CCOC(=O)CCC(=O)CBr AB69626 [0,1,0,0,0,0|1,0,1]=3 4 B10R1.113 CC(C)C1CNCC(=O)N1 AB37306 [0,0,0,1,0,0|3,0,0]=4 5 B10R1.113 CC(C)C1COCC(=O)N1 AB72696 [0,0,0,1,0,0|3,0,0]=4 6 B10R1.113 CC(C)N1CCCC(=O)C1 AB39319 [0,0,0,1,0,0|2,0,0]=3 7 B10R1.113 CC(C)[C@@H]1CNCC(=O)N1 AB37312 [0,0,0,1,0,0|3,0,0]=4 8 B10R1.113 CC(C)[C@H]1CNCC(=O)N1 AB37309 [0,0,0,1,0,0|3,0,0]=4 9 B10R1.140 CCOC(=O)C1CC(C1)O PB10706 [0,0,0,1,0,0|1,0,0]=2 10 B8R0.5 CCOC(=O)CC(=N)N AB29705 [0,0,0,0,1,0|2,0,1]=4 11 B8R0.5 CCOC(=O)CC(=O)O AB01280 [0,0,0,0,1,0|2,0,1]=4 12 B8R0.5 CCOC(=O)CC(=O)[O-] AB01563 [0,0,0,0,1,0|2,0,1]=4 13 B8R0.5 CCOC(=O)CC(F)F AB71794 [0,0,0,0,1,0|2,0,0]=3 14 B7R0.3 COC(=O)CCC=C AB16906 [2,0,0,0,0,0|0,0,2]=4 15 B7R0.3 COC(=O)CCCO AB65249 [2,0,0,0,0,0|1,0,0]=3 16 B7R0.7 CCOC(=O)C#CC AB01182 [2,0,0,0,0,0|0,0,2]=4 17 B7R0.7 CCOC(=O)C[N+]#[C-] AB00104 [2,0,0,0,0,0|1,0,1]=4 18 B9R0.5 CCOC(=O)CCN=C=O AB03009 [1,1,0,0,0,0|1,0,1]=4 19 B9R0.18 C(CC(=O)CCCCl)CCl AB01251 [1,1,0,0,0,0|2,0,0]=4 20 B9R0.34 CCOC(=O)CC(C=C)O MB69298 [1,1,0,0,0,0|0,0,2]=4 21 B9R0.34 CCOC(=O)CC(C=O)Cl AB76485 [1,1,0,0,0,0|1,0,1]=4 22 B9R0.35 CCCC(=O)C(=O)OCC AB25061 [1,1,0,0,0,0|0,0,1]=3 23 B9R0.35 CCOC(=N)C(=O)OCC AB60910 [1,1,0,0,0,0|1,0,1]=4 24 B11R0.54 CCOC(=O)CC(C(F)(F)F)O AB01831 [0,2,0,0,0,0|2,0,0]=4 25 B11R0.186 CCOC(=O)C(=O)OC(C)(C)C PB31527 [0,2,0,0,0,0|1,0,1]=4 26 B11R0.34 C[C@@H](CNC(=O)OC(C)(C)C)N AB63700 [0,2,0,0,0,0|2,0,0]=4 27 B11R0.34 C[C@H](CNC(=O)OC(C)(C)C)N AB63696 [0,2,0,0,0,0|2,0,0]=4 28 B11R0.9 CCOC(=O)\C=C\C(OC)OC AB23226 [0,2,0,0,0,0|0,0,2]=4 29 B9R1.2 C1CNC(=O)CC1CN PB30164 [1,0,0,1,0,0|2,0,0]=4 30 B9R1.2 C1CNC(=O)CC1CO PB18227 [1,0,0,1,0,0|2,0,0]=4 31 B9R1.2 CCC1CCCC(=O)N1 CB11733 [1,0,0,1,0,0|2,0,0]=4 32 B9R1.15 CCC1C(=O)CCCN1 AB43253 [1,0,0,1,0,0|2,0,0]=4 33 B9R1.15 CCC1CCCCC1=O AB02693 [1,0,0,1,0,0|1,0,0]=3 34 B9R1.15 CCC1COCCC1=O AB75455 [1,0,0,1,0,0|2,0,0]=4 35 B9R1.15 CCN1CCNCC1=O AB30261 [1,0,0,1,0,0|2,0,0]=4 36 B9R1.33 CCCN1CCCC1=O AB51341 [1,0,0,1,0,0|2,0,0]=4 37 B9R1.49 CN1CCCC(=O)CC1 AB42491 [1,0,0,1,0,0|2,0,0]=4 38 B9R1.13 CC(C)C[C@@H]1CCNC1 AB66512 [1,0,0,1,0,0|1,0,1]=4 39 B9R1.13 CC(C)C[C@H]1CCNC1 AB66515 [1,0,0,1,0,0|1,0,1]=4 40 B9R1.10 C1CC(CCC1=O)(F)F PB10513 [1,0,0,1,0,0|2,0,0]=4 41 B9R1.10 CC1(OCC(=O)CO1)C MB01392 [1,0,0,1,0,0|2,0,0]=4 42 B9R1.82 COC(=O)C1CC(=C)C1 PB23217 [1,0,0,1,0,0|0,0,2]=4 43 B9R1.82 COC(=O)C1CC(=O)C1 PB32215 [1,0,0,1,0,0|1,0,1]=4 44 B9R1.82 COC(=O)C1CC(C1)Cl PB19451 [1,0,0,1,0,0|1,0,0]=3 45 B9R1.82 COC(=O)C1CC(C1)O PB33903 [1,0,0,1,0,0|1,0,0]=3 46 B9R1.82 COC(=O)[C@H]1C[C@@H](C1)N PB33409 [1,0,0,1,0,0|1,0,0]=3 47 B9R1.82 COC(=O)[C@H]1C[C@@H](C1)O PB11695 [1,0,0,1,0,0|1,0,0]=3 48 B9R1.82 COC(=O)[C@H]1C[C@H](C1)N PB13348 [1,0,0,1,0,0|1,0,0]=3 49 B9R1.82 COC(=O)[C@H]1C[C@H](C1)O PB16819 [1,0,0,1,0,0|1,0,0]=3 50 B9R1.137 CC(C)OC(=O)C1CC1 AB21119 [0,0,0,1,1,0|2,0,0]=4 51 B11R1.15 CCOC(=O)C1CC(=O)NC1 AB44509 [0,0,0,1,0,1|1,0,1]=4 52 B11R1.15 CCOC(=O)C1CCN(C1)C AB65422 [0,0,0,1,0,1|1,0,0]=3 53 B11R1.15 CCOC(=O)N1CCC(=O)C1 PB29183 [0,0,0,1,0,1|1,0,1]=4 54 B11R1.15 CCOC(=O)[C@@H]1COC(=N1)C AB14234 [0,0,0,1,0,1|1,0,1]=4 55 B11R1.157 CC(C)CC1CNCC(=O)N1 AB37316 [0,0,0,1,0,1|2,0,0]=4 56 B11R1.157 CC(C)C[C@@H]1CNCC(=O)N1 AB37319 [0,0,0,1,0,1|2,0,0]=4 57 B11R1.157 CC(C)C[C@H]1CNCC(=O)N1 AB37318 [0,0,0,1,0,1|2,0,0]=4 58 B11R1.201 CCOC(=O)CC1CC(C1)O PB38836 [0,0,0,1,0,1|1,0,0]=3 59 B11R1.201 CCOC(=O)C[C@H]1C[C@@H](C1)O PB39260 [0,0,0,1,0,1|1,0,0]=3 60 B11R1.201 CCOC(=O)C[C@H]1C[C@H](C1)O PB36616 [0,0,0,1,0,1|1,0,0]=3 61 B11R1.839 CCOC(=O)CC1CC1(F)F AB85425 [0,0,0,1,0,1|2,0,0]=4 62 B11R1.334 CCOC(=O)CC(=O)C1CC1 AB04447 [0,1,0,1,0,0|0,0,1]=3 63 B11R1.86 CC(C)CC1C(=O)NCCN1 AB37162 [0,1,0,1,0,0|1,0,0]=3 64 B11R1.86 CC(C)CN1CCNCC1=O AB30264 [0,1,0,1,0,0|2,0,0]=4 65 B11R1.86 CC(C)C[C@@H]1C(=O)NCCN1 AB37167 [0,1,0,1,0,0|1,0,0]=3 66 B11R1.86 CC(C)C[C@H]1C(=O)NCCN1 AB37166 [0,1,0,1,0,0|1,0,0]=3 67 B11R1.821 CCOC(=O)C1CC(C1)(F)F AB71467 [0,1,0,1,0,0|1,0,0]=3 68 B11R1.833 CCOC(=O)C1(CC(=O)C1)C PB36405 [0,1,0,1,0,0|1,0,1]=4 69 B11R1.833 CCOC(=O)[C@]1(C[C@@H](C1)N)C PB36712 [0,1,0,1,0,0|1,0,0]=3 70 B11R1.833 CCOC(=O)[C@]1(C[C@@H](C1)O)C PB38290 [0,1,0,1,0,0|1,0,0]=3 71 B11R1.833 CCOC(=O)[C@]1(C[C@H](C1)N)C PB35444 [0,1,0,1,0,0|1,0,0]=3 72 B11R1.833 CCOC(=O)[C@]1(C[C@H](C1)O)C PB35145 [0,1,0,1,0,0|1,0,0]=3 73 B11R1.837 CCOC(=O)C1(CC1(F)F)N AB85438 [0,1,0,1,0,0|2,0,0]=4 74 B11R1.23 CCC(C)N1CCCC(=O)C1 AB39321 [0,1,0,1,0,0|2,0,0]=4 75 B11R1.289 CCOC(=O)COC1CNC1 MB11429 [0,1,0,1,0,0|1,0,0]=3 76 B11R2.35 C1CC(=O)CN(C1)C2CC2 AB39325 [0,0,0,2,0,0|2,0,0]=4