0 B8R0.6 CCCCOC(=O)C=O 2129-1-0S [0,0,0,0,0,0|3,0,1]=4 1 B8R0.6 CCCSCC(=O)OC 6166-1-0C [0,0,0,0,0,0|1,0,1]=2 2 B8R0.6 CNCCCC(=O)OC 4133-5-00 [0,0,0,0,0,0|1,0,2]=3 3 B8R0.6 COC(=O)OCCCF 2128-3-97 [0,0,0,0,0,0|2,0,1]=3 4 B7R0.4 CNCCOC(C)=O 4133-5-03 [1,0,0,0,0,0|2,0,1]=4 5 B7R0.4 C\C=C\C=C\C(C)=O 2317-1-0E [1,0,0,0,0,0|0,0,2]=3 6 B7R0.4 O=C(O)CCCCO 2120-1-00 [1,0,0,0,0,0|1,0,2]=4 7 B9R0.5 CCOC(=O)OCCCF 2128-3-A7 [0,1,0,0,0,0|2,0,1]=4 8 B9R1.1 CCC1=NNC(=O)C=C1 4H48-1-08A [0,0,0,1,0,0|2,0,1]=4 9 B9R1.2 COC1=CC=NC(C)=C1 4H56-1-282 [0,0,0,1,0,0|2,0,1]=4 10 B9R1.2 COC1=CCCN(C)C1 4H56-1-0L9 [0,0,0,1,0,0|2,0,1]=4 11 B9R1.11 CNC(=O)[C@@H]1CCCN1 4H48-5-SF [0,0,0,1,0,0|2,0,1]=4 12 B9R1.11 COC(=O)C1=COC=N1 4H23-1-CN [0,0,0,1,0,0|2,0,1]=4 13 B9R1.11 COC(=O)C1=NOC=C1 4H23-1-J4 [0,0,0,1,0,0|2,0,1]=4 14 B9R1.11 COC(=O)[C@@H]1CCCO1 2H23-1-S2 [0,0,0,1,0,0|1,0,1]=3 15 B9R1.50 NC1C=CCCCCC1 3430-1-01 [0,0,0,1,0,0|2,0,1]=4 16 B9R1.50 O=C1NCCCCCN1 4H53-1-0G [0,0,0,1,0,0|2,0,1]=4 17 B9R1.81 COC(=O)[C@H]1CC[C@@H]1N 4258-5-E1 [0,0,0,1,0,0|1,0,2]=4 18 B9R1.88 COC(=O)C1CC1CN 4258-5-14 [0,0,0,1,0,0|1,0,2]=4 19 B6R0.6 C\C=C\C=C\CO 2301-1-X0 [2,0,0,0,0,0|1,0,1]=4 20 B6R0.4 O=C(O)\C=C\CCl 2321-5-03 [2,0,0,0,0,0|1,0,0]=3 21 B8R0.3 CCCC(Br)C(=O)OC 2123-9-0L [1,1,0,0,0,0|0,0,1]=3 22 B8R0.3 CCC[C@@H](N)C(=O)OC 4158-1-R00 [1,1,0,0,0,0|0,0,1]=3 23 B8R0.9 CCC(=O)NCC(C)C 4148-1-0W [1,1,0,0,0,0|2,0,0]=4 24 B8R0.19 COC(=O)C[C@@H](O)CCl 2129-5-R0 [1,1,0,0,0,0|1,0,1]=4 25 B8R0.5 CCCC(N)CC(=O)O 4158-1-50 [1,1,0,0,0,0|0,0,2]=4 26 B10R0.2 CCCC(=O)CC(=O)CCC 2118-1-00 [0,2,0,0,0,0|1,0,1]=4 27 B10R0.2 CCC\C(C)=C\C(=O)OCC 2323-1-36 [0,2,0,0,0,0|0,0,0]=2 28 B8R1.2 COC1C=CCCC1 2407-1-00 [1,0,0,1,0,0|0,0,1]=3 29 B8R1.7 CC(=O)N1CCCC1 4H48-1-0A0 [1,0,0,1,0,0|1,0,1]=4 30 B8R1.31 C[C@@H]1CN[C@@H]1C(=O)O 4H21-1-AR [1,0,0,1,0,0|1,0,1]=4 31 B8R1.34 CC(=O)C=C1COC1 2H17-1-0B [1,0,0,1,0,0|1,0,0]=3 32 B8R1.35 O=[N+]([O-])\C=C\C1CC1 4354-1-E0 [1,0,0,1,0,0|1,0,1]=4 33 B10R1.14 COC(=O)C1=CN(C)C=C1 4H23-1-GT [0,1,0,1,0,0|1,0,1]=4 34 B10R1.14 COC(=O)C1=CNC(C)=C1 4H23-1-KY [0,1,0,1,0,0|1,0,1]=4 35 B10R1.14 COC(=O)[C@@H]1CC[C@H](N)C1 4258-5-11 [0,1,0,1,0,0|0,0,2]=4 36 B10R1.14 COC(=O)[C@H]1CC[C@@H](N)C1 4233-5-05 [0,1,0,1,0,0|0,0,2]=4 37 B10R1.150 COC(=O)CC1CC(O)C1 2229-1-0S [0,1,0,1,0,0|0,0,2]=4 38 B10R1.11 CCOC(=O)C1CCCN1 4H58-1-7S [0,1,0,1,0,0|1,0,1]=4 39 B10R1.137 CCOC(=O)C=C1CSC1 6H23-1-0U [0,1,0,1,0,0|1,0,0]=3 40 B10R1.138 CCOC(=O)\C=C\C1CC1 2323-1-42 [0,1,0,1,0,0|0,0,0]=2 41 B10R1.245 COC1=C(C)OC=CC1=O 2H17-1-1B [0,1,0,1,0,0|1,0,1]=4 42 B10R1.15 COC(=O)C1=CCOCC1 2H23-1-62 [0,1,0,1,0,0|0,0,0]=2 43 B10R1.15 COC(=O)C1=CNCCC1 4H58-1-488 [0,1,0,1,0,0|0,0,0]=2 44 B10R1.15 COC(=O)N1CCOCC1 4H56-1-0H8 [0,1,0,1,0,0|1,0,1]=4 45 B10R1.15 COC(=O)[C@@H]1CNCCO1 4H58-5-BJ [0,1,0,1,0,0|1,0,1]=4 46 B10R1.15 COC(=O)[C@@H]1COCCN1 4H58-5-S6 [0,1,0,1,0,0|1,0,1]=4 47 B10R1.15 COC(=O)[C@H]1CNCCO1 4H58-5-BH [0,1,0,1,0,0|1,0,1]=4 48 B10R1.15 COC(=O)[C@H]1COCCN1 4H58-5-R6 [0,1,0,1,0,0|1,0,1]=4 49 B10R1.184 COC(=O)[C@H](O)CC1CC1 2229-1-R3 [0,1,0,1,0,0|0,0,2]=4 50 B10R1.411 COC(=O)C1(N)CCCC1 4258-5-16 [0,1,0,1,0,0|0,0,2]=4 51 B10R1.27 COC(=O)C=C1CCCC1 2323-1-0X [0,1,0,1,0,0|0,0,0]=2 52 B10R1.134 COC(=O)\C=C(\C)C1CC1 2323-1-0Q [0,1,0,1,0,0|0,0,0]=2 53 B10R1.149 COC(=O)C1=C(C)C=CN1 4H23-1-G5 [0,1,0,1,0,0|0,0,2]=4 54 B10R1.149 COC(=O)C1=CON=C1C 4H23-1-LE [0,1,0,1,0,0|1,0,1]=4 55 B10R1.149 COC(=O)C1SCCC1=O 6H29-1-0A [0,1,0,1,0,0|1,0,1]=4