0 B6R0.1 CCCC(=O)NC WXVL_AK00442SB0073 [0,1,0,0,0,0|2,0,1]=4 1 B6R0.1 CCCC(=O)NC WXVL_AK00442SB0073 [0,1,0,0,0,0|2,0,1]=4 2 B6R0.1 CCNC(=O)CC WXVL_AK00476SB0064 [0,1,0,0,0,0|2,0,1]=4 3 B6R0.1 CCNC(=O)CC WXVL_AK00476SB0064 [0,1,0,0,0,0|2,0,1]=4 4 B6R0.1 CCNC(=O)CO WXVL_AK00476SB2706 [0,1,0,0,0,0|1,0,1]=3 5 B6R0.1 CCNC(=O)CO WXVL_AK00476SB2706 [0,1,0,0,0,0|1,0,1]=3 6 B6R0.4 CC(=O)NCCF WXVL_AK00466SB0150 [0,1,0,0,0,0|2,0,1]=4 7 B6R0.4 CC(=O)NCCF WXVL_AK00466SB0150 [0,1,0,0,0,0|2,0,1]=4 8 B6R0.4 CCCNC(=O)C WXVL_AK00504SB0150 [0,1,0,0,0,0|1,0,2]=4 9 B6R0.4 CCCNC(=O)C WXVL_AK00504SB0150 [0,1,0,0,0,0|1,0,2]=4 10 B6R0.4 CCOCC(=O)N WXVL_AK0084SB0091 [0,1,0,0,0,0|1,0,2]=4 11 B6R0.4 CCOCC(=O)N WXVL_AK0084SB0091 [0,1,0,0,0,0|1,0,2]=4 12 B6R0.4 CCSCC(=O)N WXVL_AK0084SB0002 [0,1,0,0,0,0|1,0,2]=4 13 B6R0.4 CCSCC(=O)N WXVL_AK0084SB0002 [0,1,0,0,0,0|1,0,2]=4 14 B6R0.4 COCCC(=O)N WXVL_AK0084SB0156 [0,1,0,0,0,0|1,0,2]=4 15 B6R0.4 COCCC(=O)N WXVL_AK0084SB0156 [0,1,0,0,0,0|1,0,2]=4 16 B6R0.4 CSCCC(=O)N WXVL_AK0084SB0361 [0,1,0,0,0,0|1,0,2]=4 17 B6R0.4 CSCCC(=O)N WXVL_AK0084SB0361 [0,1,0,0,0,0|1,0,2]=4 18 B5R0.1 CCCC(=O)N WXVL_AK0084SB0073 [1,1,0,0,0,0|0,0,2]=4 19 B5R0.1 CCCC(=O)N WXVL_AK0084SB0073 [1,1,0,0,0,0|0,0,2]=4 20 B5R0.1 CCNC(=O)C WXVL_AK00476SB0150 [1,1,0,0,0,0|1,0,1]=4 21 B5R0.1 CCNC(=O)C WXVL_AK00476SB0150 [1,1,0,0,0,0|1,0,1]=4 22 B5R0.3 CCC(=O)NC WXVL_AK00442SB0064 [1,1,0,0,0,0|1,0,1]=4 23 B5R0.3 CCC(=O)NC WXVL_AK00442SB0064 [1,1,0,0,0,0|1,0,1]=4 24 B5R0.3 CNC(=O)CO WXVL_AK00442SB2706 [1,1,0,0,0,0|1,0,1]=4 25 B5R0.3 CNC(=O)CO WXVL_AK00442SB2706 [1,1,0,0,0,0|1,0,1]=4 26 B7R0.2 CC(=O)N[C@@H](C)CO WXVL_AK0109SB0150 [0,2,0,0,0,0|1,0,1]=4 27 B7R0.2 CC(=O)N[C@@H](C)CO WXVL_AK0109SB0150 [0,2,0,0,0,0|1,0,1]=4 28 B7R0.2 CC(C)NC(=O)CO WXVL_AK0030SB2706 [0,2,0,0,0,0|1,0,1]=4 29 B7R0.2 CC(C)NC(=O)CO WXVL_AK0030SB2706 [0,2,0,0,0,0|1,0,1]=4 30 B7R0.2 CCC(C)CC(=O)N WXVL_AK0084SB0353 [0,2,0,0,0,0|0,0,2]=4 31 B7R0.2 CCC(C)CC(=O)N WXVL_AK0084SB0353 [0,2,0,0,0,0|0,0,2]=4 32 B7R0.2 CCC(O)CC(=O)N WXVL_AK0084SB4092 [0,2,0,0,0,0|0,0,2]=4 33 B7R0.2 CCC(O)CC(=O)N WXVL_AK0084SB4092 [0,2,0,0,0,0|0,0,2]=4 34 B7R0.2 CC[C@@H](C)CC(=O)N WXVL_AK0084SB8650 [0,2,0,0,0,0|0,0,2]=4 35 B7R0.2 CC[C@@H](C)CC(=O)N WXVL_AK0084SB8650 [0,2,0,0,0,0|0,0,2]=4 36 B7R0.2 CNC(=O)CC(C)O WXVL_AK00442SB3643 [0,2,0,0,0,0|1,0,1]=4 37 B7R0.2 CNC(=O)CC(C)O WXVL_AK00442SB3643 [0,2,0,0,0,0|1,0,1]=4 38 B7R0.3 CCC(=O)NCCF WXVL_AK00466SB0064 [0,2,0,0,0,0|1,0,1]=4 39 B7R0.3 CCC(=O)NCCF WXVL_AK00466SB0064 [0,2,0,0,0,0|1,0,1]=4 40 B7R0.3 CCCNC(=O)CC WXVL_AK00504SB0064 [0,2,0,0,0,0|1,0,1]=4 41 B7R0.3 CCCNC(=O)CC WXVL_AK00504SB0064 [0,2,0,0,0,0|1,0,1]=4 42 B7R0.3 CCCNC(=O)CO WXVL_AK00504SB2706 [0,2,0,0,0,0|0,0,1]=3 43 B7R0.3 CCCNC(=O)CO WXVL_AK00504SB2706 [0,2,0,0,0,0|0,0,1]=3 44 B7R0.3 CNC(=O)CCOC WXVL_AK00442SB0156 [0,2,0,0,0,0|1,0,1]=4 45 B7R0.3 CNC(=O)CCOC WXVL_AK00442SB0156 [0,2,0,0,0,0|1,0,1]=4 46 B7R0.3 O=C(CO)NCCF WXVL_AK00466SB2706 [0,2,0,0,0,0|1,0,1]=4 47 B7R0.3 O=C(CO)NCCF WXVL_AK00466SB2706 [0,2,0,0,0,0|1,0,1]=4 48 B7R0.5 CC(=O)N(C)CCO WXVL_AN2670SB0150 [0,2,0,0,0,0|1,0,1]=4 49 B7R0.5 CC(=O)N(C)CCO WXVL_AN2670SB0150 [0,2,0,0,0,0|1,0,1]=4 50 B7R0.5 CCCC(C)C(=O)N WXVL_AK0084SB0352 [0,2,0,0,0,0|0,0,2]=4 51 B7R0.5 CCCC(C)C(=O)N WXVL_AK0084SB0352 [0,2,0,0,0,0|0,0,2]=4 52 B7R0.5 CCC[C@H](O)C(=O)N WXVL_AK0084SB3627 [0,2,0,0,0,0|0,0,2]=4 53 B7R0.5 CCC[C@H](O)C(=O)N WXVL_AK0084SB3627 [0,2,0,0,0,0|0,0,2]=4 54 B7R0.5 CCNC(=O)[C@@H](C)O WXVL_AK00476SB1085 [0,2,0,0,0,0|1,0,1]=4 55 B7R0.5 CCNC(=O)[C@@H](C)O WXVL_AK00476SB1085 [0,2,0,0,0,0|1,0,1]=4 56 B7R0.7 CCCC(=O)NCC WXVL_AK00476SB0073 [0,2,0,0,0,0|1,0,1]=4 57 B7R0.7 CCCC(=O)NCC WXVL_AK00476SB0073 [0,2,0,0,0,0|1,0,1]=4 58 B7R0.7 CCNC(=O)COC WXVL_AK00476SB0090 [0,2,0,0,0,0|1,0,1]=4 59 B7R0.7 CCNC(=O)COC WXVL_AK00476SB0090 [0,2,0,0,0,0|1,0,1]=4 60 B7R0.4 CC(=O)NCCCO WXVL_AK0073SB0150 [0,2,0,0,0,0|0,0,1]=3 61 B7R0.4 CC(=O)NCCCO WXVL_AK0073SB0150 [0,2,0,0,0,0|0,0,1]=3 62 B7R0.4 CCCCNC(=O)C WXVL_AK00588SB0150 [0,2,0,0,0,0|0,0,2]=4 63 B7R0.4 CCCCNC(=O)C WXVL_AK00588SB0150 [0,2,0,0,0,0|0,0,2]=4 64 B7R0.4 NC(=O)CCCCBr WXVL_AK0084SB3153 [0,2,0,0,0,0|0,0,2]=4 65 B7R0.4 NC(=O)CCCCBr WXVL_AK0084SB3153 [0,2,0,0,0,0|0,0,2]=4 66 B7R0.4 NC(=O)CCCCCl WXVL_AK0084SB0379 [0,2,0,0,0,0|0,0,2]=4 67 B7R0.4 NC(=O)CCCCCl WXVL_AK0084SB0379 [0,2,0,0,0,0|0,0,2]=4 68 B7R0.6 CC(=O)NCC(C)O WXVL_AK0052SB0150 [0,2,0,0,0,0|1,0,1]=4 69 B7R0.6 CC(=O)NCC(C)O WXVL_AK0052SB0150 [0,2,0,0,0,0|1,0,1]=4 70 B7R0.6 CC(=O)NC[C@H](C)O WXVL_AK0113SB0150 [0,2,0,0,0,0|1,0,1]=4 71 B7R0.6 CC(=O)NC[C@H](C)O WXVL_AK0113SB0150 [0,2,0,0,0,0|1,0,1]=4 72 B7R0.6 CC(C)CCC(=O)N WXVL_AK0084SB0354 [0,2,0,0,0,0|0,0,2]=4 73 B7R0.6 CC(C)CCC(=O)N WXVL_AK0084SB0354 [0,2,0,0,0,0|0,0,2]=4 74 B7R0.8 CCCCS(=O)(=O)N WXVL_AK0084HU0031 [0,2,0,0,0,0|1,0,1]=4 75 B7R0.8 CCCCS(=O)(=O)N WXVL_AK0084HU0031 [0,2,0,0,0,0|1,0,1]=4 76 B7R1.12 CC1CC1C(=O)N WXVL_AK0084SB0041 [0,1,0,1,0,0|0,0,2]=4 77 B7R1.12 CC1CC1C(=O)N WXVL_AK0084SB0041 [0,1,0,1,0,0|0,0,2]=4 78 B7R1.18 NC(=O)C1CCC1 WXVL_AK0084SB0042 [0,1,0,1,0,0|0,0,2]=4 79 B7R1.18 NC(=O)C1CCC1 WXVL_AK0084SB0042 [0,1,0,1,0,0|0,0,2]=4 80 B7R1.20 NC(=O)CC1CC1 WXVL_AK0084SB0155 [0,1,0,1,0,0|0,0,2]=4 81 B7R1.20 NC(=O)CC1CC1 WXVL_AK0084SB0155 [0,1,0,1,0,0|0,0,2]=4