0 B9R0.56 CC(=O)OCC[N+](C)(C)C CS-0020798 [0,0,0,0,0,0|0,0,0]=0 1 B9R0.56 CC(=O)OCC[N+](C)(C)C CS-0143594 [0,0,0,0,0,0|0,0,0]=0 2 B9R0.56 CC(=O)OCC[Si](Cl)(Cl)Cl CS-0716642 [0,0,0,0,0,0|4,0,0]=4 3 B9R0.56 CC(=O)SCC[N+](C)(C)C CS-0199449 [0,0,0,0,0,0|0,1,0]=1 4 B9R0.56 CC(=O)SCC[N+](C)(C)C CS-D1378 [0,0,0,0,0,0|0,1,0]=1 5 B8R0.28 CC(=O)CCC=C(C)C CS-W011151 [1,0,0,0,0,0|2,0,1]=4 6 B8R0.28 CC(=O)CCCC(C)C CS-0154232 [1,0,0,0,0,0|2,0,0]=3 7 B8R0.28 CC(=O)OCC=C(C)C CS-W011131 [1,0,0,0,0,0|1,0,1]=3 8 B8R0.28 CC(=O)OCOC(C)=O CS-W004911 [1,0,0,0,0,0|3,0,0]=4 9 B8R0.28 CC(=O)\C=C\CC(C)C CS-0657803 [1,0,0,0,0,0|2,0,1]=4 10 B8R0.28 CN(C)CCCC(=O)O CS-0117583 [1,0,0,0,0,0|2,0,1]=4 11 B8R0.28 CN(C)CCCC(=O)O CS-W007989 [1,0,0,0,0,0|2,0,1]=4 12 B10R0.31 C[N+](C)(C)C[C@@H](O)CC(=O)[O-] CS-W013266 [0,1,0,0,0,0|2,0,0]=3 13 B10R0.31 C[N+](C)(C)C[C@H](O)CC(=O)O CS-0159622 [0,1,0,0,0,0|2,0,0]=3 14 B10R0.31 C[N+](C)(C)C[C@H](O)CC(=O)[O-] CS-0158160 [0,1,0,0,0,0|2,0,0]=3 15 B10R0.92 CC(C)(C)CC[C@H](N)C(=O)O CS-0375848 [0,1,0,0,0,0|3,0,0]=4 16 B10R1.55 CC(C)(C)[C@@H]1COC(=O)N1 CS-0097463 [0,0,0,1,0,0|2,0,0]=3 17 B10R1.55 CC(C)(C)[C@H]1COC(=O)N1 CS-0097462 [0,0,0,1,0,0|2,0,0]=3 18 B8R0.29 CC(C)(C)NCC(=O)O CS-W021463 [0,0,0,0,1,0|3,0,0]=4 19 B8R0.29 CC(C)(C)OCC(=O)O CS-W013413 [0,0,0,0,1,0|3,0,0]=4 20 B8R0.29 CC(C)(N)CCC(=O)O CS-0273048 [0,0,0,0,1,0|3,0,0]=4 21 B8R0.29 C[Si](C)(C)CCC(=O)O CS-0698434 [0,0,0,0,1,0|2,0,0]=3 22 B7R0.4 CC(=O)OCCCCl CS-W017752 [2,0,0,0,0,0|2,0,0]=4 23 B7R0.4 CC(=O)OCCCI CS-0166646 [2,0,0,0,0,0|2,0,0]=4 24 B7R0.8 CCCC[N+](C)(C)C CS-0187556 [2,0,0,0,0,0|0,0,1]=3 25 B7R0.8 C[N+](C)(C)CCCBr CS-W010147 [2,0,0,0,0,0|1,0,1]=4 26 B9R0.38 CCCCCC[N+](C)(C)C CS-0152324 [1,1,0,0,0,0|1,0,1]=4 27 B9R0.1 C=CC(=O)OCCN(C)C CS-W016416 [1,1,0,0,0,0|0,0,2]=4 28 B9R0.10 CC(C)(C)[C@H](N)CC(=O)O CS-0145791 [0,1,0,0,1,0|2,0,0]=4 29 B9R0.57 CC(C)(C)CC(N)C(=O)O CS-0171694 [0,1,0,0,1,0|2,0,0]=4 30 B9R0.57 CC(C)(C)C[C@H](N)C(=O)O CS-0011700 [0,1,0,0,1,0|2,0,0]=4 31 B11R0.318 C=C(C)C(=O)OCC[N+](C)(C)C CS-W015255 [0,1,0,0,0,1|1,0,0]=3 32 B11R0.180 CCCC(=O)OCC[N+](C)(C)C CS-W009952 [0,2,0,0,0,0|0,0,0]=2 33 B11R0.180 CCCC(=O)SCC[N+](C)(C)C CS-D1379 [0,2,0,0,0,0|0,1,0]=3 34 B9R1.66 CC1(C)CCCC(=O)C1 CS-0010863 [1,0,0,1,0,0|2,0,0]=4 35 B9R1.35 CC(C)C1CNC(=O)C1 CS-0046667 [1,0,0,1,0,0|2,0,0]=4 36 B9R1.35 CC(C)C1COC(=O)N1 CS-0076533 [1,0,0,1,0,0|2,0,0]=4 37 B9R1.35 CC(C)[C@@H]1COC(=O)N1 CS-W002320 [1,0,0,1,0,0|2,0,0]=4 38 B9R1.35 CC(C)[C@H]1COC(=O)N1 CS-W002062 [1,0,0,1,0,0|2,0,0]=4 39 B9R1.49 CN1CCCC(=O)CC1 CS-W003427 [1,0,0,1,0,0|1,0,1]=4 40 B9R1.10 CC1(C)CCC(=O)CC1 CS-W002564 [0,0,0,1,1,0|1,0,0]=3 41 B9R1.10 CC1(O)CCC(=O)CC1 CS-0091842 [0,0,0,1,1,0|2,0,0]=4 42 B9R1.147 CC1(CCC(=O)O)CC1 CS-0240053 [0,0,0,1,1,0|2,0,0]=4 43 B9R1.164 CC1(C)CC(C(=O)O)C1 CS-W021789 [0,0,0,1,1,0|2,0,0]=4 44 B11R1.19 CC(C)(C)C1CCC(=O)CC1 CS-W010932 [0,1,0,1,0,0|2,0,0]=4 45 B7R0.6 C=C(C)CCC(C)=O CS-0225159 [1,0,0,0,1,0|1,0,1]=4 46 B7R0.6 CC(=O)CCC(C)=O CS-D1203 [1,0,0,0,1,0|2,0,0]=4 47 B7R0.6 CC(C)CCC(=O)O CS-W016598 [1,0,0,0,1,0|2,0,0]=4 48 B7R0.6 CN(C)CCC(=O)O CS-W007826 [1,0,0,0,1,0|1,0,1]=4 49 B7R0.6 C[S+](C)CCC(=O)O CS-0158148 [1,0,0,0,1,0|2,0,0]=4 50 B7R0.9 CC(=O)O[Si](C)(C)C CS-W011087 [0,0,0,0,2,0|1,0,0]=3 51 B7R0.9 CC(C)(C)OC(N)=O CS-D1170 [0,0,0,0,2,0|2,0,0]=4 52 B7R0.9 C[N+](C)(C)CC(=O)[O-] CS-2947 [0,0,0,0,2,0|1,0,0]=3 53 B7R0.9 C[N+](C)(C)CC(=O)[O-] CS-W011064 [0,0,0,0,2,0|1,0,0]=3 54 B9R0.55 CC(=O)CCCOC(C)=O CS-0089169 [1,0,0,0,0,1|2,0,0]=4