0 B9R0.44 COCN(C)C[Si](C)(C)C 8180-1-00 [0,0,0,0,0,0|3,1,0]=4 1 B8R0.21 CC(C)(C)NCCCCl 3131-5-02 [1,0,0,0,0,0|2,0,1]=4 2 B8R0.21 CC(C)(C)OCCCCl 2107-5-0V [1,0,0,0,0,0|2,0,1]=4 3 B8R0.21 CC(C)(C)OCCCF 2107-3-5J [1,0,0,0,0,0|2,0,1]=4 4 B8R0.21 CC(C)(C)OCCCN 4156-5-0P [1,0,0,0,0,0|2,0,1]=4 5 B8R0.21 COCCNC(C)(C)C 4156-1-3M [1,0,0,0,0,0|3,0,0]=4 6 B8R0.21 COCCOC(C)(C)C 2108-1-09 [1,0,0,0,0,0|3,0,0]=4 7 B8R0.24 C[N+](C)(C)C[C@H](O)CCl 4156-5-16 [1,0,0,0,0,0|3,0,0]=4 8 B10R0.28 CC(C)(C)OC(=O)NCC=O 4156-1-2T [0,1,0,0,0,0|2,0,1]=4 9 B10R0.31 CC(=O)OC(C)C[N+](C)(C)C 4156-5-17 [0,1,0,0,0,0|2,0,0]=3 10 B10R0.31 CC(CC(=O)O)CC(C)(C)C 2121-1-0Q [0,1,0,0,0,0|0,0,0]=1 11 B10R0.31 C[N+](C)(C)C[C@H](N)CC(=O)[O-] 4157-1-29 [0,1,0,0,0,0|2,0,0]=3 12 B10R0.48 CC(C)(C)CC(C)(C)NC=O 4148-1-1E [0,1,0,0,0,0|1,0,0]=2 13 B10R1.112 CC(C)(C)OC1CC(=O)C1 2217-1-08 [0,0,0,1,0,0|1,0,0]=2 14 B10R1.329 CC1(C)CC(=O)C=C(Cl)C1 2417-5-04 [0,0,0,1,0,0|1,0,2]=4 15 B10R1.329 CC1(C)CC(=O)C=C(N)C1 4256-1-81 [0,0,0,1,0,0|1,0,2]=4 16 B10R1.329 CC1(C)CC(=O)CC(=O)N1 4H48-1-JP [0,0,0,1,0,0|2,0,1]=4 17 B10R1.329 CC1CC(=O)CC(C)(C)C1 2217-1-0S [0,0,0,1,0,0|0,0,0]=1 18 B10R1.329 CC1CC(N)CC(C)(C)C1 3230-1-0J [0,0,0,1,0,0|1,0,1]=3 19 B10R1.329 CC1CC(O)CC(C)(C)C1 2202-1-0G [0,0,0,1,0,0|0,0,2]=3 20 B10R1.329 C[C@@H]1C[C@@H](O)CC(C)(C)C1 2202-1-1A [0,0,0,1,0,0|0,0,2]=3 21 B8R0.14 CC(CC=O)C(F)(F)F 2115-3-08 [0,0,0,0,1,0|3,0,0]=4 22 B8R0.14 CCCC(O)C(C)(C)C 2102-1-0E [0,0,0,0,1,0|2,0,1]=4 23 B7R0.2 CC(C)C[C@H](N)CO 4156-1-S6 [2,0,0,0,0,0|1,0,1]=4 24 B7R0.2 CCC(C)CC(C)C 1100-1-24 [2,0,0,0,0,0|0,0,1]=3 25 B7R0.7 CCCC(C)CCO 2101-1-0B [2,0,0,0,0,0|0,0,2]=4 26 B7R0.8 C=CCC[Si](C)(C)C 5380-1-02 [2,0,0,0,0,0|0,1,1]=4 27 B7R0.8 C=CCNC(C)(C)C 3331-1-03 [2,0,0,0,0,0|1,0,1]=4 28 B7R0.8 CC(C)(C)NCCO 4156-1-2R [2,0,0,0,0,0|1,0,1]=4 29 B7R0.8 CC(C)(C)OCCBr 2107-9-06 [2,0,0,0,0,0|2,0,0]=4 30 B7R0.8 CC(C)(C)OCCCl 2107-5-0L [2,0,0,0,0,0|2,0,0]=4 31 B7R0.8 CC(C)(C)OCCN 4156-5-0Q [2,0,0,0,0,0|2,0,0]=4 32 B7R0.8 CC(C)(C)OCCO 2207-1-06 [2,0,0,0,0,0|1,0,1]=4 33 B7R0.8 CC(C)(C)SCCN 7166-1-01 [2,0,0,0,0,0|2,0,0]=4 34 B7R0.8 CC(C)(Cl)CCCCl 1100-5-39 [2,0,0,0,0,0|2,0,0]=4 35 B7R0.8 CC(C)(N)CCCO 4156-1-W9 [2,0,0,0,0,0|1,0,1]=4 36 B7R0.8 CCCCC(C)(C)O 2103-1-09 [2,0,0,0,0,0|1,0,1]=4 37 B7R0.9 CC(=O)CC(C)(C)C 2117-1-02 [2,0,0,0,0,0|0,0,1]=3 38 B7R0.9 CC(=O)CC(C)(C)O 2120-1-07 [2,0,0,0,0,0|1,0,1]=4 39 B7R0.9 CC(C)(C)CC(=O)Cl 2116-5-0D [2,0,0,0,0,0|1,0,1]=4 40 B7R0.9 CC(C)CC(C)(C)C 1100-1-35 [2,0,0,0,0,0|0,0,0]=2 41 B7R0.9 CN(C)CC(C)(C)N 3132-1-08 [2,0,0,0,0,0|2,0,0]=4 42 B7R0.9 CN(C)CC(C)(C)O 4147-1-0A [2,0,0,0,0,0|2,0,0]=4 43 B7R0.9 C[C@@H](O)CC(C)(C)O 2103-1-R0 [2,0,0,0,0,0|1,0,1]=4 44 B7R0.9 C[C@H](O)CC(C)(C)O 2103-1-S0 [2,0,0,0,0,0|1,0,1]=4 45 B9R0.4 CCCCC(C)CC(C)C 1100-1-29 [1,1,0,0,0,0|1,0,1]=4 46 B9R0.53 CC(=O)CC(=O)CC(C)C 2118-1-06 [1,1,0,0,0,0|1,0,1]=4 47 B9R0.53 CN(C)CC(O)CC(=O)O 4129-1-X1 [1,1,0,0,0,0|2,0,0]=4 48 B9R0.38 CCCCCCC(C)(C)C 1100-1-X3 [1,1,0,0,0,0|1,0,1]=4 49 B9R0.56 CC(=O)SCC[N+](C)(C)C 8166-9-01 [1,1,0,0,0,0|2,0,0]=4 50 B9R0.56 CC(=O)SCC[N+](C)(C)C 8166-H-01 [1,1,0,0,0,0|2,0,0]=4 51 B9R0.56 CC(C)(C)OCCC(=O)O 2121-1-10 [1,1,0,0,0,0|1,0,0]=3 52 B9R0.30 [C-]#[N+]C(C)(C)CC(C)(C)C 3137-1-0R [1,1,0,0,0,0|1,0,1]=4 53 B9R0.57 CC(C)(C)CC(=O)C(=O)O 2129-1-1M [1,1,0,0,0,0|1,0,1]=4 54 B9R0.57 CC(C)(C)CC(N)C(=O)O 4157-1-0F [1,1,0,0,0,0|1,0,0]=3 55 B9R0.57 CC(C)(C)C[C@@H](N)C(=O)O 4157-1-R8 [1,1,0,0,0,0|1,0,0]=3 56 B9R0.57 CC(C)(F)C[C@H](N)C(=O)O 4157-3-S3 [1,1,0,0,0,0|2,0,0]=4 57 B9R0.10 CC(=O)CC(=O)C(C)(C)C 2118-1-0A [0,1,0,0,1,0|1,0,1]=4 58 B9R0.10 CC(C)(C)[C@H](N)CC(=O)O 4157-1-R1 [0,1,0,0,1,0|1,0,0]=3 59 B9R0.10 C\C(=C/C(=O)O)C(C)(C)C 2321-1-0L [0,1,0,0,1,0|0,0,2]=4 60 B9R0.10 C\C(=C/C(N)=O)C(C)(C)C 4348-1-0E [0,1,0,0,1,0|0,0,2]=4 61 B11R0.186 CN(CC=O)C(=O)OC(C)(C)C 4156-1-1Q [0,1,0,0,0,1|1,0,1]=4 62 B11R0.208 CC(C)(C)CC(C)(C)NC(N)=S 7167-1-30 [0,2,0,0,0,0|1,1,0]=4 63 B9R1.34 CC1CC(=O)CC(C)C1 2217-1-1B [1,0,0,1,0,0|0,0,0]=2 64 B9R1.34 CC1CC(=O)CC(C)O1 P612-A-15 [1,0,0,1,0,0|1,0,0]=3 65 B9R1.34 CC1CC(C)CC(O)C1 2202-1-0K [1,0,0,1,0,0|0,0,2]=4 66 B9R1.34 C[C@@H]1CC(=O)C[C@@H](C)O1 2H17-1-86 [1,0,0,1,0,0|1,0,0]=3 67 B9R1.38 CC1CC(=O)C(C)(C)C1 2217-1-1L [1,0,0,1,0,0|0,0,0]=2 68 B9R1.136 O=CCC1CC(F)(F)C1 2215-3-05 [1,0,0,1,0,0|2,0,0]=4 69 B9R1.19 CC(C)(C)C1CCCN1 3H33-5-1R [1,0,0,1,0,0|1,0,1]=4 70 B9R1.133 CC1(C)OCC(C=O)O1 2H15-1-26 [1,0,0,1,0,0|2,0,0]=4 71 B9R1.133 CC1(C)OC[C@@H](C=O)O1 2H15-1-0E [1,0,0,1,0,0|2,0,0]=4 72 B9R1.36 CC1CC(C)(C)CC1=O 2217-1-1J [1,0,0,1,0,0|0,0,0]=2 73 B11R1.509 CC(C)(C)CC1CCCCN1 3H31-1-F2 [0,1,0,1,0,0|1,0,1]=4 74 B11R1.496 CC(C)(C)C1C(=O)COC1=O 2H18-1-0E [0,1,0,1,0,0|1,0,1]=4 75 B11R1.1362 CC1(C)CC(=O)CC(C)(C)C1 2217-1-36 [0,1,0,1,0,0|0,0,0]=2 76 B11R1.1361 CC1C(=O)CC(C)(C)CC1=O 2218-1-0M [0,1,0,1,0,0|1,0,1]=4 77 B11R1.1361 CC1CC(C)(C)CC(=O)C1=O 2718-1-0A [0,1,0,1,0,0|0,0,1]=3 78 B7R0.14 CC(C)(C)[C@H](N)CO 4156-1-X0 [1,0,0,0,1,0|1,0,1]=4 79 B7R0.14 CCC(C)C(C)(C)C 1100-1-25 [1,0,0,0,1,0|0,0,1]=3 80 B11R0.180 CC(CC=O)CCCC(C)(C)O 2115-1-0E [0,0,0,0,0,2|1,0,0]=3