0 B9R0.2 CCCCCCOC(C)=O SBB060306 [0,0,0,0,0,0|0,0,4]=4 1 B8R0.7 CCCCCOC(C)=O SBB060027 [1,0,0,0,0,0|0,0,3]=4 2 B8R0.7 CCOCCOC(C)=O SBB061000 [1,0,0,0,0,0|1,0,2]=4 3 B10R0.97 CC(=O)OCCCOC(C)=O SBB008022 [0,1,0,0,0,0|1,0,2]=4 4 B10R1.18 CC(=O)NC1=CC=CC=C1 SBB040833 [0,0,0,1,0,0|1,0,2]=4 5 B10R1.18 CC(=O)NC1=CC=CC=N1 SBB085932 [0,0,0,1,0,0|2,0,1]=4 6 B10R1.18 CC(=O)OC1=CC=CC=C1 SBB058747 [0,0,0,1,0,0|0,0,2]=3 7 B10R1.18 O=C(Cl)OC1=CC=CC=C1 SBB060851 [0,0,0,1,0,0|1,0,2]=4 8 B10R1.61 CC(=O)C1=C(Br)C=CC=C1 SBB040857 [0,0,0,1,0,0|2,0,1]=4 9 B10R1.61 CC(=O)C1=C(C)N=CC=N1 SBB005785 [0,0,0,1,0,0|3,0,0]=4 10 B10R1.61 CC(=O)C1=C(N)C=CC=C1 SBB058825 [0,0,0,1,0,0|2,0,1]=4 11 B10R1.61 CC(=O)C1=CC=CC=C1C SBB063140 [0,0,0,1,0,0|1,0,1]=3 12 B10R1.61 CC(=O)C1=CC=CC=C1Cl SBB040259 [0,0,0,1,0,0|2,0,1]=4 13 B10R1.61 CC(=O)C1=CC=CC=C1F SBB058458 [0,0,0,1,0,0|2,0,1]=4 14 B10R1.61 CC(=O)C1=CC=CC=C1I SBB064803 [0,0,0,1,0,0|2,0,1]=4 15 B10R1.61 CC(=O)C1=CC=CC=C1O SBB040261 [0,0,0,1,0,0|2,0,1]=4 16 B10R1.61 CC(=O)C1=CN=CC=C1C SBB055670 [0,0,0,1,0,0|2,0,1]=4 17 B10R1.61 CC1=C(C(=O)O)C=CC=C1 SBB040521 [0,0,0,1,0,0|2,0,1]=4 18 B10R1.61 CC1=C(C(N)=O)C=CC=C1 SBB007860 [0,0,0,1,0,0|2,0,1]=4 19 B10R1.61 CC1=CC=CN=C1C(=O)O SBB052853 [0,0,0,1,0,0|3,0,0]=4 20 B10R1.61 CC1=CC=CN=C1C(N)=O SBB055568 [0,0,0,1,0,0|3,0,0]=4 21 B10R1.64 CC(=O)CN1N=CC=C1C SBB022354 [0,0,0,1,0,0|3,0,0]=4 22 B10R1.66 CC(=O)CCN1C=CC=N1 SBB047979 [0,0,0,1,0,0|3,0,0]=4 23 B10R1.66 CC(=O)OCC1=CC=CO1 SBB055767 [0,0,0,1,0,0|1,0,0]=2 24 B10R1.66 CC(=O)SCC1=CC=CO1 SBB057323 [0,0,0,1,0,0|1,1,0]=3 25 B10R1.66 CC(=O)\C=C\C1=CC=CO1 SBB056697 [0,0,0,1,0,0|2,0,1]=4 26 B10R1.66 CC(=O)\C=C\C1=CC=CS1 SBB056771 [0,0,0,1,0,0|2,0,1]=4 27 B10R1.66 OC(=O)CCC1=CC=CO1 SBB005449 [0,0,0,1,0,0|3,0,0]=4 28 B7R0.4 COCCOC(C)=O SBB060999 [2,0,0,0,0,0|1,0,1]=4 29 B7R0.4 C\C=C\C=C\C(=O)O SBB060282 [2,0,0,0,0,0|1,0,0]=3 30 B7R0.4 OC(=O)C\C=C/CC SBB006610 [2,0,0,0,0,0|1,0,1]=4 31 B9R0.55 CC(=O)CCCOC(C)=O SBB001556 [1,1,0,0,0,0|0,0,2]=4 32 B9R0.55 CC(=O)OCCOC(C)=O SBB060701 [1,1,0,0,0,0|1,0,1]=4 33 B11R0.30 CC(=O)OC\C=C/COC(C)=O SBB008422 [0,2,0,0,0,0|0,0,1]=3 34 B9R1.15 CC1=CC=CN=C1C=O SBB052241 [1,0,0,1,0,0|2,0,0]=4 35 B9R1.6 CC(=O)C1=CC=CC=C1 SBB040241 [1,0,0,1,0,0|0,0,2]=4 36 B9R1.6 CC(=O)C1=NC=CC=C1 SBB058824 [1,0,0,1,0,0|1,0,1]=4 37 B9R1.13 CC(=O)CN1C=CC=N1 SBB002740 [1,0,0,1,0,0|2,0,0]=4 38 B9R1.13 O=C(Cl)CC1=CC=CS1 SBB006705 [1,0,0,1,0,0|2,0,0]=4 39 B9R1.13 OC(=O)CC1=CC=CS1 SBB004145 [1,0,0,1,0,0|2,0,0]=4 40 B9R1.41 CC(=O)C1=C(C)C=CS1 SBB066531 [1,0,0,1,0,0|1,0,1]=4 41 B9R1.41 CC(=O)C1=CC=CN1C SBB067044 [1,0,0,1,0,0|1,0,1]=4 42 B11R1.157 CC(=O)C[N+]1=CC(C)=CC=C1 SBB002639 [0,1,0,1,0,0|2,0,0]=4 43 B11R1.157 CC(=O)NC1=CC(C)=CC=C1 SBB059218 [0,1,0,1,0,0|1,0,1]=4 44 B11R1.157 CC(=O)NC1=CC=CC(C)=N1 SBB086718 [0,1,0,1,0,0|1,0,1]=4 45 B11R1.157 CC(=O)OC1=CC(C)=CC=C1 SBB060031 [0,1,0,1,0,0|0,0,1]=3 46 B11R1.157 CC(=O)OC1=CC=CC(F)=C1 SBB086985 [0,1,0,1,0,0|0,0,2]=4 47 B11R1.166 CC(=O)C1=C(C)C=C(F)C=C1 SBB086841 [0,1,0,1,0,0|1,0,1]=4 48 B11R1.166 CC(=O)C1=CC=C(C)C=C1C SBB058451 [0,1,0,1,0,0|1,0,1]=4 49 B11R1.166 CC(=O)C1=CC=C(O)C=C1C SBB063800 [0,1,0,1,0,0|1,0,1]=4 50 B11R1.172 CC(=O)CSCC1=CC=CO1 SBB116836 [0,1,0,1,0,0|1,1,0]=4 51 B11R1.53 COC1=CC=CC=C1C(C)=O SBB040282 [0,1,0,1,0,0|1,0,1]=4 52 B11R1.86 CC(=O)NC1=CC=CC=C1C SBB058208 [0,1,0,1,0,0|1,0,1]=4 53 B11R1.86 CC(=O)NC1=NC=CC=C1C SBB113292 [0,1,0,1,0,0|1,0,1]=4 54 B11R1.86 CC(=O)OC1=C(C)C=CC=C1 SBB060700 [0,1,0,1,0,0|0,0,1]=3 55 B11R1.86 CC(=O)OC1=CC=CC=C1F SBB086981 [0,1,0,1,0,0|0,0,2]=4 56 B11R1.91 CC(=O)CCC1=CC=CC=C1 SBB058827 [0,1,0,1,0,0|1,0,1]=4 57 B11R1.91 CC(=O)OCC1=CC=CC=C1 SBB058375 [0,1,0,1,0,0|0,0,1]=3 58 B11R1.91 CC(=O)O[I+]C1=CC=CC=C1 SBB057853 [0,1,0,1,0,0|0,0,2]=4 59 B11R1.91 NC(=O)OCC1=CC=CC=C1 SBB058407 [0,1,0,1,0,0|1,0,1]=4 60 B11R1.91 O=C(Cl)OCC1=CC=CC=C1 SBB063193 [0,1,0,1,0,0|1,0,1]=4 61 B11R1.20 CC(=O)OC1=CC=C(C)C=C1 SBB060032 [0,1,0,1,0,0|0,0,2]=4 62 B11R1.20 CC(=O)OC1=CC=C(F)C=C1 SBB086983 [0,1,0,1,0,0|0,0,2]=4 63 B11R1.75 CC1=CC=C(CCC(=O)O)O1 SBB007451 [0,1,0,1,0,0|2,0,0]=4 64 B11R1.159 CC(=O)C1=CC=CC(F)=C1C SBB086846 [0,1,0,1,0,0|1,0,1]=4 65 B11R1.25 CCC(=O)SCC1=CC=CO1 SBB058322 [0,1,0,1,0,0|1,1,0]=4 66 B11R1.25 CCC(=S)OCC1=CC=CO1 SBB067099 [0,1,0,1,0,0|1,1,0]=4 67 B11R1.25 O=C(CBr)NCC1=CC=CO1 SBB080068 [0,1,0,1,0,0|2,0,0]=4 68 B11R1.25 O=C(CBr)NCC1=CC=CS1 SBB080070 [0,1,0,1,0,0|2,0,0]=4 69 B11R1.25 O=C(CCl)NCC1=CC=CO1 SBB000183 [0,1,0,1,0,0|2,0,0]=4 70 B11R1.25 O=C(CCl)NCC1=CC=CS1 SBB038695 [0,1,0,1,0,0|2,0,0]=4 71 B11R1.40 O=C(CCl)OC1=CC=CC=C1 SBB060340 [0,1,0,1,0,0|0,0,2]=4 72 B11R1.222 CNC(=O)C1=C(C)C=CC=C1 SBB086650 [0,1,0,1,0,0|1,0,1]=4 73 B11R1.222 COC(=O)C1=CC=CC=C1C SBB063118 [0,1,0,1,0,0|1,0,1]=4 74 B11R1.167 CC(=O)C1=C(C)C=CC(F)=C1 SBB086847 [0,1,0,1,0,0|1,0,1]=4 75 B11R1.167 CC(=O)C1=CC(C)=CC=C1C SBB058819 [0,1,0,1,0,0|1,0,1]=4 76 B11R2.1 O=C1CCC2=CC=CC=C12 SBB056339 [0,0,0,2,0,0|1,0,1]=4 77 B11R2.1 O=C1OCC2=C1C=CC=C2 SBB056840 [0,0,0,2,0,0|0,0,2]=4