0 B9R1.35 CC1=CC(C(N)=O)=NO1 BB12-1502 [0,0,0,0,0,0|2,1,0]=3 1 B9R1.35 CC1=CC=C(C(=N)N)O1 BB12-3708 [0,0,0,0,0,0|4,0,0]=4 2 B9R1.35 CC1=CNC(C(=O)O)=N1 BB12-3671 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.35 CC1=NC(C(=O)O)=CS1 BB01-2835 [0,0,0,0,0,0|1,0,0]=1 4 B9R1.35 CC1=NOC(C(=O)O)C1 BB55-3992 [0,0,0,0,0,0|2,0,2]=4 5 B9R1.35 NC1=CC(C(=O)O)=NN1 BB55-3807 [0,0,0,0,0,0|3,0,0]=3 6 B9R1.35 NC1=NNC(C(=O)O)=N1 BB53-2042 [0,0,0,0,0,0|4,0,0]=4 7 B9R1.35 O=C(O)C1=NC(Cl)=NN1 BB53-2032 [0,0,0,0,0,0|4,0,0]=4 8 B9R1.35 O=C1CC(C(=O)O)CS1 BB01-0509 [0,0,0,0,0,0|1,0,3]=4 9 B9R1.35 O=C1NC=C(C(=O)O)N1 BB26-0164 [0,0,0,0,0,0|3,0,0]=3 10 B9R1.35 O=C1NN=C(C(=O)O)N1 BB12-3315 [0,0,0,0,0,0|4,0,0]=4 11 B8R1.1 CC1=CC(C=O)=NN1 BB12-3191 [1,0,0,0,0,0|2,0,0]=3 12 B8R1.1 CN1C=C(C=O)C=N1 BB12-1724 [1,0,0,0,0,0|2,0,0]=3 13 B8R1.7 O=C(O)C1=CN=NN1 BB90-0079 [1,0,0,0,0,0|3,0,0]=4 14 B8R1.7 O=C(O)C1=CNN=C1 BB01-4399 [1,0,0,0,0,0|2,0,0]=3 15 B8R1.7 O=C(O)C1=NOC=C1 BB20-4533 [1,0,0,0,0,0|1,1,0]=3 16 B10R1.14 CC1=CC=C(\C(N)=N/O)O1 BB12-3494 [0,1,0,0,0,0|3,0,0]=4 17 B10R1.14 COC(=O)C1=CC(N)=NN1 BB55-4201 [0,1,0,0,0,0|3,0,0]=4 18 B10R1.31 CCC1=CC(C(=O)Cl)=NO1 BB55-4165 [0,1,0,0,0,0|2,1,0]=4 19 B10R1.31 CCC1=CC(C(=O)O)=NN1 BB56-2146 [0,1,0,0,0,0|2,0,0]=3 20 B10R1.31 CCC1=NC(C(=O)O)=CO1 BB12-3563 [0,1,0,0,0,0|1,1,0]=3 21 B10R1.31 CCC1=NC(C(=O)O)=CS1 BB12-3311 [0,1,0,0,0,0|1,0,0]=2 22 B10R1.59 CC(=O)C1=C(C)SC(C)=N1 BB12-3985 [0,1,0,0,0,0|2,0,0]=3 23 B10R1.59 CC1=C(C(=O)O)N=C(Br)S1 BB26-0182 [0,1,0,0,0,0|2,0,0]=3 24 B10R1.59 CC1=C(C(=O)O)N=C(Cl)S1 BB26-0154 [0,1,0,0,0,0|2,0,0]=3 25 B10R1.59 CC1=C(C(=O)O)N=C(N)S1 BB12-3541 [0,1,0,0,0,0|2,0,0]=3 26 B10R1.59 CN1C=C(Cl)C(C(=O)O)=N1 BB12-1896 [0,1,0,0,0,0|3,0,0]=4 27 B10R1.194 CC1=C(C)C(C(=O)O)=NN1 BB17-3005 [0,1,0,0,0,0|2,0,0]=3 28 B10R1.194 CN1N=CC(C(N)=O)=C1N BB20-3081 [0,1,0,0,0,0|3,0,0]=4 29 B10R1.194 NC1=C(Cl)C(C(=O)O)=NN1 BB55-4181 [0,1,0,0,0,0|3,0,0]=4 30 B10R1.13 CC(=O)C1=CC=C(I)C=C1 BB17-2376 [0,0,0,0,0,1|3,0,0]=4 31 B10R1.13 CC1=CC=C(C(=N)N)C=C1 BB20-3270 [0,0,0,0,0,1|3,0,0]=4 32 B10R1.13 NC1=NC=C(C(=O)O)C=C1 BB01-7654 [0,0,0,0,0,1|2,0,0]=3 33 B10R1.13 O=C(O)C1=CC=C(O)C=N1 BB56-1848 [0,0,0,0,0,1|2,0,0]=3 34 B10R1.13 O=C1C=CC(C(=O)O)=CO1 BB26-0398 [0,0,0,0,0,1|1,1,0]=3 35 B10R1.13 O=C1C=CC(C(=O)O)=NN1 BB12-2030 [0,0,0,0,0,1|3,0,0]=4 36 B10R1.54 CC1=CC=C(CC(=O)O)S1 BB56-0024 [0,0,0,0,0,1|2,0,0]=3 37 B10R1.54 O=C(O)CC1=CC=C(Cl)S1 BB56-1329 [0,0,0,0,0,1|3,0,0]=4 38 B10R1.113 NC(=O)C1=NC=CC(Cl)=C1 BB20-4612 [0,0,0,0,0,1|3,0,0]=4 39 B10R1.113 O=C(O)C1=CC(Br)=CN=C1 BB17-0499 [0,0,0,0,0,1|2,0,0]=3 40 B7R1.1 OCC1=COC=C1 BB12-2281 [2,0,0,0,0,0|0,1,1]=4 41 B9R1.22 CC1=CC(C=O)=C(C)N1 BB17-1648 [1,1,0,0,0,0|1,0,0]=3 42 B9R1.132 CC1=NNC(C=O)=C1Br BB12-3454 [1,1,0,0,0,0|2,0,0]=4 43 B9R1.11 COC(=O)C1=CNC=N1 BB20-4625 [1,1,0,0,0,0|2,0,0]=4 44 B9R1.11 C\C(=N\O)C1=CSC=N1 BB12-2088 [1,1,0,0,0,0|2,0,0]=4 45 B9R1.11 N\C(=N/O)C1=CSC=C1 BB91-0071 [1,1,0,0,0,0|1,0,0]=3 46 B9R1.41 CC1=C(C(=O)O)N=CN1 BB12-2055 [1,1,0,0,0,0|2,0,0]=4 47 B9R1.41 CC1=C(C(=O)O)N=CS1 BB26-0189 [1,1,0,0,0,0|1,0,0]=3 48 B9R1.41 CC1=C(C(=O)O)SC=N1 BB12-3519 [1,1,0,0,0,0|2,0,0]=4 49 B9R1.41 NC1=C(C(=O)O)NN=C1 BB55-4193 [1,1,0,0,0,0|2,0,0]=4 50 B9R1.41 NC1=C(C(=O)O)SC=C1 BB53-1404 [1,1,0,0,0,0|2,0,0]=4 51 B9R1.41 O=C(O)C1=C(Br)C=NN1 BB55-3823 [1,1,0,0,0,0|2,0,0]=4 52 B9R1.41 O=C(O)C1=C(Cl)C=NN1 BB56-2893 [1,1,0,0,0,0|2,0,0]=4 53 B11R1.3 NC(=O)C1=CC=C(CCl)C=C1 BB53-1358 [0,1,0,0,0,1|2,0,0]=4 54 B11R1.3 NCC1=CC=C(C(N)=O)C=C1 BB12-2672 [0,1,0,0,0,1|2,0,0]=4 55 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 BB56-2538 [0,1,0,0,0,1|2,0,0]=4 56 B11R1.3 NNC1=NC=C(C(=O)O)C=C1 BB12-3514 [0,1,0,0,0,1|2,0,0]=4 57 B11R1.21 O=C(O)C1=CC=C(F)C(Cl)=C1 BB12-4696 [0,1,0,0,0,1|2,0,0]=4 58 B11R1.22 CC1=CC=C(C(=O)CBr)C=C1 BB53-4156 [0,1,0,0,0,1|2,0,0]=4 59 B11R1.22 CC1=CC=C(C(=O)NN)C=C1 BB12-2577 [0,1,0,0,0,1|2,0,0]=4 60 B11R1.22 COC(=O)C1=CC=C(O)C=N1 BB56-2624 [0,1,0,0,0,1|2,0,0]=4 61 B11R1.166 NC1=C(C(=O)O)C=NC(=S)N1 BB52-2194 [0,1,0,0,0,1|2,0,0]=4 62 B11R1.166 NC1=C(C(=O)O)C=NC(O)=N1 BB12-4164 [0,1,0,0,0,1|2,0,0]=4 63 B11R1.166 NC1=CC(Br)=C(C(=O)O)C=C1 BB17-0728 [0,1,0,0,0,1|2,0,0]=4 64 B11R1.166 NC1=NC(S)=NC=C1C(=O)O BB52-6462 [0,1,0,0,0,1|2,0,0]=4 65 B11R1.166 O=C(O)C1=C(Cl)C=C(Br)C=C1 BB20-4599 [0,1,0,0,0,1|2,0,0]=4 66 B11R1.166 O=C(O)C1=C(Cl)C=C(Cl)C=C1 BB12-2552 [0,1,0,0,0,1|2,0,0]=4 67 B11R1.166 O=C(O)C1=C(O)C=C(O)N=C1 BB12-2178 [0,1,0,0,0,1|2,0,0]=4 68 B11R1.166 O=C(O)C1=CC=C(Cl)N=C1Cl BB12-2212 [0,1,0,0,0,1|2,0,0]=4 69 B11R1.23 CC1=CC(C(=O)NN)=CC=C1 BB12-2533 [0,1,0,0,0,1|2,0,0]=4 70 B11R1.74 O=C(O)C1=CC(O)=NC(O)=C1 BB10-1202 [0,1,0,0,0,1|2,0,0]=4 71 B11R1.159 CN1C=CC=C(C(=O)O)C1=O BB12-3383 [0,1,0,0,0,1|2,0,0]=4 72 B11R1.159 O=C(O)C1=C(O)C(Br)=CC=C1 BB12-4608 [0,1,0,0,0,1|2,0,0]=4 73 B11R1.159 O=C(O)C1=C(O)C(Cl)=CC=C1 BB12-4662 [0,1,0,0,0,1|2,0,0]=4 74 B11R1.167 CC1=NNC(=O)C(C(=O)O)=C1 BB17-0297 [0,1,0,0,0,1|1,0,0]=3 75 B11R1.266 CCC1=NC=CC(C(=O)O)=C1 BB12-2280 [0,1,0,0,0,1|1,0,0]=3 76 B11R1.15 CCOC(=O)C1=CSC(Br)=N1 BB12-1472 [0,2,0,0,0,0|2,0,0]=4 77 B11R1.15 CCOC(=O)C1=CSC(N)=N1 BB56-1326 [0,2,0,0,0,0|2,0,0]=4 78 B11R1.15 CCOC(=O)C1=NNC(C)=C1 BB56-2143 [0,2,0,0,0,0|2,0,0]=4 79 B11R1.15 CCOC(=O)C1=NOC(C)=C1 BB55-3966 [0,2,0,0,0,0|1,1,0]=4 80 B11R1.44 COC(=O)C1=CC(CN)=CS1 BB56-1936 [0,2,0,0,0,0|2,0,0]=4 81 B11R1.44 COC(=O)C1=CC=C(CCl)O1 BB12-3464 [0,2,0,0,0,0|2,0,0]=4 82 B11R1.225 CC1=CC(C(=O)CCl)=C(C)S1 BB12-1786 [0,2,0,0,0,0|1,0,0]=3 83 B11R1.225 COC(=O)C1=C(C)SC(N)=N1 BB26-0250 [0,2,0,0,0,0|2,0,0]=4 84 B11R1.226 COC(=O)C1=NN(C)C(C)=C1 BB12-1864 [0,2,0,0,0,0|2,0,0]=4 85 B11R1.865 COC(=O)C1=NOC(C)=C1Br BB55-4071 [0,2,0,0,0,0|1,1,0]=4 86 B11R1.124 CCCC1=CC(C(=O)O)=NO1 BB55-3909 [0,2,0,0,0,0|1,1,0]=4 87 B11R1.124 CCCC1=NOC(C(=O)O)=C1 BB55-4011 [0,2,0,0,0,0|2,0,0]=4 88 B11R1.124 COCC1=CC=C(C(=O)O)O1 BB53-1836 [0,2,0,0,0,0|2,0,0]=4 89 B11R1.175 CC(=O)C1=CC([N+](=O)[O-])=CS1 BB17-2210 [0,2,0,0,0,0|1,0,1]=4 90 B11R1.175 CC(=O)C1=NNC(C(=O)O)=C1 BB12-2168 [0,2,0,0,0,0|2,0,0]=4 91 B11R1.175 CC(C)C1=CC(C(=O)O)=NO1 BB55-3899 [0,2,0,0,0,0|1,1,0]=4 92 B11R1.175 CC(C)C1=NC(C(=O)O)=CS1 BB12-3273 [0,2,0,0,0,0|1,0,0]=3 93 B11R1.175 CC(C)N1C=C(C(=O)O)C=N1 BB12-1474 [0,2,0,0,0,0|2,0,0]=4 94 B11R1.49 CCC1=C(C(=O)O)N=C(Br)S1 BB26-0183 [0,2,0,0,0,0|2,0,0]=4 95 B11R1.49 CCC1=C(C(=O)O)N=C(C)S1 BB26-0198 [0,2,0,0,0,0|1,0,0]=3 96 B11R1.49 CCC1=C(C(=O)O)N=C(Cl)S1 BB26-0180 [0,2,0,0,0,0|2,0,0]=4 97 B11R1.49 CCC1=C(C(=O)O)SC(C)=N1 BB12-3625 [0,2,0,0,0,0|2,0,0]=4 98 B9R1.13 O=C(O)CN1C=CN=C1 BB01-4993 [1,0,0,0,0,1|2,0,0]=4 99 B11R1.20 CC(=O)NC1=CC=C(C)C=C1 BB12-3713 [0,0,0,0,0,2|2,0,0]=4 100 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 BB12-4748 [0,0,0,0,0,2|2,0,0]=4