0 B8R1.2 CNc1cnccn1 ZERO/009603 [0,0,0,0,0,0|2,0,0]=2 1 B8R1.2 c1cnc(cn1)CN ZERO/008859 [0,0,0,0,0,0|2,0,0]=2 2 B8R1.2 c1cnccc1NN ZERO/009850 [0,0,0,0,0,0|4,0,0]=4 3 B9R1.1 c1cc(ccc1CN)N ZERO/006008 [0,1,0,0,0,0|2,0,0]=3 4 B9R1.1 c1cc(ccc1NN)F ZERO/001549 [0,1,0,0,0,0|3,0,0]=4 5 B9R1.6 CC(c1ccccn1)N ZERO/009554 [0,1,0,0,0,0|2,0,0]=3 6 B9R1.8 CNCc1cnccn1 ZERO/008678 [0,1,0,0,0,0|1,0,0]=2 7 B9R1.8 c1cc(cnc1)CC#N ZERO/010412 [0,1,0,0,0,0|0,0,1]=2 8 B9R1.8 c1ccnc(c1)CCBr ZERO/009228 [0,1,0,0,0,0|2,0,0]=3 9 B9R1.8 c1ccnc(c1)CCCl ZERO/009177 [0,1,0,0,0,0|2,0,0]=3 10 B9R1.8 c1cnccc1CCN ZERO/008451 [0,1,0,0,0,0|2,0,0]=3 11 B9R1.15 COc1ccncc1N ZERO/004846 [0,1,0,0,0,0|3,0,0]=4 12 B9R1.15 c1cc(c(nc1)Cl)C#N ZERO/005552 [0,1,0,0,0,0|1,0,1]=3 13 B9R1.15 c1cc(c(nc1)N)C=O ZERO/004822 [0,1,0,0,0,0|1,0,1]=3 14 B9R1.15 c1ccc(c(c1)NN)F ZERO/001817 [0,1,0,0,0,0|3,0,0]=4 15 B9R1.15 c1cncc(c1N)C=O ZERO/008579 [0,1,0,0,0,0|1,0,1]=3 16 B7R1.1 c1c([nH]nn1)CO ZERO/005679 [0,0,0,0,1,0|3,0,0]=4 17 B7R1.1 c1cn[nH]c1CO ZERO/008363 [0,0,0,0,1,0|2,0,0]=3 18 B7R1.1 c1cnc([nH]1)CN ZERO/005568 [0,0,0,0,1,0|2,0,0]=3 19 B7R1.1 c1cnoc1CCl ZERO/005918 [0,0,0,0,1,0|2,0,0]=3 20 B7R1.1 c1conc1CCl ZERO/005758 [0,0,0,0,1,0|2,0,0]=3 21 B8R1.3 c1cc(ncc1Br)Cl ZERO/006251 [1,1,0,0,0,0|1,0,0]=3 22 B8R1.3 c1cc(ncc1F)N ZERO/006220 [1,1,0,0,0,0|1,0,0]=3 23 B8R1.3 c1cc(ncc1I)Br ZERO/006252 [1,1,0,0,0,0|1,0,0]=3 24 B8R1.3 c1cc(ncc1I)Cl ZERO/006253 [1,1,0,0,0,0|1,0,0]=3 25 B8R1.3 c1cc(ncc1I)F ZERO/006160 [1,1,0,0,0,0|1,0,0]=3 26 B8R1.4 Cc1cc(ccn1)N ZERO/010396 [1,1,0,0,0,0|2,0,0]=4 27 B8R1.5 Cc1cnccc1N ZERO/010466 [1,1,0,0,0,0|0,0,0]=2 28 B8R1.5 c1cc(c(=O)[nH]c1)N ZERO/001732 [1,1,0,0,0,0|1,0,1]=4 29 B8R1.5 c1cc(c(nc1)Cl)I ZERO/006257 [1,1,0,0,0,0|1,0,0]=3 30 B8R1.5 c1cc(c(nc1)N)Br ZERO/006197 [1,1,0,0,0,0|1,0,0]=3 31 B8R1.5 c1cncc(c1N)Br ZERO/009934 [1,1,0,0,0,0|1,0,0]=3 32 B8R1.1 Cc1cc(no1)CN ZERO/009758 [0,1,0,0,1,0|2,0,0]=4 33 B8R1.1 Cc1cc(on1)CN ZERO/010435 [0,1,0,0,1,0|2,0,0]=4 34 B8R1.1 Cn1cc(cn1)CN ZERO/009859 [0,1,0,0,1,0|2,0,0]=4 35 B8R1.1 c1c(nc(s1)N)CO ZERO/009089 [0,1,0,0,1,0|2,0,0]=4 36 B8R1.1 c1cc(oc1CN)Br ZERO/008936 [0,1,0,0,1,0|2,0,0]=4 37 B8R1.8 c1c(cn[nH]1)CCN ZERO/009643 [0,1,0,0,1,0|1,0,0]=3 38 B8R1.8 c1c(nc[nH]1)CCN ZERO/004089 [0,1,0,0,1,0|1,0,0]=3 39 B8R1.8 c1cc(oc1)CCN ZERO/005328 [0,1,0,0,1,0|1,0,0]=3 40 B8R1.8 c1cc(sc1)CCN ZERO/005227 [0,1,0,0,1,0|1,0,0]=3 41 B8R1.8 c1cc(sc1)CCN ZERO/005760 [0,1,0,0,1,0|1,0,0]=3 42 B8R1.8 c1cnn(c1)CCN ZERO/008893 [0,1,0,0,1,0|1,0,0]=3 43 B8R1.8 c1nc([nH]n1)CCN ZERO/010904 [0,1,0,0,1,0|2,0,0]=4 44 B8R1.11 Cc1c([nH]cn1)CCl ZERO/009975 [0,1,0,0,1,0|2,0,0]=4 45 B8R1.11 Cc1c(c[nH]n1)CN ZERO/005575 [0,1,0,0,1,0|2,0,0]=4 46 B8R1.11 Cn1ccnc1CCl ZERO/005995 [0,1,0,0,1,0|2,0,0]=4 47 B8R1.11 Cn1ccnc1CN ZERO/008528 [0,1,0,0,1,0|2,0,0]=4 48 B10R1.3 COc1ccc(cc1)NN ZERO/004587 [0,2,0,0,0,0|2,0,0]=4 49 B10R1.3 c1cc(ccc1CCl)C#N ZERO/004616 [0,2,0,0,0,0|2,0,0]=4 50 B10R1.13 c1cc(ncc1C(=O)O)O ZERO/005644 [0,2,0,0,0,0|1,0,1]=4 51 B10R1.176 COc1ccc(c(c1)N)O ZERO/005376 [0,2,0,0,0,0|2,0,0]=4 52 B10R1.28 c1cc(cnc1)S(=O)(=O)Cl ZERO/009851 [0,2,0,0,0,0|2,0,0]=4 53 B10R1.61 Cc1ccncc1C(=O)O ZERO/009371 [0,2,0,0,0,0|1,0,1]=4 54 B10R1.61 c1cc(c(nc1)O)[N+](=O)[O-] ZERO/008538 [0,2,0,0,0,0|2,0,0]=4 55 B10R1.61 c1cncc(c1N)C(=O)O ZERO/010694 [0,2,0,0,0,0|1,0,1]=4 56 B10R1.61 c1cncc(c1N)[N+](=O)[O-] ZERO/008536 [0,2,0,0,0,0|2,0,0]=4 57 B10R1.4 CCOc1cccnc1N ZERO/009270 [0,2,0,0,0,0|0,0,0]=2 58 B10R1.17 c1cc(cnc1)CCCBr ZERO/009226 [0,2,0,0,0,0|0,0,0]=2 59 B10R1.17 c1ccc(cc1)CN=C=S ZERO/008132 [0,2,0,0,0,0|1,0,1]=4 60 B10R1.17 c1ccnc(c1)CCC#N ZERO/009426 [0,2,0,0,0,0|2,0,0]=4 61 B10R1.17 c1ccnc(c1)CCCN ZERO/004569 [0,2,0,0,0,0|2,0,0]=4 62 B10R1.18 c1cc(cnc1)CC(=N)N ZERO/010345 [0,2,0,0,0,0|0,0,1]=3 63 B10R1.20 COc1c(cccn1)C#N ZERO/010282 [0,2,0,0,0,0|1,0,1]=4 64 B10R1.20 COc1ccccc1NN ZERO/000909 [0,2,0,0,0,0|2,0,0]=4 65 B10R1.245 COc1c(cccc1Cl)N ZERO/006444 [0,2,0,0,0,0|2,0,0]=4 66 B6R1.2 Cn1cccn1 ZERO/005846 [1,0,0,0,1,0|1,0,0]=3 67 B6R1.2 c1c(cn[nH]1)Br ZERO/010006 [1,0,0,0,1,0|2,0,0]=4 68 B6R1.2 c1c(cn[nH]1)N ZERO/009579 [1,0,0,0,1,0|2,0,0]=4 69 B6R1.2 c1c(csn1)Br ZERO/004872 [1,0,0,0,1,0|2,0,0]=4 70 B6R1.2 c1c(csn1)I ZERO/010751 [1,0,0,0,1,0|2,0,0]=4 71 B6R1.2 c1c[nH]nc1N ZERO/010267 [1,0,0,0,1,0|2,0,0]=4 72 B6R1.2 c1c[nH]nc1N ZERO/010430 [1,0,0,0,1,0|2,0,0]=4 73 B6R1.2 c1cnsc1Br ZERO/010444 [1,0,0,0,1,0|2,0,0]=4 74 B6R1.2 c1coc(n1)N ZERO/010223 [1,0,0,0,1,0|2,0,0]=4