0 B5R0.1 CCC[C@H](C)N SPC-k309 [0,0,0,0,0,0|2,0,2]=4 1 B5R0.1 C[C@@H](N)CCO SPC-g658 [0,0,0,0,0,0|1,1,2]=4 2 B5R0.1 C[C@H](N)CCO SPC-n760 [0,0,0,0,0,0|1,1,2]=4 3 B4R0.1 CC(=O)CN SPC-t886 [1,0,0,0,0,0|2,0,0]=3 4 B4R0.1 NC(=O)CI SPC-s873 [1,0,0,0,0,0|3,0,0]=4 5 B4R0.2 C=CCCO SPC-t137 [1,0,0,0,0,0|0,1,2]=4 6 B6R0.3 CC(C)C(=O)NN SPC-t733 [0,1,0,0,0,0|2,0,1]=4 7 B6R0.4 CC\C=C\C(=O)O SPC-t510 [0,1,0,0,0,0|3,0,0]=4 8 B6R0.5 C[Si](C)(C)CCO SPC-k286 [0,1,0,0,0,0|0,2,1]=4 9 B6R1.2 CC1=CNC=C1 SPC-m068 [0,0,0,1,0,0|1,0,2]=4 10 B6R1.2 CC1=CNN=C1 SPC-n152 [0,0,0,1,0,0|2,0,1]=4 11 B6R1.2 CC1=COC=N1 SPC-n151 [0,0,0,1,0,0|3,0,0]=4 12 B6R1.2 CC1=CSC=N1 SPC-g112 [0,0,0,1,0,0|1,0,2]=4 13 B6R1.2 C[C@@H]1CCCN1 SPC-n701 [0,0,0,1,0,0|2,0,1]=4 14 B6R1.2 C[C@H]1CCCN1 SPC-r295 [0,0,0,1,0,0|2,0,1]=4 15 B6R1.2 ClC1=CSC=C1 SPC-t726 [0,0,0,1,0,0|1,0,2]=4 16 B6R1.2 IC1=COCC1 SPC-t718 [0,0,0,1,0,0|3,0,0]=4 17 B6R1.2 NC1=CSN=C1 SPC-r370 [0,0,0,1,0,0|2,0,1]=4 18 B6R1.2 O=C1C=CCC1 SPC-g207 [0,0,0,1,0,0|2,0,1]=4 19 B6R1.2 O=C1CCNC1 SPC-g182 [0,0,0,1,0,0|2,0,1]=4 20 B6R1.2 O=C1CCOC1 SPC-g234 [0,0,0,1,0,0|1,1,1]=4 21 B6R1.3 ICCC1CC1 SPC-k255 [0,0,0,1,0,0|1,0,2]=4 22 B6R1.3 NCCC1CC1 SPC-t690 [0,0,0,1,0,0|1,0,2]=4 23 B6R1.3 OCCC1CC1 SPC-h056 [0,0,0,1,0,0|0,1,2]=4 24 B6R1.5 CC1CC(=O)C1 SPC-n075 [0,0,0,1,0,0|2,0,1]=4 25 B6R1.5 CN1CC(Cl)C1 SPC-u755 [0,0,0,1,0,0|2,0,1]=4 26 B6R1.5 CN1CC(N)C1 SPC-a122 [0,0,0,1,0,0|2,0,1]=4 27 B6R1.5 CN1CC(N)C1 SPC-a122 [0,0,0,1,0,0|2,0,1]=4 28 B6R1.5 CN1CC(O)C1 SPC-h814 [0,0,0,1,0,0|1,1,1]=4 29 B6R1.5 C[C@H]1C[C@@H](N)C1 SPC-t414 [0,0,0,1,0,0|1,0,2]=4 30 B6R1.5 NC1CC(=O)C1 SPC-g768 [0,0,0,1,0,0|2,0,1]=4 31 B6R1.5 O=C1CC(Br)C1 SPC-i596 [0,0,0,1,0,0|2,0,1]=4 32 B5R0.3 C=C(CCl)CCl SPC-g310 [1,1,0,0,0,0|1,0,1]=4 33 B5R0.3 C=C(CO)CO SPC-g493 [1,1,0,0,0,0|0,1,1]=4 34 B5R0.4 C=C[Si](C)(C)C SPC-t167 [1,1,0,0,0,0|0,1,1]=4 35 B5R0.4 CC(C)(F)CO SPC-t593 [1,1,0,0,0,0|0,1,1]=4 36 B5R0.4 CC(C)(O)CN SPC-g498 [1,1,0,0,0,0|1,0,1]=4 37 B7R0.5 CC(C)C(=O)OCCl SPC-n339 [0,2,0,0,0,0|1,0,1]=4 38 B7R0.5 CN(C)C(=O)CCN SPC-t561 [0,2,0,0,0,0|2,0,0]=4 39 B7R0.14 CC(C)(C)C(=O)CN SPC-n968 [0,2,0,0,0,0|1,0,1]=4 40 B5R1.2 CC1CNC1 SPC-h149 [1,0,0,1,0,0|1,0,1]=4 41 B5R1.2 C[C@H]1CCN1 SPC-i601 [1,0,0,1,0,0|1,0,1]=4 42 B5R1.2 NC1CSC1 SPC-i072 [1,0,0,1,0,0|1,0,1]=4 43 B5R1.2 O=C1CCN1 SPC-t120 [1,0,0,1,0,0|2,0,0]=4 44 B5R1.2 O=C1CNC1 SPC-h722 [1,0,0,1,0,0|2,0,0]=4 45 B5R1.2 O=C1CSC1 SPC-a100 [1,0,0,1,0,0|1,0,0]=3 46 B5R1.2 OC1CSC1 SPC-t361 [1,0,0,1,0,0|1,0,1]=4 47 B5R1.3 CNC1CC1 SPC-g900 [1,0,0,1,0,0|1,0,1]=4 48 B5R1.5 CC1(C)CO1 SPC-p106 [1,0,0,1,0,0|0,1,1]=4 49 B7R1.1 BrCC1=CCCC1 SPC-n905 [0,1,0,1,0,0|1,0,0]=3 50 B7R1.2 O=C1C[C@@H](S)CN1 SPC-u488 [0,1,0,1,0,0|1,0,1]=4 51 B7R1.3 CC1=CCCNC1 SPC-m637 [0,1,0,1,0,0|1,0,0]=3 52 B7R1.3 CC1=CCNCC1 SPC-h455 [0,1,0,1,0,0|1,0,0]=3 53 B7R1.3 O=C1C=CCOC1 SPC-s270 [0,1,0,1,0,0|1,1,0]=4 54 B7R1.3 O=C1CCCSC1 SPC-k221 [0,1,0,1,0,0|1,0,1]=4 55 B7R1.3 O=C1CCSCC1 SPC-g130 [0,1,0,1,0,0|1,0,1]=4 56 B7R1.4 CC1=C(C)NN=C1 SPC-s309 [0,1,0,1,0,0|2,0,0]=4 57 B7R1.4 CC1=CSC=C1N SPC-p592 [0,1,0,1,0,0|0,0,2]=4 58 B7R1.6 N#CC=C1COC1 SPC-a011 [0,1,0,1,0,0|1,0,1]=4 59 B7R1.6 N#CC=C1CSC1 SPC-a102 [0,1,0,1,0,0|1,0,1]=4 60 B7R1.6 O=CC=C1COC1 SPC-a010 [0,1,0,1,0,0|0,1,1]=4 61 B7R1.17 CC1(C)CCC1=O SPC-s190 [0,1,0,1,0,0|1,0,1]=4 62 B7R1.17 CC1(C)OCC1=O SPC-r001 [0,1,0,1,0,0|0,1,1]=4