0 B6R0.1 CCCC(O)CN ALBB-031019 [0,0,0,0,0,0|2,0,2]=4 1 B6R0.1 CCOC(=N)CC ALBB-022391 [0,0,0,0,0,0|3,0,0]=3 2 B6R0.1 CCOC(=N)CCl ALBB-022622 [0,0,0,0,0,0|4,0,0]=4 3 B6R0.1 CNC(C)CCO ALBB-004088 [0,0,0,0,0,0|3,0,1]=4 4 B6R0.1 CNCC(=O)NN ALBB-014329 [0,0,0,0,0,0|3,0,0]=3 5 B6R0.1 CNCC(C)OC ALBB-009408 [0,0,0,0,0,0|2,0,1]=3 6 B6R0.1 COC(=O)CCO ALBB-013447 [0,0,0,0,0,0|1,0,0]=1 7 B6R0.1 COC(C)CCN ALBB-022248 [0,0,0,0,0,0|2,0,1]=3 8 B6R0.1 COC\C(N)=N/O ALBB-031514 [0,0,0,0,0,0|4,0,0]=4 9 B5R0.1 COCC(N)=S ALBB-031235 [1,0,0,0,0,0|2,1,0]=4 10 B5R0.1 CS(=O)CCN ALBB-011537 [1,0,0,0,0,0|2,0,0]=3 11 B5R0.1 NC(=O)CCO ALBB-027682 [1,0,0,0,0,0|2,0,0]=3 12 B5R0.2 COCCNN ALBB-026577 [1,0,0,0,0,0|2,0,1]=4 13 B5R0.2 COCCNN ALBB-026577 [1,0,0,0,0,0|2,0,1]=4 14 B5R0.3 CNC(=O)CBr ALBB-012802 [1,0,0,0,0,0|2,0,0]=3 15 B5R0.3 COC(C)CN ALBB-009407 [1,0,0,0,0,0|2,0,1]=4 16 B7R0.2 CC(C)NC(=O)CBr ALBB-011961 [0,1,0,0,0,0|3,0,0]=4 17 B7R0.2 CNC(=O)CC(=O)O ALBB-009534 [0,1,0,0,0,0|2,0,1]=4 18 B7R0.3 CCN(C)CCCN ALBB-014682 [0,1,0,0,0,0|3,0,0]=4 19 B7R0.3 CCN(C)CCCO ALBB-004106 [0,1,0,0,0,0|3,0,0]=4 20 B7R0.5 CCOC(=N)C(C)C ALBB-022392 [0,1,0,0,0,0|3,0,0]=4 21 B7R0.5 CCOC(=N)C(C)O ALBB-027997 [0,1,0,0,0,0|3,0,0]=4 22 B7R0.5 CCOC(=O)N(C)N ALBB-022260 [0,1,0,0,0,0|2,0,0]=3 23 B7R0.10 CCC(N)C(=O)NO ALBB-022805 [0,1,0,0,0,0|2,0,0]=3 24 B7R0.10 CNC(=O)C(C)NC ALBB-005651 [0,1,0,0,0,0|2,0,0]=3 25 B7R0.10 CNC(C)C(=O)OC ALBB-018696 [0,1,0,0,0,0|1,0,0]=2 26 B7R0.11 CCS(=O)(=O)CCCl ALBB-008889 [0,1,0,0,0,0|3,0,0]=4 27 B7R0.11 CCS(=O)(=O)CCN ALBB-010778 [0,1,0,0,0,0|3,0,0]=4 28 B7R0.11 CCS(=O)(=O)CCN ALBB-010778 [0,1,0,0,0,0|3,0,0]=4 29 B7R0.11 CNS(=O)(=O)CCN ALBB-005481 [0,1,0,0,0,0|3,0,0]=4 30 B7R0.11 COC(C)(C)CCN ALBB-016800 [0,1,0,0,0,0|2,0,1]=4 31 B7R1.1 CCC1CCCN1 ALBB-014922 [0,0,0,1,0,0|2,0,1]=4 32 B7R1.1 CCC1CCCN1 ALBB-014922 [0,0,0,1,0,0|2,0,1]=4 33 B7R1.2 CC1=NOC(=O)N1 ALBB-032735 [0,0,0,1,0,0|2,0,1]=4 34 B7R1.2 CC1CNC(=O)O1 ALBB-022254 [0,0,0,1,0,0|2,0,0]=3 35 B7R1.2 CC1CNC(=S)N1 ALBB-034787 [0,0,0,1,0,0|2,1,0]=4 36 B7R1.2 O=C1CNC(=O)C1 ALBB-030115 [0,0,0,1,0,0|2,0,1]=4 37 B7R1.3 CC1=CCNCC1 ALBB-018638 [0,0,0,1,0,0|3,0,0]=4 38 B7R1.3 CC1CNCCO1 ALBB-018624 [0,0,0,1,0,0|2,0,1]=4 39 B7R1.4 NC1CCCC1=O ALBB-030356 [0,0,0,1,0,0|2,0,0]=3 40 B7R1.22 CCC(N)C1CC1 ALBB-018073 [0,0,0,1,0,0|2,0,1]=4 41 B7R1.22 COC(=N)C1CC1 ALBB-033323 [0,0,0,1,0,0|1,0,0]=2 42 B7R1.22 COC(=O)C1CN1 ALBB-031806 [0,0,0,1,0,0|1,0,0]=2 43 B4R0.1 CCC(=N)N ALBB-033342 [2,0,0,0,0,0|2,0,0]=4 44 B4R0.2 CCCNN ALBB-029755 [2,0,0,0,0,0|2,0,0]=4 45 B4R0.2 CNCCCl ALBB-023508 [2,0,0,0,0,0|2,0,0]=4 46 B6R0.2 CC(N)CC(C)O ALBB-030473 [1,1,0,0,0,0|0,0,2]=4 47 B6R0.2 NC(=O)CC(=O)O ALBB-009535 [1,1,0,0,0,0|1,0,1]=4 48 B6R0.3 CCC(Br)C(N)=O ALBB-016211 [1,1,0,0,0,0|1,0,0]=3 49 B6R0.3 COC(C)C(=O)O ALBB-019163 [1,1,0,0,0,0|1,0,0]=3 50 B6R0.3 NC(CCl)C(=O)O ALBB-018637 [1,1,0,0,0,0|1,0,0]=3 51 B6R0.3 O=C(O)C(O)CCl ALBB-025599 [1,1,0,0,0,0|1,0,0]=3 52 B6R0.4 CC(=O)NCC#N ALBB-022348 [1,1,0,0,0,0|1,0,1]=4 53 B6R0.4 CCNCC(C)O ALBB-017752 [1,1,0,0,0,0|0,0,2]=4 54 B6R0.4 CNCCC(=O)O ALBB-013461 [1,1,0,0,0,0|0,0,0]=2 55 B6R0.4 COCCC(C)=O ALBB-027646 [1,1,0,0,0,0|0,0,0]=2 56 B6R0.4 COCCC(C)O ALBB-036368 [1,1,0,0,0,0|0,0,2]=4 57 B6R0.4 NC(=O)CCCCl ALBB-018689 [1,1,0,0,0,0|1,0,0]=3 58 B6R0.4 NCCCC(N)=O ALBB-023443 [1,1,0,0,0,0|1,0,0]=3 59 B6R0.5 CS(=O)(=O)CCCl ALBB-012289 [1,1,0,0,0,0|2,0,0]=4 60 B6R0.5 CS(=O)(=O)CCN ALBB-004999 [1,1,0,0,0,0|2,0,0]=4 61 B6R0.6 CCCSCCN ALBB-013368 [1,1,0,0,0,0|2,0,0]=4 62 B6R0.6 CCOCCNC ALBB-019162 [1,1,0,0,0,0|1,0,1]=4 63 B6R0.6 CCSCCNC ALBB-013382 [1,1,0,0,0,0|1,0,1]=4 64 B8R0.1 CCOC(=O)CCNC ALBB-022247 [0,2,0,0,0,0|0,0,0]=2 65 B8R0.3 CCOC(=O)C(=O)CC ALBB-014722 [0,2,0,0,0,0|0,0,1]=3 66 B8R0.6 CCNCCC(=O)NN ALBB-004098 [0,2,0,0,0,0|2,0,0]=4 67 B8R0.9 CCC(=O)CCC(=O)O ALBB-025658 [0,2,0,0,0,0|1,0,1]=4 68 B8R0.11 CCOC=C(C=O)CC ALBB-032448 [0,2,0,0,0,0|1,0,1]=4 69 B8R0.25 CCS(=O)(=O)CCNC ALBB-013369 [0,2,0,0,0,0|2,0,0]=4 70 B6R1.10 CC1(N)CCC1 ALBB-025000 [1,0,0,1,0,0|1,0,1]=4 71 B6R1.10 CC1(N)CCC1 ALBB-025000 [1,0,0,1,0,0|1,0,1]=4 72 B6R1.11 CC(N)C1CC1 ALBB-013362 [1,0,0,1,0,0|1,0,1]=4 73 B6R1.1 C1CCONC1 ALBB-010164 [1,0,0,1,0,0|1,0,0]=3 74 B8R1.1 CCC1COC(=O)N1 ALBB-022268 [0,1,0,1,0,0|0,0,0]=2 75 B8R1.1 O=C1CCC(CBr)O1 ALBB-027787 [0,1,0,1,0,0|2,0,0]=4 76 B8R1.1 O=C1CCC(CCl)O1 ALBB-014758 [0,1,0,1,0,0|2,0,0]=4 77 B8R1.4 CC1CCCC(=O)N1 ALBB-028844 [0,1,0,1,0,0|1,0,0]=3 78 B8R1.18 CN1CC(N)CC1=O ALBB-030606 [0,1,0,1,0,0|1,0,0]=3 79 B8R1.51 CC1(C)CC(=O)CO1 ALBB-030532 [0,1,0,1,0,0|2,0,0]=4 80 B8R1.51 CC1(C)CNC(=O)C1 ALBB-022301 [0,1,0,1,0,0|1,0,0]=3 81 B8R1.2 COC1CCCNC1 ALBB-004177 [0,1,0,1,0,0|1,0,1]=4 82 B8R1.2 COC1CCCNC1 ALBB-004177 [0,1,0,1,0,0|1,0,1]=4 83 B8R1.2 NCC1=CCCCC1 ALBB-028823 [0,1,0,1,0,0|2,0,0]=4 84 B8R1.2 NCC1CCCCO1 ALBB-024717 [0,1,0,1,0,0|1,0,1]=4 85 B8R1.3 O=C1CCS(=O)CC1 ALBB-009269 [0,1,0,1,0,0|2,0,0]=4 86 B8R1.5 CN1CCNCC1=O ALBB-010140 [0,1,0,1,0,0|1,0,0]=3 87 B8R1.5 CN1CCNCC1=O ALBB-010140 [0,1,0,1,0,0|1,0,0]=3 88 B8R1.5 NC1CCCCC1=O ALBB-031058 [0,1,0,1,0,0|1,0,0]=3 89 B8R1.22 CC1CNCCCO1 ALBB-026617 [0,1,0,1,0,0|1,0,1]=4 90 B8R1.22 O=C1CCSCCN1 ALBB-022853 [0,1,0,1,0,0|1,0,0]=3 91 B8R1.50 CN1CCC(N)C1=O ALBB-014420 [0,1,0,1,0,0|1,0,0]=3 92 B8R1.19 CC1(C)OCCC1=O ALBB-030740 [0,1,0,1,0,0|2,0,0]=4 93 B8R1.37 CCOC(=N)C1CC1 ALBB-013387 [0,1,0,1,0,0|1,0,0]=3 94 B8R1.66 COCC1(N)CCC1 ALBB-021475 [0,1,0,1,0,0|1,0,1]=4