0 B6R0.4 BrCCCN(C)C BCP18662 [0,0,0,0,0,0|4,0,0]=4 1 B6R0.4 CC(C)CCCO BCP06801 [0,0,0,0,0,0|3,0,1]=4 2 B6R0.4 CCCCC(N)=N BCP11276 [0,0,0,0,0,0|3,0,0]=3 3 B6R0.4 O=C(O)\C=C\CBr BCP11140 [0,0,0,0,0,0|3,0,1]=4 4 B6R0.4 OC(CSCC)=O BCP05241 [0,0,0,0,0,0|3,0,0]=3 5 B5R0.1 CC(OCCl)=O BCP16170 [1,0,0,0,0,0|1,1,0]=3 6 B5R0.1 CN(CCBr)C BCP20000 [1,0,0,0,0,0|3,0,0]=4 7 B5R0.1 C[C@@H](N)CCO BCP01279 [1,0,0,0,0,0|2,0,1]=4 8 B5R0.1 C[C@@H](N)COC BCP19342 [1,0,0,0,0,0|2,0,1]=4 9 B5R0.1 NC(SCC)=N BCP20133 [1,0,0,0,0,0|2,0,0]=3 10 B5R0.1 O=C(Cl)CCBr BCP20557 [1,0,0,0,0,0|2,0,0]=3 11 B5R0.1 O=C(Cl)CCCl BCP09962 [1,0,0,0,0,0|2,0,0]=3 12 B5R0.1 OC(CCO)=O BCP05902 [1,0,0,0,0,0|2,0,0]=3 13 B5R0.1 OC(CCS)=O BCP16636 [1,0,0,0,0,0|2,0,0]=3 14 B5R0.1 [S-]C(OCC)=S BCP29024 [1,0,0,0,0,0|1,2,0]=4 15 B5R0.2 ClCCOCC BCP15316 [1,0,0,0,0,0|1,1,1]=4 16 B5R0.2 O=CCCC=O BCP20105 [1,0,0,0,0,0|2,0,1]=4 17 B7R0.2 CC(N)CC(C)CC BCP07039 [0,1,0,0,0,0|2,0,1]=4 18 B7R0.2 CC(N)CC(C)CC BCP18792 [0,1,0,0,0,0|2,0,1]=4 19 B7R0.2 O=C(O)C[C@@H](N)CC BCP07772 [0,1,0,0,0,0|2,0,0]=3 20 B7R0.3 O=C(OC)\C=C\CBr BCP09298 [0,1,0,0,0,0|2,0,1]=4 21 B7R0.3 O=C(OC)\C=C\OC BCP18643 [0,1,0,0,0,0|2,0,1]=4 22 B7R0.4 O=C(O)CCCCO BCP10662 [0,1,0,0,0,0|2,0,0]=3 23 B7R0.4 OC(\C=C\OCC)=O BCP05609 [0,1,0,0,0,0|2,0,1]=4 24 B7R0.5 CNC[C@H](N)C(O)=O BCP26260 [0,1,0,0,0,0|3,0,0]=4 25 B7R0.5 COC[C](C(O)=O)N BCP11642 [0,1,0,0,0,0|3,0,0]=4 26 B7R0.5 N[C@@H](COC)C(O)=O BCP14284 [0,1,0,0,0,0|3,0,0]=4 27 B7R0.5 O=C(O)[C@@H](CCN)N BCP11565 [0,1,0,0,0,0|3,0,0]=4 28 B7R0.5 O=C(O)[C](CNC)N BCP09610 [0,1,0,0,0,0|3,0,0]=4 29 B7R0.5 O=C(OCC)C(Cl)=O BCP20422 [0,1,0,0,0,0|3,0,0]=4 30 B7R0.8 CCCNS(N)(=O)=O BCP15431 [0,1,0,0,0,0|3,0,0]=4 31 B7R0.8 CS(=O)(=O)CCCO BCP18464 [0,1,0,0,0,0|3,0,0]=4 32 B7R0.8 O=S(NCCC)(N)=O BCP09330 [0,1,0,0,0,0|3,0,0]=4 33 B7R0.8 O=S([NH-])(NCCC)=O BCP09231 [0,1,0,0,0,0|3,0,0]=4 34 B7R1.2 O=C1NCC(O)C1 BCP07569 [0,0,0,1,0,0|2,0,0]=3 35 B7R1.2 O=C1OC[C@@H](C)O1 BCP12993 [0,0,0,1,0,0|1,1,0]=3 36 B7R1.3 C=C1CCNCC1 BCP15107 [0,0,0,1,0,0|3,0,0]=4 37 B7R1.3 O=C1CCNCC1 BCP15157 [0,0,0,1,0,0|2,0,0]=3 38 B7R1.3 O=C1CCSCC1 BCP09565 [0,0,0,1,0,0|2,0,0]=3 39 B7R1.3 O=C1NCCCC1 BCP00878 [0,0,0,1,0,0|1,0,0]=2 40 B7R1.12 O=C(O)[C@@H]1[C@@H](C1)F BCP07708 [0,0,0,1,0,0|3,0,0]=4 41 B7R1.18 O=C(C1CNC1)O BCP07094 [0,0,0,1,0,0|3,0,0]=4 42 B7R1.20 O=C(O)CC1CC1 BCP05386 [0,0,0,1,0,0|2,0,0]=3 43 B4R0.1 CC(CBr)=O BCP06577 [2,0,0,0,0,0|1,0,0]=3 44 B4R0.1 C[C@@H](O)CC BCP06774 [2,0,0,0,0,0|0,0,2]=4 45 B4R0.1 O=C(O)CCl BCP20585 [2,0,0,0,0,0|2,0,0]=4 46 B4R0.2 CSCCN BCP16561 [2,0,0,0,0,0|1,0,0]=3 47 B4R0.2 NCCOC BCP15361 [2,0,0,0,0,0|1,1,0]=4 48 B6R0.1 O=C(C#N)OCC BCP04941 [1,1,0,0,0,0|0,1,1]=4 49 B6R0.1 O=C(C=C)OCC BCP06341 [1,1,0,0,0,0|0,1,1]=4 50 B6R0.1 O=C(OC)CCO BCP16887 [1,1,0,0,0,0|1,0,0]=3 51 B6R0.1 O=C(OC)CCS BCP16637 [1,1,0,0,0,0|1,0,0]=3 52 B6R0.1 O=C(OCC)CBr BCP04940 [1,1,0,0,0,0|0,1,0]=3 53 B6R0.2 CC(C)CC(N)=O BCP05941 [1,1,0,0,0,0|1,0,0]=3 54 B6R0.2 CC(C)NC(C)=O BCP19527 [1,1,0,0,0,0|1,0,0]=3 55 B6R0.2 CC(CC(N)=O)=O BCP19964 [1,1,0,0,0,0|1,0,1]=4 56 B6R0.2 CC(OC(C)=O)=O BCP20665 [1,1,0,0,0,0|0,1,1]=4 57 B6R0.2 CC(\C=C([O-])C)=O BCP15074 [1,1,0,0,0,0|0,0,2]=4 58 B6R0.2 C[C@@H](N)CC(O)=O BCP11586 [1,1,0,0,0,0|1,0,0]=3 59 B6R0.2 C[C@@H](N)CC(O)=O BCP16924 [1,1,0,0,0,0|1,0,0]=3 60 B6R0.3 CC[C@@H](N)C(O)=O BCP17075 [1,1,0,0,0,0|1,0,0]=3 61 B6R0.3 CC[C](N)C(O)=O BCP04716 [1,1,0,0,0,0|1,0,1]=4 62 B6R0.3 C[C@@H](CC)C(O)=O BCP18859 [1,1,0,0,0,0|1,0,0]=3 63 B6R0.3 NC(CC)C(N)=O BCP08675 [1,1,0,0,0,0|1,0,0]=3 64 B6R0.5 CS(CCN)(=O)=O BCP09595 [1,1,0,0,0,0|2,0,0]=4 65 B6R0.5 NCCS(=O)(=O)C BCP04141 [1,1,0,0,0,0|2,0,0]=4 66 B6R0.5 NS(CCC)(=O)=O BCP20038 [1,1,0,0,0,0|2,0,0]=4 67 B6R0.6 C=CCCCCO BCP03575 [1,1,0,0,0,0|1,0,1]=4 68 B6R0.6 CCCCCCO BCP29486 [1,1,0,0,0,0|1,0,1]=4 69 B6R0.6 COCCCCCl BCP14187 [1,1,0,0,0,0|2,0,0]=4 70 B6R0.6 O=CCCCCO BCP10790 [1,1,0,0,0,0|1,0,0]=3 71 B6R0.6 OCCCCOC BCP22070 [1,1,0,0,0,0|2,0,0]=4 72 B8R0.2 CCC(C)C(C([O-])=O)=O BCP13101 [0,2,0,0,0,0|2,0,0]=4 73 B8R0.19 O=C(OC)CC(O)CCl BCP13432 [0,2,0,0,0,0|2,0,0]=4 74 B8R0.23 CC(C)[C@@H](CC(=O)O)N BCP11719 [0,2,0,0,0,0|2,0,0]=4 75 B8R0.1 O=C(CC#N)OCCC BCP12769 [0,2,0,0,0,0|0,1,0]=3 76 B8R0.1 O=C(OCC)C#CCC BCP20891 [0,2,0,0,0,0|1,0,1]=4 77 B8R0.8 N[C](C(O)=O)CCCN BCP18679 [0,2,0,0,0,0|2,0,0]=4 78 B8R0.8 N[C](CCCN)C(O)=O BCP13629 [0,2,0,0,0,0|2,0,0]=4 79 B8R0.8 O=C([O-])C(O)CCSC BCP11942 [0,2,0,0,0,0|2,0,0]=4 80 B8R0.7 NC(SCCCC#N)=N BCP16345 [0,2,0,0,0,0|2,0,0]=4 81 B8R0.7 NC(SCCCC#N)=N BCP28785 [0,2,0,0,0,0|2,0,0]=4 82 B6R1.2 CC1CCCO1 BCP16203 [1,0,0,1,0,0|0,0,2]=4 83 B6R1.2 NC1=NCCC1 BCP11252 [1,0,0,1,0,0|2,0,0]=4 84 B6R1.2 O=C1COCC1 BCP14176 [1,0,0,1,0,0|1,0,0]=3 85 B6R1.2 O=C1NCCC1 BCP15175 [1,0,0,1,0,0|1,0,0]=3 86 B6R1.2 O=C1SCCN1 BCP16484 [1,0,0,1,0,0|1,0,0]=3 87 B6R1.10 NC1(C)CCC1 BCP13870 [1,0,0,1,0,0|1,0,1]=4 88 B6R1.11 N[C](C1CC1)C BCP14967 [1,0,0,1,0,0|1,0,1]=4 89 B6R1.1 C1=CCNCC1 BCP09736 [1,0,0,1,0,0|2,0,0]=4 90 B6R1.1 C1CCCCC1 BCP08072 [1,0,0,1,0,0|1,0,1]=4 91 B6R1.1 N1CCCCC1 BCP15342 [1,0,0,1,0,0|1,0,1]=4 92 B6R1.1 O1CCC=CC1 BCP23557 [1,0,0,1,0,0|2,0,0]=4 93 B8R1.4 CN1CCNC(=O)C1 BCP17253 [0,1,0,1,0,0|1,0,0]=3 94 B8R1.4 NC=1CCCC(C1)=O BCP19985 [0,1,0,1,0,0|1,0,1]=4 95 B8R1.4 O=C1CC(N)CCN1 BCP07513 [0,1,0,1,0,0|1,0,0]=3 96 B8R1.4 O=C1NCC[C](O)C1 BCP14222 [0,1,0,1,0,0|1,0,1]=4 97 B8R1.4 OC1CCNC(=O)C1 BCP11689 [0,1,0,1,0,0|1,0,0]=3 98 B8R1.34 O=C(O)CC1CCC1 BCP15064 [0,1,0,1,0,0|2,0,0]=4 99 B8R1.2 O=CN1CCCCC1 BCP20086 [0,1,0,1,0,0|2,0,0]=4 100 B8R1.3 O=C1NCC(C)CC1 BCP14293 [0,1,0,1,0,0|1,0,0]=3 101 B8R1.5 O=C1C(O)CCCO1 BCP06471 [0,1,0,1,0,0|0,1,0]=3 102 B8R1.5 O=C1CCOCC1C BCP07576 [0,1,0,1,0,0|2,0,0]=4 103 B8R1.7 CC(C1=NCCS1)=O BCP17112 [0,1,0,1,0,0|1,0,0]=3 104 B8R1.7 O=C(N)[C]1NCCC1 BCP07471 [0,1,0,1,0,0|2,0,0]=4 105 B8R1.7 O=C(O)C1CNCC1 BCP04865 [0,1,0,1,0,0|2,0,0]=4 106 B8R1.7 OC(=O)C1COCC1 BCP08172 [0,1,0,1,0,0|2,0,0]=4 107 B8R1.35 [*]C(OC[C@@H]1OC1)=O BCP12886 [0,1,0,1,0,0|1,1,0]=4 108 B8R1.72 O=S1(CCCCO1)=O BCP23575 [0,1,0,1,0,0|1,1,0]=4 109 B8R1.23 O=C(O)[C@@H]1C[C@@H](N)C1 BCP04214 [0,1,0,1,0,0|2,0,0]=4 110 B8R1.54 O=C(O)[C@@H](N)C1CC1 BCP11588 [0,1,0,1,0,0|2,0,0]=4 111 B8R1.77 CC1(C[C]1C(N)=O)C BCP16588 [0,1,0,1,0,0|2,0,0]=4