0 B6R0.1 O=C(C#N)OCC BCP04941 [0,0,0,0,0,0|1,0,1]=2 1 B6R0.1 O=C(C=C)OCC BCP06341 [0,0,0,0,0,0|0,0,2]=2 2 B6R0.1 O=C(OC)CCO BCP16887 [0,0,0,0,0,0|3,0,0]=3 3 B6R0.1 O=C(OC)CCS BCP16637 [0,0,0,0,0,0|3,0,0]=3 4 B6R0.1 O=C(OCC)CBr BCP04940 [0,0,0,0,0,0|1,0,0]=1 5 B5R0.1 CC(OCCl)=O BCP16170 [1,0,0,0,0,0|1,0,0]=2 6 B5R0.1 NC(SCC)=N BCP20133 [1,0,0,0,0,0|2,1,0]=4 7 B5R0.1 O=C(Cl)CCBr BCP20557 [1,0,0,0,0,0|3,0,0]=4 8 B5R0.1 O=C(Cl)CCCl BCP09962 [1,0,0,0,0,0|3,0,0]=4 9 B5R0.1 OC(CCO)=O BCP05902 [1,0,0,0,0,0|3,0,0]=4 10 B5R0.1 OC(CCS)=O BCP16636 [1,0,0,0,0,0|3,0,0]=4 11 B5R0.1 [S-]C(OCC)=S BCP29024 [1,0,0,0,0,0|1,1,0]=3 12 B5R0.2 ClCCOCC BCP15316 [1,0,0,0,0,0|1,0,1]=3 13 B5R0.3 CC[C](N)CO BCP16938 [1,0,0,0,0,0|2,0,1]=4 14 B5R0.3 O=C(CBr)CC BCP08723 [1,0,0,0,0,0|1,0,0]=2 15 B5R0.3 O=C(NC)CBr BCP13174 [1,0,0,0,0,0|2,0,0]=3 16 B5R0.3 O=C(OC)CBr BCP06456 [1,0,0,0,0,0|1,0,0]=2 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 C[C@@H](O)CC(OC)=O BCP15245 [0,1,0,0,0,0|2,0,0]=3 20 B7R0.2 C[C](O)CC(OC)=O BCP12973 [0,1,0,0,0,0|2,0,1]=4 21 B7R0.2 O=C(OC)C=C(C)C BCP10333 [0,1,0,0,0,0|2,0,1]=4 22 B7R0.2 O=C(OC)\C=C(N)C BCP15340 [0,1,0,0,0,0|2,0,1]=4 23 B7R0.3 O=C(OC)\C=C\CBr BCP09298 [0,1,0,0,0,0|2,0,1]=4 24 B7R0.3 O=C(OC)\C=C\OC BCP18643 [0,1,0,0,0,0|2,0,1]=4 25 B7R0.5 O=C(OCC)C(Cl)=O BCP20422 [0,1,0,0,0,0|1,0,1]=3 26 B7R0.7 O=C(OCC)C[N+]#[C-] BCP11231 [0,1,0,0,0,0|0,0,1]=2 27 B7R0.10 COC([C@H](N)CCl)=O BCP04711 [0,1,0,0,0,0|3,0,0]=4 28 B7R0.10 COC([C](C)CO)=O BCP16617 [0,1,0,0,0,0|3,0,0]=4 29 B7R0.10 O=C(OC)[C@@H](C)CO BCP07508 [0,1,0,0,0,0|3,0,0]=4 30 B7R0.10 O=C(OC)[C](CO)N BCP15170 [0,1,0,0,0,0|3,0,0]=4 31 B7R0.10 O[C@@H](CO)C(CO)=O BCP10464 [0,1,0,0,0,0|3,0,0]=4 32 B7R1.1 CCN1CCCC1 BCP07071 [0,0,0,1,0,0|3,0,0]=4 33 B7R1.1 CC[C]1NCCC1 BCP11727 [0,0,0,1,0,0|2,0,1]=4 34 B7R1.1 CSC1=NCCS1 BCP14244 [0,0,0,1,0,0|2,1,0]=4 35 B7R1.1 OCC1OCCO1 BCP19203 [0,0,0,1,0,0|1,0,2]=4 36 B7R1.2 O=C1NCC(O)C1 BCP07569 [0,0,0,1,0,0|3,0,0]=4 37 B7R1.2 O=C1OC[C@@H](C)O1 BCP12993 [0,0,0,1,0,0|1,0,0]=2 38 B7R1.3 C=C1CCNCC1 BCP15107 [0,0,0,1,0,0|3,0,0]=4 39 B7R1.3 C[C@@H]1CNCCO1 BCP07192 [0,0,0,1,0,0|2,0,1]=4 40 B7R1.3 C[C]1CNCCO1 BCP16612 [0,0,0,1,0,0|2,0,1]=4 41 B7R1.3 O=C1CCNCC1 BCP15157 [0,0,0,1,0,0|2,0,0]=3 42 B7R1.3 O=C1CCSCC1 BCP09565 [0,0,0,1,0,0|2,0,0]=3 43 B7R1.3 O=C1NCCCC1 BCP00878 [0,0,0,1,0,0|1,0,0]=2 44 B7R1.4 C=C1CCOC1=O BCP18620 [0,0,0,1,0,0|0,0,2]=3 45 B7R1.4 N[C@H]1CCOC1=O BCP20062 [0,0,0,1,0,0|1,0,0]=2 46 B7R1.4 O=C1CCCN1N BCP15282 [0,0,0,1,0,0|3,0,0]=4 47 B7R1.4 O=C1N(N)CCC1 BCP08744 [0,0,0,1,0,0|3,0,0]=4 48 B7R1.4 O=C1OCC[C@@H]1N BCP19716 [0,0,0,1,0,0|1,0,0]=2 49 B7R1.4 OC1CCNC1=O BCP00893 [0,0,0,1,0,0|2,0,0]=3 50 B7R1.22 BrCC(C1CC1)=O BCP05144 [0,0,0,1,0,0|2,0,0]=3 51 B7R1.22 O=C(C1OC1)OC BCP18462 [0,0,0,1,0,0|3,0,0]=4 52 B7R1.22 O=C(OC)[C@@H]1CO1 BCP07553 [0,0,0,1,0,0|3,0,0]=4 53 B7R1.22 O=C([C@@H]1OC1)OC BCP16542 [0,0,0,1,0,0|3,0,0]=4 54 B4R0.1 CC(CBr)=O BCP06577 [2,0,0,0,0,0|1,0,0]=3 55 B4R0.1 C[C@@H](O)CC BCP06774 [2,0,0,0,0,0|0,0,2]=4 56 B4R0.1 O=C(O)CCl BCP20585 [2,0,0,0,0,0|1,0,0]=3 57 B4R0.1 O=CC(O)=O BCP15407 [2,0,0,0,0,0|1,0,1]=4 58 B4R0.1 OC(C#C)=O BCP18740 [2,0,0,0,0,0|0,0,2]=4 59 B4R0.2 NCCOC BCP15361 [2,0,0,0,0,0|1,0,1]=4 60 B6R0.2 CC(C)CC(N)=O BCP05941 [1,1,0,0,0,0|2,0,0]=4 61 B6R0.2 CC(C)NC(C)=O BCP19527 [1,1,0,0,0,0|1,0,0]=3 62 B6R0.2 CC(OC(C)=O)=O BCP20665 [1,1,0,0,0,0|0,0,1]=3 63 B6R0.2 CC(\C=C([O-])C)=O BCP15074 [1,1,0,0,0,0|1,0,1]=4 64 B6R0.2 C[C@@H](N)CC(O)=O BCP11586 [1,1,0,0,0,0|2,0,0]=4 65 B6R0.2 C[C@@H](N)CC(O)=O BCP16924 [1,1,0,0,0,0|2,0,0]=4 66 B6R0.3 CC[C@@H](N)C(O)=O BCP17075 [1,1,0,0,0,0|2,0,0]=4 67 B6R0.3 CC[C](N)C(O)=O BCP04716 [1,1,0,0,0,0|2,0,0]=4 68 B6R0.3 C[C@@H](CC)C(O)=O BCP18859 [1,1,0,0,0,0|2,0,0]=4 69 B6R0.3 NC(CC)C(N)=O BCP08675 [1,1,0,0,0,0|2,0,0]=4 70 B6R0.4 OC(CSCC)=O BCP05241 [1,1,0,0,0,0|1,1,0]=4 71 B6R0.6 CCCCCCO BCP29486 [1,1,0,0,0,0|1,0,1]=4 72 B6R0.9 CCN(CC)CC BCP07310 [1,1,0,0,0,0|2,0,0]=4 73 B6R0.9 CCN(CC)CC BCP16967 [1,1,0,0,0,0|2,0,0]=4 74 B6R0.9 CCN(N=O)CC BCP19136 [1,1,0,0,0,0|1,0,0]=3 75 B6R0.9 CCP(CC)CC BCP04420 [1,1,0,0,0,0|2,0,0]=4 76 B8R0.2 CC([C@H](N)C(OC)=O)C BCP11286 [0,2,0,0,0,0|2,0,0]=4 77 B8R0.5 CCOC(\C=C(N)\C)=O BCP12251 [0,2,0,0,0,0|0,0,1]=3 78 B8R0.5 O=C(OC(C)C)OCCl BCP13081 [0,2,0,0,0,0|1,0,0]=3 79 B8R0.5 O=C(OC(C)C)\C=CI BCP15356 [0,2,0,0,0,0|0,0,2]=4 80 B8R0.19 O=C(OC)CC(O)CCl BCP13432 [0,2,0,0,0,0|2,0,0]=4 81 B8R0.23 O=C([C](C)N)OC(C)C BCP16773 [0,2,0,0,0,0|0,0,1]=3 82 B8R0.1 C#CCCC(=O)CCO BCP18051 [0,2,0,0,0,0|1,0,1]=4 83 B8R0.1 O=C(CC#N)OCCC BCP12769 [0,2,0,0,0,0|0,0,1]=3 84 B8R0.1 O=C(OCC)C#CCC BCP20891 [0,2,0,0,0,0|0,0,0]=2 85 B8R0.1 O=C(OCC)\C=C\C=O BCP16342 [0,2,0,0,0,0|0,0,2]=4 86 B8R0.14 CCOC(=O)C(F)(F)C BCP10917 [0,2,0,0,0,0|0,0,0]=2 87 B8R0.14 O=C(OCC)C(C)(C)N BCP13883 [0,2,0,0,0,0|0,0,0]=2 88 B8R0.14 O=C(OCC)C(F)(Br)F BCP11101 [0,2,0,0,0,0|1,0,0]=3 89 B8R0.22 C#CC(OCC)OCC BCP18205 [0,2,0,0,0,0|1,0,1]=4 90 B6R1.2 CC1CCCO1 BCP16203 [1,0,0,1,0,0|1,0,1]=4 91 B6R1.2 NC1=NCCC1 BCP11252 [1,0,0,1,0,0|2,0,0]=4 92 B6R1.2 O=C1COCC1 BCP14176 [1,0,0,1,0,0|2,0,0]=4 93 B6R1.2 O=C1NCCC1 BCP15175 [1,0,0,1,0,0|1,0,0]=3 94 B6R1.2 O=C1OCC=C1 BCP15247 [1,0,0,1,0,0|0,0,2]=4 95 B6R1.2 O=C1SCCN1 BCP16484 [1,0,0,1,0,0|1,1,0]=4 96 B6R1.1 C1=CCNCC1 BCP09736 [1,0,0,1,0,0|2,0,0]=4 97 B6R1.1 C1CCCCC1 BCP08072 [1,0,0,1,0,0|1,0,1]=4 98 B6R1.1 C1COCCN1 BCP24054 [1,0,0,1,0,0|1,0,1]=4 99 B6R1.1 C1COCCO1 BCP16201 [1,0,0,1,0,0|1,0,1]=4 100 B6R1.1 N1CCCCC1 BCP15342 [1,0,0,1,0,0|1,0,1]=4 101 B6R1.1 O1CCC=CC1 BCP23557 [1,0,0,1,0,0|2,0,0]=4 102 B8R1.4 CN1CCNC(=O)C1 BCP17253 [0,1,0,1,0,0|1,0,0]=3 103 B8R1.4 C[C@@H]1O[C](C)CNC1 BCP10396 [0,1,0,1,0,0|1,0,1]=4 104 B8R1.4 NC=1CCCC(C1)=O BCP19985 [0,1,0,1,0,0|1,0,1]=4 105 B8R1.4 O=C1CC(N)CCN1 BCP07513 [0,1,0,1,0,0|1,0,0]=3 106 B8R1.4 O=C1NCC[C](O)C1 BCP14222 [0,1,0,1,0,0|1,0,1]=4 107 B8R1.4 OC1CCNC(=O)C1 BCP11689 [0,1,0,1,0,0|1,0,0]=3 108 B8R1.2 O=CN1CCCCC1 BCP20086 [0,1,0,1,0,0|2,0,0]=4 109 B8R1.3 O=C1NCC(C)CC1 BCP14293 [0,1,0,1,0,0|1,0,0]=3 110 B8R1.5 O=C1C(O)CCCO1 BCP06471 [0,1,0,1,0,0|0,0,0]=2 111 B8R1.5 O=C1CCOCC1C BCP07576 [0,1,0,1,0,0|1,0,0]=3 112 B8R1.39 COC(=O)C1(Br)CC1 BCP14088 [0,1,0,1,0,0|2,0,0]=4 113 B8R1.72 O=S1(CCCCO1)=O BCP23575 [0,1,0,1,0,0|1,0,0]=3