0 B6R0.5 C=CCC(C)(C)N SY264947 [1,0,0,0,0,0|2,0,1]=4 1 B6R0.5 CC(C)(C)CCBr SY031960 [1,0,0,0,0,0|2,0,0]=3 2 B6R0.5 CC(C)(C)CCN SY123555 [1,0,0,0,0,0|2,0,0]=3 3 B6R0.5 CC(C)(C)CON SY149479 [1,0,0,0,0,0|2,0,0]=3 4 B6R0.5 CC(C)(C)CON SY281749 [1,0,0,0,0,0|2,0,0]=3 5 B6R0.5 CC(C)(I)CCO SY248398 [1,0,0,0,0,0|3,0,0]=4 6 B6R0.5 CC(C)(N)CCO SY025601 [1,0,0,0,0,0|3,0,0]=4 7 B6R0.5 CC(C)(N)CCO SY029973 [1,0,0,0,0,0|3,0,0]=4 8 B6R0.5 CC(C)(O)CCBr SY043014 [1,0,0,0,0,0|2,0,0]=3 9 B6R0.5 CC(C)(O)CON SY164879 [1,0,0,0,0,0|2,0,0]=3 10 B6R0.5 CNCC(C)(C)O SY123563 [1,0,0,0,0,0|0,0,2]=3 11 B6R0.5 COCC(C)(C)N SY023626 [1,0,0,0,0,0|2,0,1]=4 12 B6R0.5 COCC(C)(C)N SY026408 [1,0,0,0,0,0|2,0,1]=4 13 B6R0.5 COCC(C)(C)O SY285974 [1,0,0,0,0,0|1,0,1]=3 14 B6R0.5 CSCC(C)(C)N SY196988 [1,0,0,0,0,0|2,0,1]=4 15 B6R0.5 C[N+](C)(C)CCO SY129307 [1,0,0,0,0,0|3,0,0]=4 16 B6R0.5 C[Si](C)(C)CC#N SY107268 [1,0,0,0,0,0|2,1,0]=4 17 B6R0.5 C[Si](C)(C)CCCl SY201843 [1,0,0,0,0,0|2,1,0]=4 18 B6R0.8 CC(C)(C#N)CBr SY250128 [1,0,0,0,0,0|3,0,0]=4 19 B6R0.8 CC(C)(C#N)CO SY045527 [1,0,0,0,0,0|3,0,0]=4 20 B6R0.8 CC(C)(C=O)CO SY107563 [1,0,0,0,0,0|3,0,0]=4 21 B6R0.8 CC(C)(CBr)CBr SY038454 [1,0,0,0,0,0|3,0,0]=4 22 B6R0.8 CC(C)(CN)CF SY276712 [1,0,0,0,0,0|2,0,1]=4 23 B6R0.8 CC(C)(CO)CBr SY039504 [1,0,0,0,0,0|3,0,0]=4 24 B6R0.8 CNC(C)(C)CBr SY283913 [1,0,0,0,0,0|2,0,0]=3 25 B6R0.8 CNC(C)(C)CO SY033902 [1,0,0,0,0,0|2,0,0]=3 26 B6R0.8 COC(C)(C)CBr SY007681 [1,0,0,0,0,0|1,0,0]=2 27 B6R0.8 COC(C)(C)CN SY195711 [1,0,0,0,0,0|0,0,1]=2 28 B6R0.8 COC(C)(C)CO SY162215 [1,0,0,0,0,0|1,0,0]=2 29 B8R1.51 CC1(C)CC(Cl)=NO1 SY251058 [0,0,0,1,0,0|3,0,0]=4 30 B8R1.51 CC1(C)CCC(=O)C1 SY043145 [0,0,0,1,0,0|3,0,0]=4 31 B8R1.51 CN1CCC(C)(C)C1 SY275505 [0,0,0,1,0,0|1,0,2]=4 32 B8R1.72 CC1(C)CCNCC1 SY023190 [0,0,0,1,0,0|3,0,0]=4 33 B8R1.72 CC1(C)CCNCC1 SY025578 [0,0,0,1,0,0|3,0,0]=4 34 B8R1.72 CC1(C)CNCCN1 SY022639 [0,0,0,1,0,0|1,0,2]=4 35 B8R1.72 CC1(C)CNCCO1 SY005344 [0,0,0,1,0,0|0,0,2]=3 36 B8R1.72 CC1(C)CNCCO1 SY097274 [0,0,0,1,0,0|0,0,2]=3 37 B8R1.72 CC1(C)COCCN1 SY024354 [0,0,0,1,0,0|2,0,1]=4 38 B5R0.1 CC(C)CON SY013358 [2,0,0,0,0,0|2,0,0]=4 39 B5R0.1 CC(O)CCBr SY216789 [2,0,0,0,0,0|2,0,0]=4 40 B5R0.1 CCC[C@@H](C)O SY045083 [2,0,0,0,0,0|1,0,1]=4 41 B5R0.1 CNCC(C)O SY083968 [2,0,0,0,0,0|0,0,2]=4 42 B5R0.1 CNC[C@H](C)O SY131109 [2,0,0,0,0,0|0,0,2]=4 43 B5R0.1 C[C@@H](O)CCO SY049450 [2,0,0,0,0,0|2,0,0]=4 44 B5R0.2 C#CCCOC SY261977 [2,0,0,0,0,0|1,0,1]=4 45 B5R0.2 COCCNN SY048076 [2,0,0,0,0,0|1,0,1]=4 46 B5R0.3 C#C[C@H](C)OC SY282343 [2,0,0,0,0,0|0,0,2]=4 47 B5R0.3 CNC(C)CO SY082195 [2,0,0,0,0,0|2,0,0]=4 48 B5R0.3 COC(C)CBr SY298794 [2,0,0,0,0,0|1,0,0]=3 49 B5R0.3 CO[C@@H](C)CN SY114788 [2,0,0,0,0,0|0,0,1]=3 50 B5R0.4 CC(C)(C)CCl SY048171 [2,0,0,0,0,0|1,0,0]=3 51 B5R0.4 CC(C)(C)NO SY036171 [2,0,0,0,0,0|1,0,1]=4 52 B5R0.4 CC(C)(C)ON SY025901 [2,0,0,0,0,0|1,0,0]=3 53 B5R0.4 CC(C)(F)CBr SY027377 [2,0,0,0,0,0|2,0,0]=4 54 B5R0.4 CC(C)(F)CI SY028245 [2,0,0,0,0,0|2,0,0]=4 55 B5R0.4 CC(C)(F)CO SY029466 [2,0,0,0,0,0|2,0,0]=4 56 B5R0.4 CC(C)(O)CBr SY236333 [2,0,0,0,0,0|1,0,0]=3 57 B5R0.4 CC(C)(O)CN SY022204 [2,0,0,0,0,0|0,0,1]=3 58 B5R0.4 CC(C)(O)CO SY107922 [2,0,0,0,0,0|1,0,0]=3 59 B5R0.4 CO[Si](C)(C)Cl SY249087 [2,0,0,0,0,0|1,1,0]=4 60 B7R0.10 [C-]#[N+]C(C)C(=O)OC SY204645 [1,1,0,0,0,0|1,0,1]=4 61 B7R0.12 COCC(OC)OC SY050730 [1,1,0,0,0,0|1,0,1]=4 62 B7R0.8 CC(C)(O)CCCN SY024445 [1,1,0,0,0,0|1,0,1]=4 63 B7R0.8 CCCCC(C)(C)O SY051607 [1,1,0,0,0,0|1,0,1]=4 64 B7R0.9 CC(C)(C)CB(O)O SY066938 [1,1,0,0,0,0|2,0,0]=4 65 B7R0.9 CC(C)(O)CC(=O)O SY032937 [1,1,0,0,0,0|2,0,0]=4 66 B7R0.14 CC(C)(C)[C@@H](N)CO SY101530 [1,1,0,0,0,0|2,0,0]=4 67 B7R0.14 CC(C)(C)[C@H](N)CO SY038947 [1,1,0,0,0,0|2,0,0]=4 68 B7R0.14 CC(C)(O)C(F)CN SY246486 [1,1,0,0,0,0|2,0,0]=4 69 B7R0.14 CC(C)(O)[C@H](F)CN SY038852 [1,1,0,0,0,0|2,0,0]=4 70 B7R0.13 CC(=O)C(C)(C)CO SY143436 [1,1,0,0,0,0|2,0,0]=4 71 B7R0.13 COC(C)(C)C(=O)O SY013214 [1,1,0,0,0,0|1,0,1]=4 72 B7R0.18 COC(C)(CBr)OC SY078679 [1,1,0,0,0,0|1,0,0]=3 73 B7R0.18 COC(C)(CN)OC SY116006 [1,1,0,0,0,0|0,0,1]=3 74 B9R0.62 COC(CC#N)(OC)OC SY257806 [0,2,0,0,0,0|2,0,0]=4 75 B7R1.1 COC1CCNC1 SY043121 [1,0,0,1,0,0|0,0,2]=4 76 B7R1.1 COC1CCNC1 SY097408 [1,0,0,1,0,0|0,0,2]=4 77 B7R1.1 CO[C@@H]1CCNC1 SY042148 [1,0,0,1,0,0|0,0,2]=4 78 B7R1.1 CO[C@@H]1CCNC1 SY056981 [1,0,0,1,0,0|0,0,2]=4 79 B7R1.1 CO[C@H]1CCNC1 SY042488 [1,0,0,1,0,0|0,0,2]=4 80 B7R1.3 CC1CNCCO1 SY008226 [1,0,0,1,0,0|0,0,2]=4 81 B7R1.3 C[C@@H]1CNCCO1 SY021208 [1,0,0,1,0,0|0,0,2]=4 82 B7R1.3 C[C@@H]1CNCCO1 SY032742 [1,0,0,1,0,0|0,0,2]=4 83 B7R1.3 C[C@H]1CNCCO1 SY021210 [1,0,0,1,0,0|0,0,2]=4 84 B7R1.3 C[C@H]1CNCCO1 SY043150 [1,0,0,1,0,0|0,0,2]=4 85 B7R1.6 OCCC1CCO1 SY099736 [1,0,0,1,0,0|2,0,0]=4 86 B7R1.9 COC1CC1C=O SY277013 [1,0,0,1,0,0|2,0,0]=4 87 B7R1.10 COC1CC(=O)C1 SY098914 [1,0,0,1,0,0|2,0,0]=4 88 B7R1.10 CO[C@H]1C[C@H](N)C1 SY100296 [1,0,0,1,0,0|2,0,0]=4 89 B7R1.25 COC1(C)CNC1 SY042211 [1,0,0,1,0,0|0,0,2]=4 90 B7R1.14 CC1(C)CCNC1 SY042120 [1,0,0,1,0,0|0,0,2]=4 91 B7R1.14 CC1(O)CCNC1 SY036721 [1,0,0,1,0,0|0,0,2]=4 92 B7R1.14 C[C@@]1(O)CCNC1 SY233757 [1,0,0,1,0,0|0,0,2]=4 93 B7R1.14 C[C@@]1(O)CCNC1 SY310803 [1,0,0,1,0,0|0,0,2]=4 94 B7R1.14 C[C@]1(O)CCNC1 SY233715 [1,0,0,1,0,0|0,0,2]=4 95 B7R1.14 C[C@]1(O)CCNC1 SY233747 [1,0,0,1,0,0|0,0,2]=4 96 B7R1.16 CC1(O)CC(=O)C1 SY297165 [1,0,0,1,0,0|2,0,0]=4 97 B7R1.16 CC1(O)CC(O)C1 SY297164 [1,0,0,1,0,0|2,0,0]=4 98 B7R1.16 C[C@]1(O)C[C@@H](N)C1 SY099872 [1,0,0,1,0,0|2,0,0]=4 99 B7R1.16 C[C@]1(O)C[C@H](N)C1 SY099871 [1,0,0,1,0,0|2,0,0]=4 100 B7R1.23 CC1(C)OC1CBr SY250816 [1,0,0,1,0,0|2,0,0]=4 101 B9R1.10 CC1(C)OCC(=O)CO1 SY023891 [0,1,0,1,0,0|2,0,0]=4 102 B9R1.10 CC1(C)OCC(N)CO1 SY113706 [0,1,0,1,0,0|2,0,0]=4 103 B9R1.133 CC1(C)OCC(CCl)O1 SY038108 [0,1,0,1,0,0|2,0,0]=4 104 B9R1.133 CC1(C)OCC(CO)O1 SY010573 [0,1,0,1,0,0|2,0,0]=4 105 B9R1.133 CC1(C)OC[C@@H](CBr)O1 SY273809 [0,1,0,1,0,0|2,0,0]=4 106 B9R1.133 CC1(C)OC[C@@H](CCl)O1 SY014847 [0,1,0,1,0,0|2,0,0]=4 107 B9R1.133 CC1(C)OC[C@@H](CO)O1 SY017621 [0,1,0,1,0,0|2,0,0]=4 108 B9R1.133 CC1(C)OC[C@H](CBr)O1 SY264708 [0,1,0,1,0,0|2,0,0]=4 109 B9R1.133 CC1(C)OC[C@H](CCl)O1 SY016487 [0,1,0,1,0,0|2,0,0]=4 110 B9R1.133 CC1(C)OC[C@H](CN)O1 SY275114 [0,1,0,1,0,0|2,0,0]=4 111 B9R1.133 CC1(C)OC[C@H](CO)O1 SY017180 [0,1,0,1,0,0|2,0,0]=4 112 B9R1.66 CC1(C)CC(=O)CCO1 SY006372 [0,1,0,1,0,0|1,0,1]=4 113 B9R1.66 CC1(C)CC(N)CCO1 SY022790 [0,1,0,1,0,0|1,0,1]=4 114 B9R1.66 CC1(C)CC(O)CCO1 SY023965 [0,1,0,1,0,0|1,0,1]=4 115 B9R1.134 CC1(CCI)OCCO1 SY027724 [0,1,0,1,0,0|2,0,0]=4 116 B9R1.134 CC1(CCN)OCCO1 SY008158 [0,1,0,1,0,0|2,0,0]=4 117 B9R1.134 CC1(CCO)OCCO1 SY026035 [0,1,0,1,0,0|2,0,0]=4 118 B9R2.139 OC1COC2(CC2)C1 SY262504 [0,0,0,2,0,0|2,0,0]=4 119 B9R2.174 C1COC2(CC2)CN1 SY039549 [0,0,0,2,0,0|0,0,2]=4 120 B9R2.174 C1COC2(CC2)CN1 SY123756 [0,0,0,2,0,0|0,0,2]=4