0 B8R0.1 C=CCCC(=O)OCC AMY3888 [0,0,0,0,0,0|1,0,3]=4 1 B8R0.1 CCC#CC(=O)OCC AMY1274 [0,0,0,0,0,0|1,0,2]=3 2 B8R0.1 CCOC(=O)CCCBr AM84904 [0,0,0,0,0,0|2,0,2]=4 3 B8R0.1 CCOC(=O)CCCN AM808169 [0,0,0,0,0,0|2,0,2]=4 4 B8R0.1 CCOC(=O)CCCO AMY4323 [0,0,0,0,0,0|2,0,2]=4 5 B8R0.1 CCOC(=O)CN=C=O AMY3222 [0,0,0,0,0,0|3,0,1]=4 6 B8R0.1 CCOC(=O)CNC=O AM20090452 [0,0,0,0,0,0|3,0,1]=4 7 B8R0.1 CCOC(=O)\C=C\C=O AMY39019 [0,0,0,0,0,0|2,0,0]=2 8 B8R0.1 CCOC(=O)\C=C\CBr AMF0008 [0,0,0,0,0,0|2,0,0]=2 9 B8R0.1 CCOCC(=O)OCC AMY4116 [0,0,0,0,0,0|2,0,1]=3 10 B7R0.3 CCCOC(=O)CC AMY21939 [1,0,0,0,0,0|2,0,1]=4 11 B7R0.3 CNCCC(=O)OC AMY4326 [1,0,0,0,0,0|1,0,2]=4 12 B7R0.3 COC(=O)\C=C\C#N AMY6967 [1,0,0,0,0,0|2,0,0]=3 13 B7R0.3 COC(=O)\C=C\CBr AMY14793 [1,0,0,0,0,0|2,0,0]=3 14 B7R0.3 CO\C=C\C(=O)OC AMY18381 [1,0,0,0,0,0|0,1,0]=2 15 B7R0.7 C=C(OCC)OCC AM9861 [1,0,0,0,0,0|2,0,1]=4 16 B7R0.7 C=CCC(=O)OCC AMY30553 [1,0,0,0,0,0|0,0,2]=3 17 B7R0.7 CC#CC(=O)OCC AM86969 [1,0,0,0,0,0|0,0,2]=3 18 B7R0.7 CCCC(=O)CCC AMY3807 [1,0,0,0,0,0|1,0,2]=4 19 B7R0.7 CCNC(=O)NCC AMY25735 [1,0,0,0,0,0|2,0,1]=4 20 B7R0.7 CCOC(=O)CC=O AMY18659 [1,0,0,0,0,0|0,1,1]=3 21 B7R0.7 CCOC(=O)CCN AM803889 [1,0,0,0,0,0|1,0,2]=4 22 B7R0.7 CCOC(=O)CCO AMY20483 [1,0,0,0,0,0|0,1,2]=4 23 B7R0.7 CCOC(=O)CNC AM82644 [1,0,0,0,0,0|1,0,1]=3 24 B7R0.7 CCOC(=O)CNC AMY3815 [1,0,0,0,0,0|1,0,1]=3 25 B7R0.7 CCOC(=O)CNN AM20100649 [1,0,0,0,0,0|2,0,1]=4 26 B7R0.7 CCOC(=O)COC AMY3969 [1,0,0,0,0,0|0,1,1]=3 27 B7R0.7 CCOC(=O)CSC AMY33462 [1,0,0,0,0,0|0,0,1]=2 28 B7R0.7 CCOC(=O)N=C=O AMY771 [1,0,0,0,0,0|1,1,1]=4 29 B7R0.7 CCOC(=O)N=C=S AMY10862 [1,0,0,0,0,0|1,0,2]=4 30 B7R0.7 CCOC(=O)OCC AMY11101 [1,0,0,0,0,0|1,0,1]=3 31 B7R0.7 CCOC(=O)OCCl AMY14438 [1,0,0,0,0,0|2,0,1]=4 32 B7R0.7 CCOC(=O)\C=C/N AM87196 [1,0,0,0,0,0|1,0,0]=2 33 B7R0.7 CCOC(=O)\C=C\I AM805822 [1,0,0,0,0,0|1,0,0]=2 34 B7R0.7 CCOC(=O)\C=C\[O-] AMY34242 [1,0,0,0,0,0|0,1,0]=2 35 B7R0.7 CCOS(=O)OCC AMY17996 [1,0,0,0,0,0|2,0,1]=4 36 B7R0.7 [C-]#[N+]CC(=O)OCC AMY403 [1,0,0,0,0,0|1,0,2]=4 37 B9R0.5 CCOC(=O)CCCCBr AM20080354 [0,1,0,0,0,0|1,0,2]=4 38 B9R0.5 CCO\C=C\C(=O)OCC AMY9319 [0,1,0,0,0,0|0,1,0]=2 39 B9R0.5 CCO\N=C\C(=O)OCC AMY13649 [0,1,0,0,0,0|1,1,0]=3 40 B9R0.34 CCOC(=O)CC(=O)CBr AM807438 [0,1,0,0,0,0|2,0,1]=4 41 B9R0.34 CCOC(=O)CC(=O)NC AM85887 [0,1,0,0,0,0|1,0,1]=3 42 B9R0.34 CCOC(=O)CC(=O)NN AMY3069 [0,1,0,0,0,0|2,0,1]=4 43 B9R0.35 CCOC(=O)C(=O)OCC AMY37179 [0,1,0,0,0,0|2,0,0]=3 44 B9R0.48 CCOC(=O)C=CC(F)F AM806388 [0,1,0,0,0,0|2,0,0]=3 45 B9R0.48 CCOC(=O)CNC(C)=O AM20090112 [0,1,0,0,0,0|2,0,1]=4 46 B9R0.48 CCOC(=O)\C=C\N(C)C AM1222 [0,1,0,0,0,0|1,0,0]=2 47 B9R1.8 CCOC1=NC=CC=C1 AM20061677 [0,0,0,1,0,0|2,0,1]=4 48 B9R1.73 CCOC(=O)C1CCC1 AM20070593 [0,0,0,1,0,0|1,0,2]=4 49 B9R1.73 CCOC(=O)C1CNC1 AM20100083 [0,0,0,1,0,0|1,0,2]=4 50 B9R1.73 CCOC(=O)C1CNC1 AM85915 [0,0,0,1,0,0|1,0,2]=4 51 B9R1.73 CCOC(=O)[C@@H]1CCN1 AMY6563 [0,0,0,1,0,0|2,0,1]=4 52 B9R1.75 CCOC(=O)C=C1CC1 AMY37969 [0,0,0,1,0,0|1,0,0]=2 53 B9R1.75 CCOC(=O)CC1CC1 AMY4002 [0,0,0,1,0,0|1,0,2]=4 54 B6R0.1 C#CC(=O)OCC AM20100525 [2,0,0,0,0,0|0,0,2]=4 55 B6R0.1 C=CC(=O)NCC AMY36703 [2,0,0,0,0,0|1,0,0]=3 56 B6R0.1 C=CC(=O)OCC AMY40211 [2,0,0,0,0,0|0,0,0]=2 57 B6R0.1 CC#CC(=O)OC AMY1234 [2,0,0,0,0,0|0,0,2]=4 58 B6R0.1 CCNC(=O)NC AM85700 [2,0,0,0,0,0|2,0,0]=4 59 B6R0.1 CCOC(=O)CBr AM20070701 [2,0,0,0,0,0|1,0,1]=4 60 B6R0.1 CCOC(=O)CC AMY21941 [2,0,0,0,0,0|0,0,1]=3 61 B6R0.1 CCOC(=O)CN AM81786 [2,0,0,0,0,0|1,0,1]=4 62 B6R0.1 CCOC(=O)NC AMY3767 [2,0,0,0,0,0|1,0,0]=3 63 B6R0.1 CCOC(=O)NN AMY23328 [2,0,0,0,0,0|2,0,0]=4 64 B6R0.1 CNCC(=O)OC AM82645 [2,0,0,0,0,0|1,0,1]=4 65 B6R0.1 COC(=O)CSC AMY10908 [2,0,0,0,0,0|0,0,1]=3 66 B6R0.1 COC(=O)OCCl AMY37648 [2,0,0,0,0,0|1,1,0]=4 67 B6R0.1 COC(=O)\C=C\I AMY21721 [2,0,0,0,0,0|1,0,0]=3 68 B6R0.1 COCC(=O)OC AMY4063 [2,0,0,0,0,0|0,1,1]=4 69 B6R0.1 C\C=C\C(=O)OC AMY15442 [2,0,0,0,0,0|0,0,0]=2 70 B6R0.4 O=C(O)\C=C\CBr AMY7050 [2,0,0,0,0,0|2,0,0]=4 71 B8R0.3 CCOC(=O)C(=O)CC AM20080427 [1,1,0,0,0,0|2,0,0]=4 72 B8R0.19 CCC(=O)CC(=O)CC AMY8840 [1,1,0,0,0,0|1,0,1]=4 73 B8R0.19 CCC(=O)CC(=O)OC AMY21932 [1,1,0,0,0,0|0,1,1]=4 74 B8R0.19 COC(=N)CC(=O)OC AMY31003 [1,1,0,0,0,0|0,1,1]=4 75 B8R0.19 COC(=O)CC(=O)OC AMY10014 [1,1,0,0,0,0|0,1,1]=4 76 B8R0.19 COC(=O)\C=C(/C)C=O AMY39195 [1,1,0,0,0,0|2,0,0]=4 77 B8R0.5 CCOC(=O)C=C(F)F AMY14713 [1,1,0,0,0,0|1,0,0]=3 78 B8R0.5 CCOC(=O)CC(=N)N AM803971 [1,1,0,0,0,0|1,0,1]=4 79 B8R0.5 CCOC(=O)CC(=N)N AMY16018 [1,1,0,0,0,0|1,0,1]=4 80 B8R0.5 CCOC(=O)CC(=O)Cl AM90203 [1,1,0,0,0,0|0,1,1]=4 81 B8R0.5 CCOC(=O)CC(=O)O AMY3657 [1,1,0,0,0,0|0,1,1]=4 82 B8R0.5 CCOC(=O)CC(=O)[O-] AMY4053 [1,1,0,0,0,0|0,1,1]=4 83 B8R0.5 CCOC(=O)CC(N)=O AMY2619 [1,1,0,0,0,0|0,1,1]=4 84 B8R0.5 CCOC(=O)CN(C)C AMY3944 [1,1,0,0,0,0|1,0,1]=4 85 B8R0.5 CCOC(=O)C[C@H](C)Br AM9919 [1,1,0,0,0,0|0,0,2]=4 86 B8R0.5 CCOC(=O)C[C@H](C)N AMY314 [1,1,0,0,0,0|0,0,2]=4 87 B8R0.5 COCC(=O)OC(C)C AMY3876 [1,1,0,0,0,0|0,1,1]=4 88 B10R0.32 C=C(NC(C)=O)C(=O)OCC AMY31994 [0,2,0,0,0,0|2,0,0]=4 89 B10R0.32 CCOC(=O)C(=O)CC(C)=O AM85846 [0,2,0,0,0,0|1,0,1]=4 90 B10R0.32 CCOC(=O)C(=O)CC(C)C AM85684 [0,2,0,0,0,0|1,0,1]=4 91 B10R0.2 CCC\C(N)=C\C(=O)OCC AMY39750 [0,2,0,0,0,0|1,0,0]=3 92 B10R0.2 CCOC(=N)CC(=O)OCC AMY32481 [0,2,0,0,0,0|0,1,1]=4 93 B10R0.2 CCOC(=O)CC(=O)OCC AMY37124 [0,2,0,0,0,0|0,1,1]=4 94 B10R0.2 CCOC(=O)\C=C(/N)OCC AM10152 [0,2,0,0,0,0|0,1,0]=3 95 B10R0.19 CCCCC(=O)C(=O)OCC AM85828 [0,2,0,0,0,0|1,0,1]=4 96 B10R0.19 CCOC(=O)[C@@H](N)CCSC AM81985 [0,2,0,0,0,0|0,0,2]=4 97 B10R0.19 CCOC(=O)[C@@H](N)CCSC AM81986 [0,2,0,0,0,0|0,0,2]=4 98 B10R0.35 CCOC(=O)[C@@H](Cl)C(=O)CC AMY32491 [0,2,0,0,0,0|1,0,1]=4 99 B10R0.35 CCOC(=O)[C@@H](F)C(=O)CC AM62557 [0,2,0,0,0,0|1,0,1]=4 100 B10R0.109 CCOC(=O)\C=C\C(F)(F)F AM20090309 [0,2,0,0,0,0|2,0,0]=4 101 B8R1.2 COC1=CCOCC1 AMY33855 [1,0,0,1,0,0|0,1,1]=4 102 B8R1.8 CCOC1=NNC=C1 AMY5033 [1,0,0,1,0,0|2,0,0]=4 103 B8R1.49 C1=CCCCCC=C1 AMY19658 [1,0,0,1,0,0|2,0,0]=4 104 B8R1.1 COC1=CC(=O)NC1 AMY31183 [1,0,0,1,0,0|1,1,0]=4 105 B8R1.1 O=C1C=C(CBr)CO1 AMY20313 [1,0,0,1,0,0|2,0,0]=4 106 B8R1.3 C[C@@H]1C=CC(=O)CC1 AMY6166 [1,0,0,1,0,0|1,0,0]=3 107 B8R1.4 CC1=C[C@H](C)OCC1 AMY6011 [1,0,0,1,0,0|1,0,1]=4 108 B8R1.18 CC1=CC(=O)O[C@@H]1O AMY11083 [1,0,0,1,0,0|1,0,0]=3 109 B8R1.37 CCOC(=O)C1CC1 AMY3988 [1,0,0,1,0,0|0,0,2]=4 110 B8R1.37 CCOC(=O)[C@@H]1CO1 AMY5207 [1,0,0,1,0,0|0,1,1]=4 111 B8R1.37 CCOC(=O)[C@H]1CO1 AMY31967 [1,0,0,1,0,0|0,1,1]=4 112 B10R1.130 CCCC1=CC(=O)O[C@@H]1O AMY16474 [0,1,0,1,0,0|2,0,0]=4 113 B10R1.11 CCOC(=O)C1=CC=CN1 AM20090208 [0,1,0,1,0,0|1,0,1]=4 114 B10R1.11 CCOC(=O)C1=CC=NN1 AM20100443 [0,1,0,1,0,0|2,0,0]=4 115 B10R1.11 CCOC(=O)C1=CC=NO1 AMY38619 [0,1,0,1,0,0|2,0,0]=4 116 B10R1.11 CCOC(=O)C1=CCCC1 AM802851 [0,1,0,1,0,0|1,0,0]=3 117 B10R1.11 CCOC(=O)C1=CN=CO1 AM20080129 [0,1,0,1,0,0|1,0,1]=4 118 B10R1.11 CCOC(=O)C1=CN=CS1 AM20090493 [0,1,0,1,0,0|1,0,1]=4 119 B10R1.11 CCOC(=O)C1=CNC=C1 AM803817 [0,1,0,1,0,0|1,0,1]=4 120 B10R1.11 CCOC(=O)C1=CNC=N1 AMY4411 [0,1,0,1,0,0|1,0,1]=4 121 B10R1.11 CCOC(=O)C1=CNN=C1 AM20100002 [0,1,0,1,0,0|1,0,1]=4 122 B10R1.11 CCOC(=O)C1=CNN=N1 AM803858 [0,1,0,1,0,0|2,0,0]=4 123 B10R1.11 CCOC(=O)C1=COC=N1 AM20090240 [0,1,0,1,0,0|0,1,1]=4 124 B10R1.11 CCOC(=O)C1=CON=C1 AM90129 [0,1,0,1,0,0|0,1,1]=4 125 B10R1.11 CCOC(=O)C1=CSC=C1 AMY13380 [0,1,0,1,0,0|0,0,1]=3 126 B10R1.11 CCOC(=O)C1=CSC=N1 AMY9322 [0,1,0,1,0,0|0,0,1]=3 127 B10R1.11 CCOC(=O)C1=CSN=N1 AM803845 [0,1,0,1,0,0|1,0,0]=3 128 B10R1.11 CCOC(=O)C1=NC=CN1 AM20080883 [0,1,0,1,0,0|2,0,0]=4 129 B10R1.11 CCOC(=O)C1=NC=CO1 AM20090498 [0,1,0,1,0,0|2,0,0]=4 130 B10R1.11 CCOC(=O)C1=NC=CS1 AMY20513 [0,1,0,1,0,0|2,0,0]=4 131 B10R1.11 CCOC(=O)C1=NOC=C1 AMY12191 [0,1,0,1,0,0|1,1,0]=4 132 B10R1.11 CCOC(=O)C1=NOC=N1 AM20210016 [0,1,0,1,0,0|1,1,0]=4 133 B10R1.11 CCOC(=O)N1C=CN=C1 AMY10117 [0,1,0,1,0,0|1,0,1]=4 134 B10R1.11 CCOC(=O)[C@@H]1CSCN1 AMY3299 [0,1,0,1,0,0|0,0,2]=4 135 B10R1.137 CCOC(=O)C=C1CCC1 AMY40990 [0,1,0,1,0,0|1,0,0]=3 136 B10R1.137 CCOC(=O)C=C1COC1 AM20020054 [0,1,0,1,0,0|0,1,0]=3 137 B10R1.137 CCOC(=O)C=C1CSC1 AMY32154 [0,1,0,1,0,0|0,0,0]=2 138 B10R1.212 CCOC(=O)C(C)=C1CC1 AM806695 [0,1,0,1,0,0|1,0,0]=3 139 B10R1.211 CN(C)\C=C\C(=O)C1CC1 AM86764 [0,1,0,1,0,0|2,0,0]=4 140 B10R2.32 O=C1C=C[C@H]2CCCN12 AMY461 [0,0,0,2,0,0|2,0,0]=4