0 B7R0.5 CC(C)N(C)CCN DY604213 [0,0,0,0,0,0|4,0,0]=4 1 B7R0.5 CCCC(=O)N(C)C DY584357 [0,0,0,0,0,0|2,0,0]=2 2 B7R0.5 CCNC(=O)C(C)Cl DY605068 [0,0,0,0,0,0|2,0,0]=2 3 B7R0.5 CCOC(=O)C(Br)Br DY584292 [0,0,0,0,0,0|2,0,0]=2 4 B7R0.5 CCOC(=O)C(C)C NO11388 [0,0,0,0,0,0|0,0,0]=0 5 B7R0.5 CCOC(=O)C(C)N DY628935 [0,0,0,0,0,0|1,0,0]=1 6 B7R0.5 CCOC(=O)C(F)F NO11385 [0,0,0,0,0,0|2,0,0]=2 7 B7R0.5 CCOC(=O)C(N)=S NO11392 [0,0,0,0,0,0|2,0,1]=3 8 B7R0.5 CCOC(=O)[C@@H](C)O NO20075 [0,0,0,0,0,0|1,0,0]=1 9 B7R0.5 CN(C)C(=O)CCO DY606315 [0,0,0,0,0,0|3,0,0]=3 10 B6R0.1 CCCC(=O)NN NO22544 [1,0,0,0,0,0|3,0,0]=4 11 B6R0.1 CCNC(=O)CN DY461322 [1,0,0,0,0,0|2,0,0]=3 12 B6R0.1 CCOC(=O)CC DY460554 [1,0,0,0,0,0|0,0,0]=1 13 B6R0.1 CCOC(=O)CN DY700831 [1,0,0,0,0,0|1,0,0]=2 14 B6R0.1 CCOC(=O)CN NO15347 [1,0,0,0,0,0|1,0,0]=2 15 B6R0.1 CCOC(=O)CO NO11386 [1,0,0,0,0,0|1,0,0]=2 16 B6R0.1 CCOC(=O)NN NO11383 [1,0,0,0,0,0|2,0,0]=3 17 B6R0.1 COC(=O)CCCl DY741043 [1,0,0,0,0,0|3,0,0]=4 18 B6R0.1 COC(=O)CCN NO22266 [1,0,0,0,0,0|3,0,0]=4 19 B6R0.1 COC(=O)CSC DY460536 [1,0,0,0,0,0|3,0,0]=4 20 B6R0.1 O=C(CCl)NCO NO14580 [1,0,0,0,0,0|3,0,0]=4 21 B6R0.3 C=CC(=O)N(C)C DY545499 [1,0,0,0,0,0|1,0,2]=4 22 B6R0.3 CC(C)C(=O)CCl DY740659 [1,0,0,0,0,0|1,0,0]=2 23 B6R0.3 CC(C)[C@@H](N)CO NO22659 [1,0,0,0,0,0|2,0,1]=4 24 B6R0.3 CC(C)[C@H](N)CO NO17224 [1,0,0,0,0,0|2,0,1]=4 25 B6R0.3 CC(C)\C(N)=N\O DY574395 [1,0,0,0,0,0|3,0,0]=4 26 B6R0.3 CC(O)C(=O)O[Ag] DY527883 [1,0,0,0,0,0|2,0,0]=3 27 B6R0.3 CCC(=O)C(=O)O NO21626 [1,0,0,0,0,0|2,0,1]=4 28 B6R0.3 CN(C)C(=O)CBr NO14025 [1,0,0,0,0,0|2,0,0]=3 29 B6R0.3 CN(C)C(=O)CCl DY545469 [1,0,0,0,0,0|2,0,0]=3 30 B6R0.3 CN(C)C(=O)CN NO21306 [1,0,0,0,0,0|2,0,0]=3 31 B6R0.3 CNC(=O)[C@@H](C)N DY608176 [1,0,0,0,0,0|2,0,0]=3 32 B6R0.3 CNC(=O)[C@H](C)N DY436151 [1,0,0,0,0,0|2,0,0]=3 33 B6R0.3 COC(=O)C(C)Br NO14958 [1,0,0,0,0,0|1,0,0]=2 34 B6R0.3 COC(=O)C(C)C DY41931 [1,0,0,0,0,0|0,0,0]=1 35 B6R0.3 COC(=O)C(C)N NO22242 [1,0,0,0,0,0|1,0,0]=2 36 B6R0.3 COC(=O)[C@@H](C)N NO16663 [1,0,0,0,0,0|1,0,0]=2 37 B6R0.3 COC(=O)[C@H](C)Cl NO15798 [1,0,0,0,0,0|1,0,0]=2 38 B6R0.3 COC(=O)[C@H](C)N DY500966 [1,0,0,0,0,0|1,0,0]=2 39 B6R0.4 C=COCC(C)C DY822723 [1,0,0,0,0,0|0,0,3]=4 40 B6R0.4 CC(C)CCCBr DY740443 [1,0,0,0,0,0|2,0,1]=4 41 B6R0.4 CC(C)NCCN DY20461 [1,0,0,0,0,0|3,0,0]=4 42 B6R0.4 CCCCC(C)O DY740779 [1,0,0,0,0,0|2,0,1]=4 43 B6R0.4 CCCC[SiH](C)C DY500283 [1,0,0,0,0,0|1,1,1]=4 44 B6R0.4 CCNCC(C)C DY564723 [1,0,0,0,0,0|1,0,1]=3 45 B6R0.4 CC\C=C\C(C)=O DY822743 [1,0,0,0,0,0|2,0,1]=4 46 B6R0.4 CNCCC(C)C DY543681 [1,0,0,0,0,0|2,0,1]=4 47 B6R0.4 CNCCC(C)C DY553713 [1,0,0,0,0,0|2,0,1]=4 48 B8R0.3 C=C(CBr)C(=O)OCC NO11325 [0,1,0,0,0,0|0,0,2]=3 49 B8R0.3 C=C(CO)C(=O)OCC NO20908 [0,1,0,0,0,0|0,0,2]=3 50 B8R0.3 CCNC(=O)[C@@H](N)CC DY116564 [0,1,0,0,0,0|2,0,0]=3 51 B8R0.3 CCOC(=O)C(=O)CBr NO18430 [0,1,0,0,0,0|1,0,1]=3 52 B8R0.3 CCOC(=O)C(=O)CC NO13439 [0,1,0,0,0,0|1,0,1]=3 53 B8R0.3 CCOC(=O)C(=O)NN NO13814 [0,1,0,0,0,0|2,0,1]=4 54 B8R0.3 CCOC(=O)C(Br)CBr DY551433 [0,1,0,0,0,0|1,0,0]=2 55 B8R0.3 CCOC(=O)C(Br)OC DY556005 [0,1,0,0,0,0|1,0,0]=2 56 B8R0.3 CCOC(=O)C(C)C#N NO21515 [0,1,0,0,0,0|0,0,1]=2 57 B8R0.3 CCOC(=O)C(N)CO DY439193 [0,1,0,0,0,0|1,0,0]=2 58 B8R0.3 CCOC(=O)N(C)N=O DY796905 [0,1,0,0,0,0|2,0,0]=3 59 B8R0.3 CCOC(=O)[C@@H](N)CO DY553761 [0,1,0,0,0,0|1,0,0]=2 60 B8R0.3 CCOC(=O)[C@@H](N)CO NO17107 [0,1,0,0,0,0|1,0,0]=2 61 B8R0.3 CCOC(=O)[C@H](N)CO NO13449 [0,1,0,0,0,0|1,0,0]=2 62 B8R0.3 CCOC(=O)\C(Cl)=N\O NO16217 [0,1,0,0,0,0|2,0,1]=4 63 B8R0.8 CNCCC(=O)N(C)C DY606171 [0,1,0,0,0,0|2,0,0]=3 64 B8R0.14 CCOC(=N)C(Cl)(Cl)Cl DY461232 [0,1,0,0,0,0|3,0,0]=4 65 B8R0.14 CCOC(=O)C(C)(C)N NO18617 [0,1,0,0,0,0|0,0,0]=1 66 B8R0.14 CCOC(=O)C(F)(F)Br DY20810 [0,1,0,0,0,0|2,0,0]=3 67 B8R0.14 CCOC(=O)C(F)(F)F DY10433 [0,1,0,0,0,0|2,0,0]=3 68 B8R0.23 CC(C)OC(=O)[C@H](C)N NO14281 [0,1,0,0,0,0|1,0,0]=2 69 B8R1.5 CC1=NCCCN1C DY20695 [0,0,0,1,0,0|3,0,0]=4 70 B8R1.5 CC1NCCNC1=O DY543543 [0,0,0,1,0,0|2,0,0]=3 71 B8R1.5 CN1CCCNC1=O DY502023 [0,0,0,1,0,0|2,0,0]=3 72 B8R1.5 CN1CCNCC1=O DY734647 [0,0,0,1,0,0|3,0,0]=4 73 B8R1.5 CN1CCNCC1=O NO17040 [0,0,0,1,0,0|3,0,0]=4 74 B8R1.5 CN1CCNCC1=O NO18390 [0,0,0,1,0,0|3,0,0]=4 75 B8R1.5 C[C@H]1CCCC[C@H]1N DY540861 [0,0,0,1,0,0|2,0,1]=4 76 B8R1.5 N[C@@H]1CCCNC1=O DY585291 [0,0,0,1,0,0|2,0,0]=3 77 B8R1.5 N[C@H]1CCCNC1=O DY106744 [0,0,0,1,0,0|2,0,0]=3 78 B8R1.5 N[C@H]1CCCNC1=O DY554319 [0,0,0,1,0,0|2,0,0]=3 79 B8R1.5 O=C1CCCCC1=O NO20486 [0,0,0,1,0,0|2,0,1]=4 80 B8R1.5 O=C1CCCCC1Br DY573183 [0,0,0,1,0,0|2,0,0]=3 81 B8R1.5 O=C1CCCCN1O DY822177 [0,0,0,1,0,0|3,0,0]=4 82 B8R1.5 O=C1CCOCC1F DY458969 [0,0,0,1,0,0|3,0,0]=4 83 B8R1.5 O=C1NCCCC1O NO19689 [0,0,0,1,0,0|2,0,0]=3 84 B8R1.5 O=C1NCCC[C@H]1O DY541749 [0,0,0,1,0,0|2,0,0]=3 85 B8R1.5 O=C1OCCCC1O NO16147 [0,0,0,1,0,0|1,0,0]=2 86 B8R1.7 CC(N)C1CCCO1 DY580113 [0,0,0,1,0,0|2,0,1]=4 87 B8R1.18 CC1=CC(Br)OC1=O DY557997 [0,0,0,1,0,0|1,0,2]=4 88 B8R1.18 C[C@H]1NC(=O)OC1=O NO17248 [0,0,0,1,0,0|2,0,1]=4 89 B8R1.18 O=C1CC(Br)C(=O)O1 DY822751 [0,0,0,1,0,0|2,0,1]=4 90 B8R1.19 CC1(C)CCCC1N DY540435 [0,0,0,1,0,0|2,0,1]=4 91 B8R1.27 CCOC1CC1(C)C DY788847 [0,0,0,1,0,0|1,0,1]=3 92 B8R1.37 CCCC(=O)N1CC1 DY743815 [0,0,0,1,0,0|2,0,0]=3 93 B8R1.37 CCOC(=N)C1CC1 DY757813 [0,0,0,1,0,0|1,0,0]=2 94 B8R1.37 N#CCC(=O)C1CC1 DY20950 [0,0,0,1,0,0|2,0,1]=4 95 B8R0.5 CC(C)OC(=O)OCCl NO19003 [0,0,0,0,0,1|1,0,0]=2 96 B8R0.5 CCOC(=O)C=C(C)C NO11345 [0,0,0,0,0,1|0,0,1]=2 97 B8R0.5 CCOC(=O)CC(C)O NO11353 [0,0,0,0,0,1|1,0,0]=2 98 B8R0.5 CCOC(=O)CC(F)F DY586521 [0,0,0,0,0,1|2,0,0]=3 99 B8R0.5 CCOC(=O)CC(N)=O NO18301 [0,0,0,0,0,1|2,0,1]=4 100 B8R0.5 CCOC(=O)C[C@@H](C)O NO18545 [0,0,0,0,0,1|1,0,0]=2 101 B8R0.5 CCOC(=O)C[N+](=O)[O-] NO22612 [0,0,0,0,0,1|3,0,0]=4 102 B8R0.5 CCOC(=O)OC(C)Cl NO20668 [0,0,0,0,0,1|1,0,0]=2 103 B8R0.5 CCOC(=O)\C=C(/C)N NO15795 [0,0,0,0,0,1|1,0,1]=3 104 B5R0.1 CC(=O)O[Ru]Cl DY577947 [2,0,0,0,0,0|2,0,0]=4 105 B5R0.1 CC(C)=CCBr DY41900 [2,0,0,0,0,0|1,0,1]=4 106 B5R0.1 CC(C)=CCCl DY460578 [2,0,0,0,0,0|1,0,1]=4 107 B5R0.1 CC(C)CCBr DY460632 [2,0,0,0,0,0|1,0,1]=4 108 B5R0.1 CCCC(=O)[O-] DY822775 [2,0,0,0,0,0|2,0,0]=4 109 B5R0.1 CCCC(C)=O NO21731 [2,0,0,0,0,0|1,0,0]=3 110 B5R0.1 CCCC(C)O DY741013 [2,0,0,0,0,0|1,0,1]=4 111 B5R0.1 CCNC(C)=O DY564051 [2,0,0,0,0,0|1,0,0]=3 112 B5R0.1 CCOC(C)=N DY500026 [2,0,0,0,0,0|1,0,0]=3 113 B5R0.1 COCC(C)O NO20741 [2,0,0,0,0,0|1,0,1]=4 114 B5R0.1 COC[C@@H](C)O NO20249 [2,0,0,0,0,0|1,0,1]=4 115 B5R0.1 COC[C@H](C)N DY623421 [2,0,0,0,0,0|1,0,1]=4 116 B5R0.1 COC[C@H](C)O NO20309 [2,0,0,0,0,0|1,0,1]=4 117 B5R0.1 C\C=C\[C@H](C)O DY791877 [2,0,0,0,0,0|1,0,1]=4 118 B5R0.1 O=C(O)OCCl DY523719 [2,0,0,0,0,0|2,0,0]=4 119 B5R0.2 CCC#CCC DY740797 [2,0,0,0,0,0|1,0,1]=4 120 B5R0.2 CCOCCBr NO21396 [2,0,0,0,0,0|1,0,1]=4 121 B5R0.2 CCO\C=C\Br DY456448 [2,0,0,0,0,0|1,0,1]=4 122 B5R0.2 CC\C=C\CO DY527871 [2,0,0,0,0,0|2,0,0]=4 123 B5R0.3 CCC(=O)OC DY460566 [2,0,0,0,0,0|0,0,0]=2 124 B5R0.3 CCN(O)CC DY551655 [2,0,0,0,0,0|1,0,1]=4 125 B5R0.3 CNC(=O)CCl DY21094 [2,0,0,0,0,0|2,0,0]=4 126 B5R0.3 CNC(=O)CN DY437710 [2,0,0,0,0,0|2,0,0]=4 127 B5R0.3 CNC(=O)CN DY542271 [2,0,0,0,0,0|2,0,0]=4 128 B5R0.3 COC(=O)CF DY822286 [2,0,0,0,0,0|1,0,0]=3 129 B5R0.3 COC(=O)CN NO15045 [2,0,0,0,0,0|1,0,0]=3 130 B5R0.3 COC(=O)CO NO19433 [2,0,0,0,0,0|1,0,0]=3 131 B5R0.3 COC(=O)CS DY20578 [2,0,0,0,0,0|1,0,0]=3 132 B5R0.3 COC(=O)NN DY20825 [2,0,0,0,0,0|2,0,0]=4 133 B5R0.3 O=C(CBr)CBr DY572985 [2,0,0,0,0,0|2,0,0]=4 134 B5R0.3 O=C(CO)CO NO11245 [2,0,0,0,0,0|2,0,0]=4 135 B5R0.5 C=C(C)C(=O)O DY740707 [2,0,0,0,0,0|0,0,2]=4 136 B5R0.5 CC(=O)C(C)C DY740329 [2,0,0,0,0,0|0,0,0]=2 137 B5R0.5 CC(=O)C(C)Cl DY740749 [2,0,0,0,0,0|1,0,0]=3 138 B5R0.5 CC(C)B(O)O DY454222 [2,0,0,0,0,0|1,0,1]=4 139 B5R0.5 CC(C)C(N)=O NO21696 [2,0,0,0,0,0|1,0,0]=3 140 B5R0.5 CC(O)C(N)=O DY538347 [2,0,0,0,0,0|2,0,0]=4 141 B5R0.5 C[C@@H](Br)C(=O)O DY788601 [2,0,0,0,0,0|1,0,0]=3 142 B5R0.5 C[C@@H](N)C(N)=O NO15732 [2,0,0,0,0,0|2,0,0]=4 143 B5R0.5 C[C@@H](O)C(=O)[O-] DY580071 [2,0,0,0,0,0|1,0,1]=4 144 B5R0.5 C[C@H](Br)C(=O)O DY20444 [2,0,0,0,0,0|1,0,0]=3 145 B5R0.5 C[C@H](Cl)C(=O)O DY20315 [2,0,0,0,0,0|1,0,0]=3 146 B5R0.5 C[C@H](N)C(=O)O NO19143 [2,0,0,0,0,0|1,0,0]=3 147 B5R0.5 C[C@H](N)C(=O)S DY572427 [2,0,0,0,0,0|1,1,0]=4 148 B5R0.5 C[C@H](N)C(N)=O NO22529 [2,0,0,0,0,0|2,0,0]=4 149 B5R0.5 C[C@H](O)C(N)=O DY624997 [2,0,0,0,0,0|2,0,0]=4 150 B5R0.5 O=C(O)C(Cl)Cl DY740833 [2,0,0,0,0,0|2,0,0]=4 151 B5R0.5 [13CH3]C(N)C(=O)O DY454719 [2,0,0,0,0,0|1,0,0]=3 152 B7R0.2 CC(C)CC(=O)CN DY540483 [1,1,0,0,0,0|2,0,0]=4 153 B7R0.2 CC(C)NC(=O)CN DY605375 [1,1,0,0,0,0|2,0,0]=4 154 B7R0.2 CC(C)OC(=O)CO NO11522 [1,1,0,0,0,0|1,0,0]=3 155 B7R0.2 CCC(=O)CC(C)=O NO21124 [1,1,0,0,0,0|1,0,1]=4 156 B7R0.2 CCC(=O)OC(C)=O NO16382 [1,1,0,0,0,0|0,0,1]=3 157 B7R0.2 COC(=O)C[C@@H](C)N DY460818 [1,1,0,0,0,0|2,0,0]=4 158 B7R0.2 COC(=O)C[C@@H](C)O NO11584 [1,1,0,0,0,0|2,0,0]=4 159 B7R0.2 COC(=O)C[C@H](C)N DY625921 [1,1,0,0,0,0|2,0,0]=4 160 B7R0.2 COC(=O)C[C@H](C)O DY559029 [1,1,0,0,0,0|2,0,0]=4 161 B7R0.3 CC\C=C\C(=O)OC DY741019 [1,1,0,0,0,0|2,0,0]=4 162 B7R0.7 CC#CC(=O)OCC NO10117 [1,1,0,0,0,0|0,0,1]=3 163 B7R0.7 CCNC(=O)CC#N DY740641 [1,1,0,0,0,0|1,0,1]=4 164 B7R0.7 CCOC(=O)CC=O DY586084 [1,1,0,0,0,0|0,0,1]=3 165 B7R0.7 CCOC(=O)CCN NO14330 [1,1,0,0,0,0|0,0,0]=2 166 B7R0.7 CCOC(=O)CNC NO17068 [1,1,0,0,0,0|0,0,0]=2 167 B7R0.7 CCOC(=O)CNN NO19987 [1,1,0,0,0,0|1,0,0]=3 168 B7R0.7 CCOC(=O)COC NO11389 [1,1,0,0,0,0|0,0,0]=2 169 B7R0.7 CCOC(=O)\C=C\Br DY822474 [1,1,0,0,0,0|0,0,2]=4 170 B7R0.7 O=C(CCCl)CCCl NO19912 [1,1,0,0,0,0|2,0,0]=4 171 B7R0.10 C=C(CC)C(=O)OC DY541119 [1,1,0,0,0,0|2,0,0]=4 172 B7R0.10 CCC(Br)C(=O)OC NO14136 [1,1,0,0,0,0|2,0,0]=4 173 B7R0.12 CCOC(CC)CN DY605537 [1,1,0,0,0,0|1,0,1]=4 174 B7R0.14 CC(C)(C)C(=O)C#N DY822781 [1,1,0,0,0,0|1,0,1]=4 175 B7R0.14 CC(C)(F)C(=O)CBr DY569355 [1,1,0,0,0,0|1,0,0]=3 176 B7R0.14 COC(=O)C(C)(C)F NO11604 [1,1,0,0,0,0|0,0,0]=2 177 B7R0.14 COC(=O)C(C)(C)N NO17071 [1,1,0,0,0,0|0,0,0]=2 178 B7R0.14 COC(=O)C(F)(F)Br DY822691 [1,1,0,0,0,0|2,0,0]=4 179 B7R0.16 CC(=O)C(=O)C(C)Br DY822550 [1,1,0,0,0,0|1,0,1]=4 180 B7R0.16 CC(Br)C(=O)C(C)Br DY798315 [1,1,0,0,0,0|1,0,0]=3 181 B7R0.16 CC(C)C(=O)C(=O)[O-] NO22357 [1,1,0,0,0,0|1,0,1]=4 182 B7R0.16 CC(C)C(N)C(C)C NO17730 [1,1,0,0,0,0|1,0,1]=4 183 B7R0.4 CC(C)OCCCN DY546693 [1,1,0,0,0,0|2,0,0]=4 184 B7R0.4 CC(O)COCCN DY560097 [1,1,0,0,0,0|1,0,1]=4 185 B7R0.8 CCNNC(C)(C)C DY743065 [1,1,0,0,0,0|2,0,0]=4 186 B9R0.6 CCOC(=O)C(Br)C(C)Br DY796845 [0,1,0,0,0,1|1,0,0]=3 187 B9R0.6 CCOC(=O)C(Br)C(C)C NO19615 [0,1,0,0,0,1|0,0,0]=2 188 B9R0.6 CCOC(=O)C(C)C(C)=O NO19187 [0,1,0,0,0,1|1,0,1]=4 189 B9R0.6 CCOC(=O)C(F)C(C)C DY429819 [0,1,0,0,0,1|0,0,0]=2 190 B9R0.6 CCOC(=O)C(N)C(C)=O DY537897 [0,1,0,0,0,1|1,0,1]=4 191 B9R0.6 CCOC(=O)[C@@H](C)[C@H](C)O DY822255 [0,1,0,0,0,1|1,0,0]=3 192 B9R0.6 CCOC(=O)[C@@H](O)C(C)C DY822254 [0,1,0,0,0,1|0,0,0]=2 193 B9R0.6 CCOC(=O)[C@H](N)C(C)C DY628149 [0,1,0,0,0,1|0,0,0]=2 194 B9R0.23 CC(C)OC(=O)[C@@H](N)CS DY572133 [0,1,0,0,0,1|2,0,0]=4 195 B9R0.34 CCOC(=O)CC(=O)CBr NO13599 [0,1,0,0,0,1|1,0,1]=4 196 B9R0.34 CCOC(=O)CC(=O)CC NO11391 [0,1,0,0,0,1|1,0,1]=4 197 B9R0.34 CCOC(=O)CC(O)CBr DY799257 [0,1,0,0,0,1|1,0,0]=3 198 B9R0.34 CCOC(=O)C[C@H](O)CC DY822251 [0,1,0,0,0,1|1,0,0]=3 199 B9R0.44 CC(C)(C)NC(=O)CCCl DY604599 [0,1,0,0,0,1|2,0,0]=4 200 B9R0.44 CC(C)(C)OC(=O)CCN NO19160 [0,1,0,0,0,1|2,0,0]=4 201 B9R0.44 CCOC(=O)CC(C)(C)C DY740851 [0,1,0,0,0,1|0,0,0]=2 202 B9R0.44 CCOC(=O)CC(C)(C)N NO14497 [0,1,0,0,0,1|0,0,0]=2 203 B9R0.44 CCOC(=O)CC(C)(C)O NO15635 [0,1,0,0,0,1|0,0,0]=2 204 B9R0.44 CNCC(=O)OC(C)(C)C NO14999 [0,1,0,0,0,1|2,0,0]=4 205 B9R0.53 CC(C)OC(=O)OC(C)C DY565407 [0,1,0,0,0,1|0,0,0]=2 206 B9R0.53 CC(C)OC(=O)OC(C)Cl NO20669 [0,1,0,0,0,1|0,0,0]=2 207 B9R0.53 C\C(N)=C\C(=O)OC(C)C NO10135 [0,1,0,0,0,1|1,0,1]=4 208 B9R0.35 CCCC(=O)C(=O)OCC NO14582 [0,2,0,0,0,0|1,0,1]=4 209 B9R0.35 CCCC(=O)C(O)CCC DY556689 [0,2,0,0,0,0|2,0,0]=4 210 B9R0.35 CCOC(=N)C(=O)OCC NO13440 [0,2,0,0,0,0|1,0,1]=4 211 B9R0.35 CCOC(=O)C(=O)OCC DY41888 [0,2,0,0,0,0|1,0,1]=4 212 B9R0.37 CCOC(=O)C(C=O)C=O NO12302 [0,2,0,0,0,0|0,0,2]=4 213 B9R0.37 CCOC(=O)C(CO)CO DY583623 [0,2,0,0,0,0|0,0,0]=2 214 B9R0.3 CC(C)(C)C(=O)NCCO DY551349 [0,2,0,0,0,0|1,0,0]=3 215 B9R0.7 CC(C)C(=O)CCN(C)C DY793521 [0,2,0,0,0,0|1,0,0]=3 216 B9R0.42 CCC(=O)OC(Cl)C(C)C NO20670 [0,2,0,0,0,0|1,0,1]=4 217 B9R0.42 COC(=O)CC(=O)C(C)C NO11675 [0,2,0,0,0,0|1,0,1]=4 218 B9R0.47 CCCCOC(=O)C(C)=O DY792807 [0,2,0,0,0,0|1,0,1]=4 219 B9R0.47 CCCCOC(=O)C(C)C DY583197 [0,2,0,0,0,0|0,0,0]=2 220 B9R0.47 CCCCOC(=O)[C@H](C)N NO15628 [0,2,0,0,0,0|1,0,0]=3 221 B9R0.10 CC(C)OC(=O)C(F)(F)F DY584365 [0,2,0,0,0,0|2,0,0]=4 222 B9R0.57 CC(Br)C(=O)OC(C)(C)C DY552723 [0,2,0,0,0,0|1,0,0]=3 223 B9R0.57 CC(C)C(=O)CC(C)(C)O DY740575 [0,2,0,0,0,0|1,0,0]=3 224 B9R0.57 C[C@@H](N)C(=O)OC(C)(C)C NO19633 [0,2,0,0,0,0|1,0,0]=3 225 B9R0.57 C[C@H](N)C(=O)OC(C)(C)C NO22243 [0,2,0,0,0,0|1,0,0]=3 226 B9R0.57 C[C@H](O)C(=O)OC(C)(C)C DY519933 [0,2,0,0,0,0|1,0,0]=3 227 B7R1.2 CC1=CC(=O)CC1 NO22356 [1,0,0,1,0,0|1,0,1]=4 228 B7R1.2 CC1=CCC(=O)O1 DY562161 [1,0,0,1,0,0|0,0,2]=4 229 B7R1.2 CC1=NCC(=O)O1 DY774159 [1,0,0,1,0,0|1,0,1]=4 230 B7R1.2 CC1CCC(=O)N1 DY505299 [1,0,0,1,0,0|1,0,0]=3 231 B7R1.2 CN1CCC(=O)C1 NO20760 [1,0,0,1,0,0|2,0,0]=4 232 B7R1.2 C[C@@H]1COC(=O)N1 NO14300 [1,0,0,1,0,0|2,0,0]=4 233 B7R1.2 C[C@H]1COC(=O)N1 DY553365 [1,0,0,1,0,0|2,0,0]=4 234 B7R1.3 O=C1CCCCO1 NO11208 [1,0,0,1,0,0|0,0,0]=2 235 B7R1.3 O=C1CCCNC1 DY557319 [1,0,0,1,0,0|2,0,0]=4 236 B7R1.3 O=C1CCCNC1 NO17767 [1,0,0,1,0,0|2,0,0]=4 237 B7R1.3 O=C1CCOCC1 NO13380 [1,0,0,1,0,0|2,0,0]=4 238 B7R1.3 O=C1CCSCC1 NO18797 [1,0,0,1,0,0|2,0,0]=4 239 B7R1.3 O=C1CNCCN1 NO19142 [1,0,0,1,0,0|2,0,0]=4 240 B7R1.3 O=C1COCCN1 NO11697 [1,0,0,1,0,0|2,0,0]=4 241 B7R1.3 O=C1COCCO1 DY20725 [1,0,0,1,0,0|1,0,0]=3 242 B7R1.3 O=S1CCCCC1 DY822282 [1,0,0,1,0,0|2,0,0]=4 243 B7R1.4 CC1CCOC1=O DY759320 [1,0,0,1,0,0|0,0,0]=2 244 B7R1.4 CC1OCCC1=O NO14135 [1,0,0,1,0,0|2,0,0]=4 245 B7R1.4 C[C@@H]1CCNC1=O DY546075 [1,0,0,1,0,0|1,0,0]=3 246 B7R1.4 C[C@H]1CCNC1=O DY560337 [1,0,0,1,0,0|1,0,0]=3 247 B7R1.4 NN1CCOC1=O DY774063 [1,0,0,1,0,0|2,0,0]=4 248 B7R1.4 N[C@@H]1CCOC1=O NO18578 [1,0,0,1,0,0|1,0,0]=3 249 B7R1.4 N[C@H]1CCOC1=O DY541269 [1,0,0,1,0,0|1,0,0]=3 250 B7R1.4 O=C1CCCC1Cl DY567621 [1,0,0,1,0,0|2,0,0]=4 251 B7R1.4 O=C1NCCC1O DY444274 [1,0,0,1,0,0|2,0,0]=4 252 B7R1.4 O=C1NCC[C@@H]1O NO19486 [1,0,0,1,0,0|2,0,0]=4 253 B7R1.4 O=C1NCC[C@H]1O DY115910 [1,0,0,1,0,0|2,0,0]=4 254 B7R1.21 CCOC1(O)CC1 NO16017 [1,0,0,1,0,0|0,0,2]=4 255 B7R1.22 CCC(=O)C1CC1 DY566457 [1,0,0,1,0,0|1,0,0]=3 256 B7R1.22 O=C(CO)C1CC1 DY758275 [1,0,0,1,0,0|2,0,0]=4 257 B7R1.7 CCNCC1CC1 DY606135 [1,0,0,1,0,0|1,0,1]=4 258 B7R1.14 CC1(C)COCN1 DY557637 [1,0,0,1,0,0|1,0,1]=4 259 B9R1.34 CC1CC(=O)CC(C)O1 DY425912 [0,0,0,1,0,1|2,0,0]=4 260 B9R1.34 C[C@H]1C[C@H](O)CC(=O)N1 DY586077 [0,0,0,1,0,1|2,0,0]=4 261 B9R1.38 CC1(C)CC(=O)OC1=O NO19863 [0,0,0,1,0,1|1,0,1]=4 262 B9R1.48 NC1CCCNC(=O)C1 DY743197 [0,0,0,1,0,1|2,0,0]=4 263 B9R1.66 CC1(C)CC(=O)CCO1 NO17870 [0,0,0,1,0,1|2,0,0]=4 264 B9R1.66 CC1(C)CCCC(=O)C1 DY10482 [0,0,0,1,0,1|1,0,0]=3 265 B9R1.3 CC1C(=O)CCCC1=O NO10132 [0,1,0,1,0,0|1,0,1]=4 266 B9R1.3 CC1NCCN(C)C1=O DY512001 [0,1,0,1,0,0|2,0,0]=4 267 B9R1.3 CN1CCC[C@@H](O)C1=O DY586206 [0,1,0,1,0,0|2,0,0]=4 268 B9R1.37 CC1C(=O)OC(=O)N1C DY774141 [0,1,0,1,0,0|1,0,1]=4 269 B9R1.37 CC1CC(C)C(=O)C1=O DY822610 [0,1,0,1,0,0|1,0,0]=3 270 B9R1.110 CN(C)C(=O)C1CNC1 DY113079 [0,1,0,1,0,0|2,0,0]=4 271 B9R1.110 CN(C)C(=O)C1CNC1 DY718780 [0,1,0,1,0,0|2,0,0]=4 272 B9R1.132 CCN1CC[C@@H](O)C1=O DY586205 [0,1,0,1,0,0|2,0,0]=4 273 B9R1.138 CC1(C)CNC(=O)C1=O DY667273 [0,1,0,1,0,0|2,0,0]=4 274 B9R1.5 NC1CCCCNC1=O NO15569 [0,1,0,1,0,0|2,0,0]=4 275 B9R1.5 NC1CCCCNC1=O NO15816 [0,1,0,1,0,0|2,0,0]=4 276 B9R1.5 N[C@H]1CCCCNC1=O DY545019 [0,1,0,1,0,0|2,0,0]=4 277 B9R1.5 O=C1NCCCCC1Br DY550035 [0,1,0,1,0,0|2,0,0]=4 278 B9R1.15 CCC1CNCCC1=O NO17950 [0,1,0,1,0,0|2,0,0]=4 279 B9R1.15 CCC1NCCCC1=O DY636158 [0,1,0,1,0,0|2,0,0]=4 280 B9R1.15 COC1CCCCC1=O DY822546 [0,1,0,1,0,0|1,0,0]=3 281 B9R1.15 COC1CCCNC1=O NO12712 [0,1,0,1,0,0|1,0,0]=3 282 B9R1.15 C[C@H]1CCCCN1N=O DY794955 [0,1,0,1,0,0|2,0,0]=4 283 B9R1.15 N#CC1CCCCC1=O DY33325 [0,1,0,1,0,0|1,0,1]=4 284 B9R1.15 O=C1CCCCC1CO DY587110 [0,1,0,1,0,0|1,0,0]=3 285 B9R1.69 CC1CNC(=O)C(C)C1 DY636400 [0,1,0,1,0,0|1,0,0]=3 286 B9R1.69 CN1CC(N)CCC1=O DY603454 [0,1,0,1,0,0|2,0,0]=4 287 B9R1.69 C[C@@H]1CNC(=O)[C@@H](C)N1 DY515061 [0,1,0,1,0,0|2,0,0]=4 288 B9R1.69 C[C@H]1CN[C@H](C)[C@@H](C)O1 DY536103 [0,1,0,1,0,0|1,0,1]=4 289 B9R1.73 CCOC(=O)C1CNC1 NO11347 [0,1,0,1,0,0|0,0,0]=2 290 B9R1.74 CCOC(=O)C1(C)CC1 NO19612 [0,1,0,1,0,0|0,0,0]=2 291 B9R1.74 CCOC(=O)C1(N)CC1 NO19059 [0,1,0,1,0,0|0,0,0]=2 292 B9R1.6 CC(C)C1CNCCO1 NO16451 [0,1,0,1,0,0|1,0,1]=4 293 B9R1.6 CC(C)[C@@H]1COCCN1 DY20926 [0,1,0,1,0,0|1,0,1]=4 294 B9R1.6 CC(C)[C@@H]1COCCN1 DY444041 [0,1,0,1,0,0|1,0,1]=4 295 B9R1.6 CC(C)[C@H]1CNCCO1 DY444059 [0,1,0,1,0,0|1,0,1]=4 296 B9R1.23 CC1N=C(CN)OC1=O DY774165 [0,1,0,1,0,0|1,0,1]=4 297 B9R1.23 CN1CC(CN)CC1=O DY580887 [0,1,0,1,0,0|2,0,0]=4 298 B9R1.23 CN1C[C@H](CN)OC1=O DY774135 [0,1,0,1,0,0|1,0,0]=3 299 B9R1.23 CNC1CC(=O)N(C)C1 DY524481 [0,1,0,1,0,0|2,0,0]=4 300 B9R1.40 CC1(C)COCCC1=O NO16380 [0,1,0,1,0,0|1,0,0]=3 301 B9R1.40 CC1(C)OCCCC1=O DY510452 [0,1,0,1,0,0|1,0,0]=3 302 B9R1.40 O=C1NCCCC1(Br)Br NO18534 [0,1,0,1,0,0|2,0,0]=4 303 B9R1.100 CCCNC(=O)C1CC1 DY757753 [0,1,0,1,0,0|1,0,0]=3 304 B9R1.100 NCCNC(=O)C1CC1 DY512583 [0,1,0,1,0,0|1,0,0]=3 305 B9R1.36 CC1(C)CC(N)C(=O)O1 DY585320 [0,1,0,1,0,0|1,0,0]=3 306 B9R2.39 O=C1CC2CC1CO2 DY506766 [0,0,0,2,0,0|2,0,0]=4 307 B9R2.39 O=C1N[C@H]2CC[C@@H]1C2 DY620394 [0,0,0,2,0,0|1,0,0]=3 308 B9R2.25 O=C1OC(=O)C2CC12 NO22387 [0,0,0,2,0,0|1,0,1]=4 309 B9R0.48 CCOC(=O)\C=C\N(C)C DY506879 [0,0,0,0,0,2|1,0,0]=3