0 B6R0.5 CC(C)(C)OC=O CNP0495948.0 [0,0,0,0,0,0|2,0,2]=4 1 B6R0.5 CC(C)(O)CNCl CNP0247437.0 [0,0,0,0,0,0|4,0,0]=4 2 B6R0.5 CC(C)(S)CCO CNP0215542.0 [0,0,0,0,0,0|2,0,0]=2 3 B6R0.5 CC=CC(C)(C)C CNP0120515.0 [0,0,0,0,0,0|2,0,2]=4 4 B6R0.5 CCCC(C)(C)C CNP0308764.0 [0,0,0,0,0,0|2,0,0]=2 5 B6R0.5 CCCC(C)(C)O CNP0258393.0 [0,0,0,0,0,0|3,0,0]=3 6 B6R0.5 CCC[N+](C)(C)C CNP0523784.0 [0,0,0,0,0,0|1,0,0]=1 7 B6R0.5 CCOC(C)(C)C CNP0285210.0 [0,0,0,0,0,0|3,0,0]=3 8 B6R0.5 CCSC(C)(C)C CNP0186557.0 [0,0,0,0,0,0|3,0,0]=3 9 B6R0.5 C[As+](C)(C)CCO CNP0083842.0 [0,0,0,0,0,0|0,1,0]=1 10 B6R0.5 C[As](=O)(C)CCO CNP0236295.0 [0,0,0,0,0,0|1,1,0]=2 11 B6R0.5 C[N+](C)(C)C=C[O-] CNP0493805.0 [0,0,0,0,0,0|0,0,3]=3 12 B6R0.5 C[N+](C)(C)CC=O CNP0578871.0 [0,0,0,0,0,0|0,0,2]=2 13 B6R0.5 C[N+](C)(C)CCO CNP0161849.0 [0,0,0,0,0,0|0,0,0]=0 14 B6R0.5 C[N+](C)(C)CCO CNP0522731.0 [0,0,0,0,0,0|0,0,0]=0 15 B6R0.5 C[N+](C)(C)CCS CNP0555759.0 [0,0,0,0,0,0|0,1,0]=1 16 B6R0.5 C[N+](C)([11CH3])CCO CNP0547808.0 [0,0,0,0,0,0|0,0,0]=0 17 B6R0.5 C[N+](C)([11CH3])CCO CNP0580308.0 [0,0,0,0,0,0|0,0,0]=0 18 B6R0.5 C[S+](=O)(C)CCO CNP0428132.0 [0,0,0,0,0,0|2,0,0]=2 19 B6R0.5 O=P(O)(O)CCO CNP0207938.0 [0,0,0,0,0,0|3,1,0]=4 20 B6R0.5 O=S(=O)(Cl)CCO CNP0242447.0 [0,0,0,0,0,0|4,0,0]=4 21 B6R0.5 O=S(=O)(O)CCO CNP0267265.0 [0,0,0,0,0,0|4,0,0]=4 22 B5R0.1 C=C(Br)CCO CNP0595001.0 [1,0,0,0,0,0|2,0,1]=4 23 B5R0.1 C=C(C)CCC CNP0179329.0 [1,0,0,0,0,0|2,0,1]=4 24 B5R0.1 C=C(C)CCO CNP0285127.0 [1,0,0,0,0,0|1,0,1]=3 25 B5R0.1 C=CCC(C)C CNP0293683.0 [1,0,0,0,0,0|2,0,1]=4 26 B5R0.1 CC(=CCO)C CNP0241702.0 [1,0,0,0,0,0|1,0,1]=3 27 B5R0.1 CC(=CCS)C CNP0262600.0 [1,0,0,0,0,0|1,1,1]=4 28 B5R0.1 CC(=O)CCO CNP0251527.0 [1,0,0,0,0,0|2,0,0]=3 29 B5R0.1 CC(=O)CCS CNP0404753.0 [1,0,0,0,0,0|2,1,0]=4 30 B5R0.1 CC(C)C=CO CNP0546358.0 [1,0,0,0,0,0|1,0,2]=4 31 B5R0.1 CC(C)C=NO CNP0180575.0 [1,0,0,0,0,0|2,0,1]=4 32 B5R0.1 CC(C)CC#N CNP0003467.0 [1,0,0,0,0,0|2,0,1]=4 33 B5R0.1 CC(C)CC=O CNP0200023.0 [1,0,0,0,0,0|1,0,2]=4 34 B5R0.1 CC(C)CCN CNP0107663.0 [1,0,0,0,0,0|2,0,0]=3 35 B5R0.1 CC(C)CCO CNP0115711.0 [1,0,0,0,0,0|1,0,0]=2 36 B5R0.1 CC(C)CCS CNP0222694.0 [1,0,0,0,0,0|1,1,0]=3 37 B5R0.1 CC(C)CNO CNP0343206.0 [1,0,0,0,0,0|2,0,0]=3 38 B5R0.1 CC(O)CCS CNP0002409.0 [1,0,0,0,0,0|2,1,0]=4 39 B5R0.1 CC(S)CCS CNP0003105.0 [1,0,0,0,0,0|2,1,0]=4 40 B5R0.1 CCC=C(C)C CNP0331653.0 [1,0,0,0,0,0|2,0,1]=4 41 B5R0.1 CCCC(=O)C CNP0169448.0 [1,0,0,0,0,0|3,0,0]=4 42 B5R0.1 CCCC(C)C CNP0319065.0 [1,0,0,0,0,0|2,0,0]=3 43 B5R0.1 CCCC(C)S CNP0029638.0 [1,0,0,0,0,0|3,0,0]=4 44 B5R0.1 CCC[C@@H](C)O CNP0287976.1 [1,0,0,0,0,0|3,0,0]=4 45 B5R0.1 CCC[C@H](C)O CNP0287976.2 [1,0,0,0,0,0|3,0,0]=4 46 B5R0.1 CCOC(C)C CNP0604172.0 [1,0,0,0,0,0|3,0,0]=4 47 B5R0.1 CCSC(C)C CNP0254931.0 [1,0,0,0,0,0|3,0,0]=4 48 B5R0.1 CN(C)CC#N CNP0084986.0 [1,0,0,0,0,0|1,0,2]=4 49 B5R0.1 CN(C)CCCl CNP0328789.0 [1,0,0,0,0,0|1,0,1]=3 50 B5R0.1 CN(C)CCO CNP0230038.0 [1,0,0,0,0,0|0,0,1]=2 51 B5R0.1 CNCC(C)C CNP0273998.0 [1,0,0,0,0,0|3,0,0]=4 52 B5R0.1 COCC(C)C CNP0528468.0 [1,0,0,0,0,0|3,0,0]=4 53 B5R0.1 CSCC(C)C CNP0405087.0 [1,0,0,0,0,0|3,0,0]=4 54 B5R0.1 C[C@@H](O)CCO CNP0110972.2 [1,0,0,0,0,0|2,0,0]=3 55 B5R0.1 C[C@H](O)CCO CNP0110972.1 [1,0,0,0,0,0|2,0,0]=3 56 B5R0.1 C[N+](=NCO)[O-] CNP0075707.0 [1,0,0,0,0,0|2,0,1]=4 57 B5R0.1 O=C(O)CCO CNP0228379.0 [1,0,0,0,0,0|3,0,0]=4 58 B5R0.1 O=[N+]([O-])CCO CNP0479078.0 [1,0,0,0,0,0|2,0,1]=4 59 B5R0.4 C=C[N+](C)(C)C CNP0076784.0 [1,0,0,0,0,0|0,0,2]=3 60 B5R0.4 C=C[N+](C)(C)C CNP0591850.0 [1,0,0,0,0,0|0,0,2]=3 61 B5R0.4 CC(C)(C)C=O CNP0320383.0 [1,0,0,0,0,0|1,0,2]=4 62 B5R0.4 CC(C)(C)N=O CNP0030824.0 [1,0,0,0,0,0|2,0,1]=4 63 B5R0.4 CC(C)(C)OO CNP0609042.0 [1,0,0,0,0,0|2,0,0]=3 64 B5R0.4 CC(C)(O)CN CNP0332905.0 [1,0,0,0,0,0|3,0,0]=4 65 B5R0.4 CC(C)(O)CO CNP0307478.0 [1,0,0,0,0,0|2,0,0]=3 66 B5R0.4 CC(C)(S)CS CNP0258725.0 [1,0,0,0,0,0|2,1,0]=4 67 B5R0.4 CCC(C)(C)C CNP0113159.0 [1,0,0,0,0,0|1,0,0]=2 68 B5R0.4 CCC(C)(C)I CNP0076730.0 [1,0,0,0,0,0|2,0,0]=3 69 B5R0.4 CCC(C)(C)N CNP0083061.0 [1,0,0,0,0,0|2,0,0]=3 70 B5R0.4 CCC(C)(C)O CNP0239239.0 [1,0,0,0,0,0|2,0,0]=3 71 B5R0.4 CC[Si](C)(C)C CNP0572818.0 [1,0,0,0,0,0|1,0,0]=2 72 B5R0.4 COC(C)(C)C CNP0379426.0 [1,0,0,0,0,0|2,0,0]=3 73 B5R0.4 CO[As](=O)(C)C CNP0017834.0 [1,0,0,0,0,0|2,1,0]=4 74 B5R0.4 CP(=O)(C)CO CNP0140331.0 [1,0,0,0,0,0|1,1,0]=3 75 B7R0.8 C=CCC[N+](C)(C)C CNP0507277.0 [0,1,0,0,0,0|1,0,0]=2 76 B7R0.8 CC(C)(C)OCCN CNP0068463.0 [0,1,0,0,0,0|2,0,0]=3 77 B7R0.8 CCCCC(C)(C)C CNP0139885.0 [0,1,0,0,0,0|2,0,0]=3 78 B7R0.8 CCCO[As](=O)(C)C CNP0175825.0 [0,1,0,0,0,0|2,1,0]=4 79 B7R0.8 CCCSC(C)(C)C CNP0177431.0 [0,1,0,0,0,0|2,0,0]=3 80 B7R0.8 COCCC(C)(C)S CNP0210797.0 [0,1,0,0,0,0|2,0,0]=3 81 B7R0.9 C=C(C)CC(C)(C)C CNP0205743.0 [0,1,0,0,0,0|2,0,1]=4 82 B7R0.9 CC(=O)C[N+](C)(C)C CNP0490253.0 [0,1,0,0,0,0|0,0,2]=3 83 B7R0.9 CC(C)(O)CC(=O)O CNP0284455.0 [0,1,0,0,0,0|2,0,1]=4 84 B7R0.9 CC(C)CC(C)(C)C CNP0079943.0 [0,1,0,0,0,0|2,0,0]=3 85 B7R0.9 CC(C)CC(C)(C)O CNP0085669.0 [0,1,0,0,0,0|3,0,0]=4 86 B7R0.9 C[As+](C)(C)CC(=O)O CNP0017752.0 [0,1,0,0,0,0|0,1,1]=3 87 B7R0.9 C[As+](C)(C)CC(=O)[O-] CNP0085594.0 [0,1,0,0,0,0|0,1,2]=4 88 B7R0.9 C[C@@H](O)CC(C)(C)O CNP0352838.2 [0,1,0,0,0,0|2,0,0]=3 89 B7R0.9 C[C@H](O)CC(C)(C)O CNP0352838.1 [0,1,0,0,0,0|2,0,0]=3 90 B7R0.9 C[N+](C)(C)CC(=O)N CNP0509431.0 [0,1,0,0,0,0|0,0,2]=3 91 B7R0.9 C[N+](C)(C)CC(=O)N CNP0510669.0 [0,1,0,0,0,0|0,0,2]=3 92 B7R0.9 C[N+](C)(C)CC(=O)O CNP0143060.0 [0,1,0,0,0,0|0,0,1]=2 93 B7R0.9 C[N+](C)(C)CC(=O)O CNP0558485.0 [0,1,0,0,0,0|0,0,1]=2 94 B7R0.9 C[N+](C)(C)CC(=O)[O-] CNP0508048.0 [0,1,0,0,0,0|0,0,2]=3 95 B7R0.9 C[N+](C)(C)CC(=O)[O-] CNP0513647.0 [0,1,0,0,0,0|0,0,2]=3 96 B7R0.9 C[N+](C)(C)CC(O)O CNP0500510.0 [0,1,0,0,0,0|0,0,0]=1 97 B7R0.11 CCCC(C)(C)CC CNP0190081.0 [0,1,0,0,0,0|2,0,0]=3 98 B7R0.11 CCCC(C)(O)CC CNP0493821.0 [0,1,0,0,0,0|3,0,0]=4 99 B7R0.11 CCOC(C)(C)CC CNP0167701.0 [0,1,0,0,0,0|3,0,0]=4 100 B7R0.11 CCOC(C)(C)OC CNP0608393.0 [0,1,0,0,0,0|3,0,0]=4 101 B7R0.11 CCSC(C)(C)CC CNP0230254.0 [0,1,0,0,0,0|3,0,0]=4 102 B7R0.11 CSC(C)(C)C=NO CNP0236630.0 [0,1,0,0,0,0|2,0,1]=4 103 B7R0.11 [C-]#[N+]CC(C)(C)OC CNP0586088.0 [0,1,0,0,0,0|3,0,0]=4 104 B7R0.14 C#CC(O)[Si](C)(C)C CNP0105363.0 [0,1,0,0,0,0|2,0,1]=4 105 B7R0.14 CC(C)(C)[C@@H](O)C#N CNP0051001.2 [0,1,0,0,0,0|2,0,1]=4 106 B7R0.14 CC(C)(C)[C@H](O)C#N CNP0051001.1 [0,1,0,0,0,0|2,0,1]=4 107 B7R1.14 CC1(CCCC1)C CNP0125073.0 [0,0,0,1,0,0|2,0,0]=3 108 B7R1.14 CC1(CCCC1)O CNP0579828.0 [0,0,0,1,0,0|3,0,0]=4 109 B7R1.14 CC1(CCSS1)C CNP0245767.0 [0,0,0,1,0,0|2,1,0]=4 110 B7R1.23 CCC1OC1(C)C CNP0495056.0 [0,0,0,1,0,0|3,0,0]=4 111 B4R0.1 C=C(C)CC CNP0605035.0 [2,0,0,0,0,0|1,0,1]=4 112 B4R0.1 C=C(C)CO CNP0505353.0 [2,0,0,0,0,0|1,0,1]=4 113 B4R0.1 CC(=NO)C CNP0591673.0 [2,0,0,0,0,0|2,0,0]=4 114 B4R0.1 CC(=O)CO CNP0487266.0 [2,0,0,0,0,0|2,0,0]=4 115 B4R0.1 CC(C)CN CNP0490050.0 [2,0,0,0,0,0|2,0,0]=4 116 B4R0.1 CC(C)CO CNP0493868.0 [2,0,0,0,0,0|1,0,0]=3 117 B4R0.1 CC(C)CS CNP0494383.0 [2,0,0,0,0,0|1,1,0]=4 118 B4R0.1 CC=C(C)C CNP0502707.0 [2,0,0,0,0,0|1,0,1]=4 119 B4R0.1 CCC(=O)C CNP0486447.0 [2,0,0,0,0,0|2,0,0]=4 120 B4R0.1 CCC(C)C CNP0492867.0 [2,0,0,0,0,0|1,0,0]=3 121 B4R0.1 CCC(C)N CNP0520467.0 [2,0,0,0,0,0|2,0,0]=4 122 B4R0.1 CC[C@@H](C)O CNP0577352.1 [2,0,0,0,0,0|2,0,0]=4 123 B4R0.1 CC[C@@H](C)S CNP0572211.1 [2,0,0,0,0,0|2,0,0]=4 124 B4R0.1 CC[C@H](C)O CNP0577352.2 [2,0,0,0,0,0|2,0,0]=4 125 B4R0.1 CNC(C)C CNP0489071.0 [2,0,0,0,0,0|2,0,0]=4 126 B4R0.1 CSC(C)C CNP0486491.0 [2,0,0,0,0,0|2,0,0]=4 127 B4R0.1 C[C@@H](N)CO CNP0589695.1 [2,0,0,0,0,0|2,0,0]=4 128 B4R0.1 C[C@@H](O)CO CNP0522839.2 [2,0,0,0,0,0|2,0,0]=4 129 B4R0.1 C[C@H](N)CO CNP0589695.2 [2,0,0,0,0,0|2,0,0]=4 130 B4R0.1 C[C@H](O)CO CNP0522839.1 [2,0,0,0,0,0|2,0,0]=4 131 B4R0.2 C#CCCO CNP0577358.0 [2,0,0,0,0,0|1,0,1]=4 132 B4R0.2 C=CCCO CNP0599473.0 [2,0,0,0,0,0|1,0,1]=4 133 B4R0.2 CC=CCO CNP0498228.0 [2,0,0,0,0,0|1,0,1]=4 134 B4R0.2 CCCCC CNP0486380.0 [2,0,0,0,0,0|2,0,0]=4 135 B4R0.2 CCCCI CNP0558480.0 [2,0,0,0,0,0|2,0,0]=4 136 B4R0.2 CCCCN CNP0597509.0 [2,0,0,0,0,0|2,0,0]=4 137 B4R0.2 CCCCO CNP0505612.0 [2,0,0,0,0,0|1,0,0]=3 138 B4R0.2 CCCCS CNP0598878.0 [2,0,0,0,0,0|1,1,0]=4 139 B4R0.2 CCCNC CNP0599313.0 [2,0,0,0,0,0|1,0,1]=4 140 B4R0.2 CCCOC CNP0609062.0 [2,0,0,0,0,0|2,0,0]=4 141 B4R0.2 CCCSC CNP0481317.0 [2,0,0,0,0,0|2,0,0]=4 142 B4R0.2 CCCSO CNP0594110.0 [2,0,0,0,0,0|2,0,0]=4 143 B4R0.2 CNCCN CNP0496542.0 [2,0,0,0,0,0|1,0,1]=4 144 B4R0.2 CNCCO CNP0513801.0 [2,0,0,0,0,0|0,0,1]=3 145 B4R0.2 COCCI CNP0495552.0 [2,0,0,0,0,0|2,0,0]=4 146 B4R0.2 COCCO CNP0561250.0 [2,0,0,0,0,0|1,0,0]=3 147 B4R0.2 COCC[Si] CNP0501162.0 [2,0,0,0,0,0|2,0,0]=4 148 B4R0.2 CSCCO CNP0574269.0 [2,0,0,0,0,0|1,0,0]=3 149 B4R0.2 NCCCO CNP0538228.0 [2,0,0,0,0,0|2,0,0]=4 150 B4R0.2 O=CCCO CNP0525339.0 [2,0,0,0,0,0|2,0,0]=4 151 B4R0.2 OCCCBr CNP0506989.0 [2,0,0,0,0,0|2,0,0]=4 152 B4R0.2 OCCCO CNP0503416.0 [2,0,0,0,0,0|2,0,0]=4 153 B4R0.2 OCCCS CNP0586497.0 [2,0,0,0,0,0|2,0,0]=4 154 B4R0.3 CC(C)(C)C CNP0568936.0 [2,0,0,0,0,0|1,0,0]=3 155 B4R0.3 CC(C)(C)O CNP0541010.0 [2,0,0,0,0,0|1,0,0]=3 156 B4R0.3 CS(=S)(C)O CNP0608926.0 [2,0,0,0,0,0|2,0,0]=4 157 B4R0.3 C[As+](C)(C)C CNP0594598.0 [2,0,0,0,0,0|0,1,0]=3 158 B4R0.3 C[As](=O)(C)O CNP0492406.0 [2,0,0,0,0,0|1,1,0]=4 159 B4R0.3 C[N+](C)(C)C CNP0519180.0 [2,0,0,0,0,0|0,0,0]=2 160 B4R0.3 C[N+](C)(C)C CNP0559650.0 [2,0,0,0,0,0|0,0,0]=2 161 B4R0.3 C[N+](C)(C)O CNP0585867.0 [2,0,0,0,0,0|0,0,0]=2 162 B4R0.3 C[N+](C)(C)[O-] CNP0598895.0 [2,0,0,0,0,0|0,0,1]=3 163 B4R0.3 C[Si](C)(C)Cl CNP0530881.0 [2,0,0,0,0,0|2,0,0]=4 164 B4R0.3 C[Si](C)(C)O CNP0575582.0 [2,0,0,0,0,0|1,0,0]=3 165 B4R0.3 C[Si](C)(O)O CNP0563438.0 [2,0,0,0,0,0|2,0,0]=4 166 B6R0.1 C=C(CO)CCO CNP0082069.0 [1,1,0,0,0,0|1,0,1]=4 167 B6R0.1 CC(=CCO)CO CNP0277047.0 [1,1,0,0,0,0|1,0,1]=4 168 B6R0.1 CCC[C@@H](C)CC CNP0407855.1 [1,1,0,0,0,0|2,0,0]=4 169 B6R0.1 CCC[C@@H](C)CO CNP0356704.1 [1,1,0,0,0,0|2,0,0]=4 170 B6R0.1 CCC[C@@H](C)SC CNP0188673.1 [1,1,0,0,0,0|2,0,0]=4 171 B6R0.1 CCC[C@H](C)CC CNP0407855.2 [1,1,0,0,0,0|2,0,0]=4 172 B6R0.1 CCC[C@H](C)CO CNP0356704.2 [1,1,0,0,0,0|2,0,0]=4 173 B6R0.1 CCC[C@H](C)NC CNP0298650.1 [1,1,0,0,0,0|2,0,0]=4 174 B6R0.1 CC[C@@H](C)CCO CNP0260863.2 [1,1,0,0,0,0|1,0,0]=3 175 B6R0.1 CC[C@H](C)CCO CNP0260863.1 [1,1,0,0,0,0|1,0,0]=3 176 B6R0.1 OCC[C@H](O)CO CNP0190269.1 [1,1,0,0,0,0|2,0,0]=4 177 B6R0.2 CC(=O)C[C@@H](C)O CNP0209002.1 [1,1,0,0,0,0|2,0,0]=4 178 B6R0.2 CC(=O)C[C@H](C)O CNP0209002.2 [1,1,0,0,0,0|2,0,0]=4 179 B6R0.2 CC(C)CC(C)C CNP0241759.0 [1,1,0,0,0,0|2,0,0]=4 180 B6R0.2 CC(C)CC(C)O CNP0493734.0 [1,1,0,0,0,0|1,0,0]=3 181 B6R0.2 CC(C)C[C@@H](C)N CNP0556567.1 [1,1,0,0,0,0|2,0,0]=4 182 B6R0.2 CN(C)CC(=O)O CNP0175140.0 [1,1,0,0,0,0|0,0,2]=4 183 B6R0.2 C[C@@H](O)C[C@@H](C)O CNP0138640.1 [1,1,0,0,0,0|2,0,0]=4 184 B6R0.2 C[C@H]([13CH3])CC(=O)O CNP0175489.1 [1,1,0,0,0,0|1,0,1]=4 185 B6R0.2 C[C](C)CC(=O)O CNP0606523.0 [1,1,0,0,0,0|1,0,1]=4 186 B6R0.2 C[S+](C)CC(=O)O CNP0149325.0 [1,1,0,0,0,0|1,0,1]=4 187 B6R0.3 CC(C)C(C)CO CNP0127606.0 [1,1,0,0,0,0|1,0,0]=3 188 B6R0.3 CC(C)[C@@H](N)CO CNP0177308.2 [1,1,0,0,0,0|1,0,0]=3 189 B6R0.3 CC(C)[C@@H](S)CO CNP0191310.1 [1,1,0,0,0,0|1,0,0]=3 190 B6R0.3 CC(C)[C@H](N)CO CNP0177308.1 [1,1,0,0,0,0|1,0,0]=3 191 B6R0.3 CCC(O)C(C)C CNP0265736.0 [1,1,0,0,0,0|2,0,0]=4 192 B6R0.3 CCC(S)C(C)C CNP0611989.0 [1,1,0,0,0,0|2,0,0]=4 193 B6R0.3 CC[C@H](C)C(C)C CNP0304167.1 [1,1,0,0,0,0|2,0,0]=4 194 B6R0.3 C[C@@H](O)[C@@H](C)CO CNP0424442.1 [1,1,0,0,0,0|2,0,0]=4 195 B6R0.3 C[C@@H](O)[C@@H](O)CO CNP0199934.3 [1,1,0,0,0,0|2,0,0]=4 196 B6R0.3 C[C@@H](O)[C@H](N)CO CNP0049541.1 [1,1,0,0,0,0|2,0,0]=4 197 B6R0.3 C[C@@H](O)[C@H](O)CO CNP0199934.1 [1,1,0,0,0,0|2,0,0]=4 198 B6R0.3 C[C@H](CCl)N(C)C CNP0239301.1 [1,1,0,0,0,0|1,0,1]=4 199 B6R0.3 C[C@H](O)[C@H](O)CO CNP0199934.2 [1,1,0,0,0,0|2,0,0]=4 200 B6R0.4 CC(=CCCN)C CNP0568876.0 [1,1,0,0,0,0|2,0,0]=4 201 B6R0.4 CC(=CCCO)C CNP0410779.0 [1,1,0,0,0,0|1,0,0]=3 202 B6R0.4 CC(=O)NCCO CNP0304709.0 [1,1,0,0,0,0|2,0,0]=4 203 B6R0.4 CC(=O)OCCO CNP0589275.0 [1,1,0,0,0,0|2,0,0]=4 204 B6R0.4 CC(C)CC#CO CNP0482838.0 [1,1,0,0,0,0|1,0,1]=4 205 B6R0.4 CC(C)CC=NO CNP0235743.0 [1,1,0,0,0,0|1,0,1]=4 206 B6R0.4 CC(C)CCC#N CNP0386277.0 [1,1,0,0,0,0|2,0,0]=4 207 B6R0.4 CC(C)CCC=O CNP0198082.0 [1,1,0,0,0,0|1,0,1]=4 208 B6R0.4 CC(C)CCCO CNP0344466.0 [1,1,0,0,0,0|1,0,0]=3 209 B6R0.4 CC(C)NCCN CNP0082470.0 [1,1,0,0,0,0|2,0,0]=4 210 B6R0.4 CC(C)NCCO CNP0141461.0 [1,1,0,0,0,0|1,0,0]=3 211 B6R0.4 CC(C)OCCO CNP0079907.0 [1,1,0,0,0,0|1,0,0]=3 212 B6R0.4 CCCCC(C)C CNP0312749.0 [1,1,0,0,0,0|2,0,0]=4 213 B6R0.4 CCCSC(C)C CNP0228244.0 [1,1,0,0,0,0|2,0,0]=4 214 B6R0.4 CCNCC(C)C CNP0165310.0 [1,1,0,0,0,0|2,0,0]=4 215 B6R0.4 CCSCC(C)C CNP0208462.0 [1,1,0,0,0,0|2,0,0]=4 216 B6R0.4 CNCCC(C)C CNP0254439.0 [1,1,0,0,0,0|2,0,0]=4 217 B6R0.4 COCC=C(C)C CNP0493784.0 [1,1,0,0,0,0|1,0,1]=4 218 B6R0.4 COCCC(C)C CNP0316382.0 [1,1,0,0,0,0|1,0,0]=3 219 B6R0.4 COCCN(C)C CNP0429553.0 [1,1,0,0,0,0|0,0,1]=3 220 B6R0.4 C[S+](C)CCC=O CNP0136791.0 [1,1,0,0,0,0|1,0,1]=4 221 B6R0.7 CC(C)(C)C(=O)O CNP0343251.0 [1,1,0,0,0,0|1,0,1]=4 222 B6R0.7 CC(C)C(C)(C)C CNP0107952.0 [1,1,0,0,0,0|1,0,0]=3 223 B6R0.7 CC(O)C(C)(C)O CNP0491018.0 [1,1,0,0,0,0|2,0,0]=4 224 B6R0.8 CC(N)(CO)CO CNP0076432.0 [1,1,0,0,0,0|2,0,0]=4 225 B6R0.8 CCC(C)(C)CC CNP0117655.0 [1,1,0,0,0,0|1,0,0]=3 226 B6R0.8 CCC(C)(C)SC CNP0141733.0 [1,1,0,0,0,0|1,0,0]=3 227 B6R0.8 CCC(C)(O)CC CNP0314635.0 [1,1,0,0,0,0|2,0,0]=4 228 B6R0.8 CCC(C)(O)CO CNP0308368.0 [1,1,0,0,0,0|2,0,0]=4 229 B6R0.8 CP(=O)(CO)CO CNP0039491.0 [1,1,0,0,0,0|1,1,0]=4 230 B6R0.8 CSC(C)(C)SC CNP0076175.0 [1,1,0,0,0,0|2,0,0]=4 231 B8R0.14 CCCC(=O)C(C)(C)C CNP0077010.0 [0,2,0,0,0,0|2,0,0]=4 232 B8R0.21 CC(C)(C)OCCCN CNP0186216.0 [0,2,0,0,0,0|2,0,0]=4 233 B8R0.21 CC(C)(S)CCOC=O CNP0002927.0 [0,2,0,0,0,0|2,0,0]=4 234 B8R0.21 CSCCC[N+](C)(C)C CNP0070476.0 [0,2,0,0,0,0|0,1,0]=3 235 B8R0.21 C[N+](C)(C)CCCC=O CNP0530420.0 [0,2,0,0,0,0|0,0,1]=3 236 B8R0.24 C=C(C[N+](C)(C)C)OC CNP0599697.0 [0,2,0,0,0,0|0,0,1]=3 237 B8R0.24 COC(C)C[N+](C)(C)C CNP0501897.0 [0,2,0,0,0,0|0,0,0]=2 238 B8R0.29 C[As+](C)(C)CCC(=O)[O-] CNP0065909.0 [0,2,0,0,0,0|0,1,1]=4 239 B8R0.29 C[N+](C)(C)CCC(=O)[O-] CNP0359196.0 [0,2,0,0,0,0|0,0,1]=3 240 B8R0.27 CC(C)(C)[C@@H](N)C(=O)O CNP0182487.1 [0,2,0,0,0,0|1,0,1]=4 241 B8R0.27 CC(C)(C)[C@H](N)C(=O)O CNP0182487.2 [0,2,0,0,0,0|1,0,1]=4 242 B8R0.27 C[C@@H](C(=O)[O-])[N+](C)(C)C CNP0588198.1 [0,2,0,0,0,0|0,0,2]=4 243 B8R0.27 C[C@H]([C@H]([O-])O)[N+](C)(C)C CNP0440483.1 [0,2,0,0,0,0|0,0,0]=2 244 B8R0.33 CC(C)(O)CC(C)(C)O CNP0357165.0 [0,2,0,0,0,0|2,0,0]=4 245 B8R0.33 C[N+](C)([O-])CP(=O)(O)O CNP0515779.0 [0,2,0,0,0,0|2,0,0]=4 246 B8R0.34 C[C@H](O)C[C@](C)(O)CO CNP0530490.1 [0,2,0,0,0,0|2,0,0]=4 247 B8R0.13 CC(O)(CO)[C@@H](O)CO CNP0176272.1 [0,2,0,0,0,0|2,0,0]=4 248 B8R0.13 C[C@@](O)(CO)[C@@H](O)CO CNP0176272.3 [0,2,0,0,0,0|2,0,0]=4 249 B8R0.13 C[C@@](O)(CO)[C@H](O)CO CNP0176272.4 [0,2,0,0,0,0|2,0,0]=4 250 B8R0.13 C[C@](O)(CO)C(O)CO CNP0176272.5 [0,2,0,0,0,0|2,0,0]=4 251 B8R0.13 C[C@](O)(CO)[C@H](O)CO CNP0176272.2 [0,2,0,0,0,0|2,0,0]=4 252 B8R0.30 C[C@@](O)(CC#N)CCO CNP0018267.1 [0,2,0,0,0,0|2,0,0]=4 253 B8R0.30 C[N+](C)([C-]=[P+]=O)CCO CNP0564036.0 [0,2,0,0,0,0|0,0,1]=3 254 B8R0.31 CCCC(C)(CC)CC CNP0251441.0 [0,2,0,0,0,0|2,0,0]=4 255 B8R0.31 CCCC(C)(CC)OC CNP0082474.0 [0,2,0,0,0,0|2,0,0]=4 256 B8R0.17 CCC(C)(C)C(C)(C)C CNP0484700.0 [0,2,0,0,0,0|2,0,0]=4 257 B6R1.2 CC1=CCOC1 CNP0516552.0 [1,0,0,1,0,0|1,0,1]=4 258 B6R1.2 CC1=COCC1 CNP0002470.0 [1,0,0,1,0,0|1,0,1]=4 259 B6R1.2 CC1CCCC1 CNP0194612.0 [1,0,0,1,0,0|2,0,0]=4 260 B6R1.2 CN1CCCC1 CNP0395436.0 [1,0,0,1,0,0|1,0,1]=4 261 B6R1.2 C[C@@H]1CCSC1 CNP0174337.1 [1,0,0,1,0,0|1,1,0]=4 262 B6R1.2 O=C1CCOC1 CNP0051503.0 [1,0,0,1,0,0|2,0,0]=4 263 B6R1.3 CCCC1CC1 CNP0506060.0 [1,0,0,1,0,0|2,0,0]=4 264 B6R1.3 NCCN1CC1 CNP0522628.0 [1,0,0,1,0,0|1,0,1]=4 265 B6R1.8 CC[C@@H]1C[C@@H]1C CNP0076250.1 [1,0,0,1,0,0|2,0,0]=4 266 B6R1.8 O=C1CC1CO CNP0073765.0 [1,0,0,1,0,0|2,0,0]=4 267 B6R1.9 CC1CC1(C)C CNP0507743.0 [1,0,0,1,0,0|2,0,0]=4 268 B6R1.10 CC1(CCO1)C CNP0252865.0 [1,0,0,1,0,0|1,0,0]=3 269 B6R1.10 CC1(CCS1)C CNP0181332.0 [1,0,0,1,0,0|1,1,0]=4 270 B8R1.51 CC1(COC(=O)C1)C CNP0084721.0 [0,1,0,1,0,0|1,0,1]=4 271 B8R1.51 C[C@H]1CCC(C1)(C)C CNP0133145.1 [0,1,0,1,0,0|2,0,0]=4 272 B8R1.72 CC1(CCCCC1)C CNP0281819.0 [0,1,0,1,0,0|2,0,0]=4 273 B8R1.72 C[N+]1(CCCCC1)[O-] CNP0052569.0 [0,1,0,1,0,0|2,0,0]=4 274 B8R1.19 CC1(CCC[C@@H]1O)C CNP0549501.1 [0,1,0,1,0,0|2,0,0]=4 275 B8R1.19 CC1(CCC[C@H]1O)C CNP0549501.2 [0,1,0,1,0,0|2,0,0]=4 276 B8R1.19 C[C@H]1CCCC1(C)C CNP0142130.1 [0,1,0,1,0,0|2,0,0]=4 277 B8R1.52 CCC1(CCCC1)C CNP0310915.0 [0,1,0,1,0,0|2,0,0]=4