0 B7R0.6 CC(=CC=C(C)C)C CNP0084726.0 [0,0,0,0,0,0|2,0,2]=4 1 B7R0.6 CC(=O)C=CC(C)C CNP0282647.0 [0,0,0,0,0,0|3,0,1]=4 2 B7R0.6 CC(=O)CCC(C)C CNP0109911.0 [0,0,0,0,0,0|3,0,1]=4 3 B7R0.6 CC(=O)COC(C)C CNP0500658.0 [0,0,0,0,0,0|2,1,1]=4 4 B7R0.6 CC(=O)NCC(C)C CNP0330824.0 [0,0,0,0,0,0|3,0,1]=4 5 B7R0.6 CC(=O)OCC(C)C CNP0233943.0 [0,0,0,0,0,0|2,1,1]=4 6 B7R0.6 CC(C)CCC(C)C CNP0238949.0 [0,0,0,0,0,0|2,0,0]=2 7 B7R0.6 CC(C)CN[S+](C)[O-] CNP0568389.0 [0,0,0,0,0,0|4,0,0]=4 8 B7R0.6 CC(C)SSC(C)C CNP0325954.0 [0,0,0,0,0,0|0,0,0]=0 9 B7R0.6 CC(O)C=CC(C)O CNP0301514.0 [0,0,0,0,0,0|4,0,0]=4 10 B7R0.6 CC(O)COC(C)C CNP0503370.0 [0,0,0,0,0,0|2,1,0]=3 11 B6R0.4 C=CCSC(C)C CNP0309084.0 [1,0,0,0,0,0|1,0,2]=4 12 B6R0.4 CC(C)CCCO CNP0344466.0 [1,0,0,0,0,0|3,0,0]=4 13 B6R0.4 CC(C)CSC#N CNP0268195.0 [1,0,0,0,0,0|2,0,1]=4 14 B6R0.4 CC(C)NCCN CNP0082470.0 [1,0,0,0,0,0|3,0,0]=4 15 B6R0.4 CC(C)NCCO CNP0141461.0 [1,0,0,0,0,0|3,0,0]=4 16 B6R0.4 CC(C)OCCO CNP0079907.0 [1,0,0,0,0,0|2,1,0]=4 17 B6R0.4 CC=CCC(C)C CNP0081831.0 [1,0,0,0,0,0|2,0,1]=4 18 B6R0.4 CCCCC(C)C CNP0312749.0 [1,0,0,0,0,0|2,0,0]=3 19 B6R0.4 CCCC[C@@H](C)O CNP0276755.1 [1,0,0,0,0,0|3,0,0]=4 20 B6R0.4 CCCC[C@H](C)O CNP0276755.2 [1,0,0,0,0,0|3,0,0]=4 21 B6R0.4 CCCSC(=O)C CNP0076500.0 [1,0,0,0,0,0|2,0,1]=4 22 B6R0.4 CCCSC(C)C CNP0228244.0 [1,0,0,0,0,0|1,0,0]=2 23 B6R0.4 CCCSC(C)S CNP0609747.0 [1,0,0,0,0,0|2,0,0]=3 24 B6R0.4 CCCS[S+](C)[O-] CNP0597218.0 [1,0,0,0,0,0|3,0,0]=4 25 B6R0.4 CCNCC(C)C CNP0165310.0 [1,0,0,0,0,0|2,0,0]=3 26 B6R0.4 CCOC[C@@H](C)O CNP0076159.1 [1,0,0,0,0,0|2,1,0]=4 27 B6R0.4 CCSCC(C)C CNP0208462.0 [1,0,0,0,0,0|1,0,0]=2 28 B6R0.4 CCSSC(C)C CNP0003135.0 [1,0,0,0,0,0|0,0,0]=1 29 B6R0.4 CNCCC(C)C CNP0254439.0 [1,0,0,0,0,0|3,0,0]=4 30 B6R0.4 COCCC(C)C CNP0316382.0 [1,0,0,0,0,0|3,0,0]=4 31 B8R0.9 CCC(C)CCC(C)C CNP0495437.0 [0,1,0,0,0,0|2,0,0]=3 32 B8R0.9 CCC(C)CCC(C)O CNP0076364.0 [0,1,0,0,0,0|3,0,0]=4 33 B8R0.9 CCC(O)CCC(C)C CNP0554641.0 [0,1,0,0,0,0|3,0,0]=4 34 B8R0.23 CC(C)CC(=O)C(C)O CNP0003258.0 [0,1,0,0,0,0|3,0,0]=4 35 B8R0.23 CC(C)C[C@H](C)C(C)C CNP0297055.1 [0,1,0,0,0,0|2,0,0]=3 36 B8R0.23 CC(C)OC(=O)C(C)C CNP0251914.0 [0,1,0,0,0,0|1,1,0]=3 37 B8R0.29 CC(C)NCC(C)(C)N CNP0083049.0 [0,1,0,0,0,0|2,0,0]=3 38 B8R0.29 C[C@@H](O)/C=C/C(C)(C)O CNP0384905.1 [0,1,0,0,0,0|3,0,0]=4 39 B8R1.3 CC1CCN(CC1)C CNP0529817.0 [0,0,0,1,0,0|3,0,0]=4 40 B8R1.3 C[C@@H]1CC[C@H](SC1)C CNP0511426.1 [0,0,0,1,0,0|1,0,0]=2 41 B8R1.3 C[C@H]1CC[C@@H](CC1)C CNP0167737.2 [0,0,0,1,0,0|2,0,0]=3 42 B8R1.3 C[C@H]1CC[C@@H](CC1)O CNP0179489.1 [0,0,0,1,0,0|3,0,0]=4 43 B8R1.3 C[C@H]1CC[C@H](CC1)C CNP0167737.1 [0,0,0,1,0,0|2,0,0]=3 44 B8R1.35 CC(C)OCC1CO1 CNP0071169.0 [0,0,0,1,0,0|2,1,0]=4 45 B8R1.51 CC1CCC(C1)(C)O CNP0582682.0 [0,0,0,1,0,0|3,0,0]=4 46 B8R1.51 CC1COC(O1)(C)C CNP0082638.0 [0,0,0,1,0,0|2,1,0]=4 47 B8R1.51 C[C@H]1CCC(C1)(C)C CNP0133145.1 [0,0,0,1,0,0|2,0,0]=3 48 B8R1.77 CN(C)C1=NC1(C)C CNP0460631.0 [0,0,0,1,0,0|3,0,0]=4 49 B6R0.2 CC(=CC(C)C)C CNP0084966.0 [0,0,0,0,1,0|1,0,1]=3 50 B6R0.2 CC(=O)CC(C)C CNP0178924.0 [0,0,0,0,1,0|2,0,1]=4 51 B6R0.2 CC(=O)OC(C)C CNP0234567.0 [0,0,0,0,1,0|1,1,1]=4 52 B6R0.2 CC(=S)OC(C)C CNP0539735.0 [0,0,0,0,1,0|1,1,1]=4 53 B6R0.2 CC(C)CC(C)C CNP0241759.0 [0,0,0,0,1,0|1,0,0]=2 54 B6R0.2 CC(C)CC(C)O CNP0493734.0 [0,0,0,0,1,0|2,0,0]=3 55 B6R0.2 CC(C)C[C@@H](C)N CNP0556567.1 [0,0,0,0,1,0|2,0,0]=3 56 B6R0.2 CC(C)C[S@@+](C)[O-] CNP0553779.1 [0,0,0,0,1,0|3,0,0]=4 57 B6R0.2 CC(C)C[S@@H+](C)[O-] CNP0593384.1 [0,0,0,0,1,0|3,0,0]=4 58 B6R0.2 CC(C)NC(C)C CNP0209283.0 [0,0,0,0,1,0|1,0,0]=2 59 B6R0.2 CC(C)SC(=N)N CNP0584188.0 [0,0,0,0,1,0|2,0,1]=4 60 B6R0.2 CC(C)SC(C)C CNP0213199.0 [0,0,0,0,1,0|0,0,0]=1 61 B6R0.2 CC(S)SC(C)S CNP0174729.0 [0,0,0,0,1,0|2,0,0]=3 62 B6R0.2 C[C@@H](O)C[C@@H](C)O CNP0138640.1 [0,0,0,0,1,0|3,0,0]=4 63 B8R0.28 CC(=CC=CC(C)C)C CNP0313251.0 [0,0,0,0,0,1|2,0,1]=4 64 B8R0.28 CC(C)CCCC(C)C CNP0166483.0 [0,0,0,0,0,1|2,0,0]=3 65 B8R0.28 CC(C)CCC[C@@H](C)N CNP0402006.1 [0,0,0,0,0,1|3,0,0]=4 66 B8R0.28 CC(C)CCC[C@H](C)N CNP0402006.2 [0,0,0,0,0,1|3,0,0]=4 67 B8R0.28 CC(C)CCC[C@H](C)O CNP0182781.1 [0,0,0,0,0,1|3,0,0]=4 68 B8R0.28 CC(C)CNCC(C)C CNP0347227.0 [0,0,0,0,0,1|2,0,0]=3 69 B8R0.28 CC(C)COCC(C)C CNP0126629.0 [0,0,0,0,0,1|1,1,0]=3 70 B8R0.28 CC(C)N=C=NC(C)C CNP0254661.0 [0,0,0,0,0,1|2,0,0]=3 71 B8R0.28 CC(C)SSSC(C)C CNP0350713.0 [0,0,0,0,0,1|0,0,0]=1 72 B5R0.1 CC(C)CCN CNP0107663.0 [2,0,0,0,0,0|2,0,0]=4 73 B5R0.1 CC(C)CCO CNP0115711.0 [2,0,0,0,0,0|2,0,0]=4 74 B5R0.1 CC(C)CCS CNP0222694.0 [2,0,0,0,0,0|2,0,0]=4 75 B5R0.1 CC=CC(C)C CNP0513218.0 [2,0,0,0,0,0|1,0,1]=4 76 B5R0.1 CCC=C(C)C CNP0331653.0 [2,0,0,0,0,0|1,0,1]=4 77 B5R0.1 CCCC(C)C CNP0319065.0 [2,0,0,0,0,0|1,0,0]=3 78 B5R0.1 CCCC(C)S CNP0029638.0 [2,0,0,0,0,0|2,0,0]=4 79 B5R0.1 CCC[C@@H](C)O CNP0287976.1 [2,0,0,0,0,0|2,0,0]=4 80 B5R0.1 CCC[C@H](C)O CNP0287976.2 [2,0,0,0,0,0|2,0,0]=4 81 B5R0.1 CCOC(C)C CNP0604172.0 [2,0,0,0,0,0|0,1,0]=3 82 B5R0.1 CCSC(=O)C CNP0274861.0 [2,0,0,0,0,0|1,0,1]=4 83 B5R0.1 CCSC(C)C CNP0254931.0 [2,0,0,0,0,0|0,0,0]=2 84 B5R0.1 CCSC(C)S CNP0579398.0 [2,0,0,0,0,0|1,0,0]=3 85 B5R0.1 CN=CC(C)C CNP0149349.0 [2,0,0,0,0,0|2,0,0]=4 86 B5R0.1 CNCC(C)C CNP0273998.0 [2,0,0,0,0,0|2,0,0]=4 87 B5R0.1 COCC(C)C CNP0528468.0 [2,0,0,0,0,0|1,1,0]=4 88 B5R0.1 CSCC(C)C CNP0405087.0 [2,0,0,0,0,0|1,0,0]=3 89 B5R0.1 CSSC(C)C CNP0267830.0 [2,0,0,0,0,0|0,0,0]=2 90 B5R0.2 C=CSSCC CNP0003136.0 [2,0,0,0,0,0|0,0,2]=4 91 B5R0.2 CCCCCC CNP0269021.0 [2,0,0,0,0,0|2,0,0]=4 92 B5R0.2 CCCSCC CNP0316215.0 [2,0,0,0,0,0|1,0,0]=3 93 B5R0.2 CCCSSC CNP0296815.0 [2,0,0,0,0,0|2,0,0]=4 94 B5R0.2 CCSCCN CNP0506731.0 [2,0,0,0,0,0|2,0,0]=4 95 B5R0.2 CCSSCC CNP0416624.0 [2,0,0,0,0,0|0,0,0]=2 96 B5R0.2 CCSSSC CNP0407481.0 [2,0,0,0,0,0|1,0,0]=3 97 B5R0.2 CSSSSC CNP0225688.0 [2,0,0,0,0,0|2,0,0]=4 98 B7R0.2 CCC(=O)CC(C)C CNP0284484.0 [1,1,0,0,0,0|2,0,0]=4 99 B7R0.2 CCC(=O)OC(C)C CNP0250066.0 [1,1,0,0,0,0|1,1,0]=4 100 B7R0.2 CC[C@H](C)CC(C)C CNP0229015.1 [1,1,0,0,0,0|2,0,0]=4 101 B7R0.3 CCCCC(C)CO CNP0563062.0 [1,1,0,0,0,0|2,0,0]=4 102 B7R0.3 CCCC[C@@H](C)CC CNP0161853.2 [1,1,0,0,0,0|2,0,0]=4 103 B7R0.3 CCCC[C@H](C)CC CNP0161853.1 [1,1,0,0,0,0|2,0,0]=4 104 B7R0.3 CCCC[C@H](C)CO CNP0563062.1 [1,1,0,0,0,0|2,0,0]=4 105 B7R0.3 CCCSC(S)CC CNP0370062.0 [1,1,0,0,0,0|2,0,0]=4 106 B7R0.3 CCSSC(C)CC CNP0075907.0 [1,1,0,0,0,0|0,0,0]=2 107 B7R0.3 CCSSC(C)SC CNP0003141.0 [1,1,0,0,0,0|0,0,0]=2 108 B7R0.3 CC[C@@H](C)SSSC CNP0173477.1 [1,1,0,0,0,0|1,0,0]=3 109 B7R0.4 CC(C)CCCCO CNP0497904.0 [1,1,0,0,0,0|2,0,0]=4 110 B7R0.4 CC=CSSC(C)C CNP0589450.0 [1,1,0,0,0,0|0,0,1]=3 111 B7R0.4 CCCCCC(C)C CNP0146536.0 [1,1,0,0,0,0|2,0,0]=4 112 B7R0.4 CCCNCC(C)C CNP0333564.0 [1,1,0,0,0,0|2,0,0]=4 113 B7R0.4 CCCSCC(C)C CNP0116113.0 [1,1,0,0,0,0|1,0,0]=3 114 B7R0.4 CCCSSC(C)C CNP0309421.0 [1,1,0,0,0,0|0,0,0]=2 115 B7R0.4 CCNCCC(C)C CNP0184897.0 [1,1,0,0,0,0|2,0,0]=4 116 B7R0.4 CCOCCC(C)C CNP0032749.0 [1,1,0,0,0,0|1,1,0]=4 117 B7R0.4 CSSC=CC(C)C CNP0002674.0 [1,1,0,0,0,0|2,0,0]=4 118 B7R0.4 [CH2]CCCCC(C)C CNP0488090.0 [1,1,0,0,0,0|2,0,0]=4 119 B7R0.5 CCCC(=O)C(C)C CNP0310980.0 [1,1,0,0,0,0|2,0,0]=4 120 B7R0.5 CCC[C@H](C)C(C)C CNP0153562.1 [1,1,0,0,0,0|2,0,0]=4 121 B7R0.5 CCOC(=O)C(C)C CNP0230163.0 [1,1,0,0,0,0|1,1,0]=4 122 B7R0.5 CCSC(C)C(C)C CNP0213489.0 [1,1,0,0,0,0|1,0,0]=3 123 B7R0.8 CCCCC(C)(C)C CNP0139885.0 [1,1,0,0,0,0|2,0,0]=4 124 B7R0.8 CCCSC(C)(C)C CNP0177431.0 [1,1,0,0,0,0|1,0,0]=3 125 B7R0.9 CC(C)CC(C)(C)C CNP0079943.0 [0,1,0,0,1,0|1,0,0]=3 126 B7R0.9 CC(C)CC(C)(C)O CNP0085669.0 [0,1,0,0,1,0|1,0,0]=3 127 B7R0.9 CN(C)CC(C)(C)O CNP0312346.0 [0,1,0,0,1,0|2,0,0]=4 128 B7R0.9 C[C@@H](O)CC(C)(C)O CNP0352838.2 [0,1,0,0,1,0|2,0,0]=4 129 B7R0.9 C[C@H](O)CC(C)(C)O CNP0352838.1 [0,1,0,0,1,0|2,0,0]=4 130 B7R0.16 CC(C)C(=O)C(C)C CNP0413157.0 [0,1,0,0,1,0|1,0,0]=3 131 B7R0.16 CC(C)C(=O)C(C)O CNP0291790.0 [0,1,0,0,1,0|2,0,0]=4 132 B7R0.16 CC(C)C(N)C(C)C CNP0083055.0 [0,1,0,0,1,0|1,0,0]=3 133 B7R0.16 CC(C)C(O)C(C)C CNP0366830.0 [0,1,0,0,1,0|1,0,0]=3 134 B9R0.1 CC(C)CCC[C@@H](C)CO CNP0195092.1 [0,1,0,0,0,1|2,0,0]=4 135 B9R0.1 CC(C)CCC[C@H](C)CO CNP0195092.2 [0,1,0,0,0,1|2,0,0]=4 136 B9R0.1 CCC(C)CC=CC(C)C CNP0083062.0 [0,1,0,0,0,1|2,0,0]=4 137 B9R0.1 CC[C@H](C)CCCC(C)C CNP0308857.1 [0,1,0,0,0,1|2,0,0]=4 138 B9R0.7 CC(C)COC(=O)C(C)C CNP0146650.0 [0,1,0,0,0,1|1,1,0]=4 139 B9R0.53 CC(=CC(=O)SC(C)C)C CNP0219971.0 [0,1,0,0,0,1|1,0,1]=4 140 B9R0.53 CC(C)CC(=O)CC(C)C CNP0084478.0 [0,1,0,0,0,1|2,0,0]=4 141 B9R0.53 CC(C)CC(=O)OC(C)C CNP0311912.0 [0,1,0,0,0,1|1,1,0]=4 142 B9R0.53 CC(C)CC(=O)SC(C)C CNP0159406.0 [0,1,0,0,0,1|1,0,0]=3 143 B9R0.53 CC(C)CC(C)CC(C)C CNP0076048.0 [0,1,0,0,0,1|2,0,0]=4 144 B9R0.53 CC(C)CC(O)CC(C)C CNP0003532.0 [0,1,0,0,0,1|2,0,0]=4 145 B9R0.53 CC(C)NC(=N)NC(C)C CNP0566006.0 [0,1,0,0,0,1|2,0,0]=4 146 B9R0.53 CC(C)NC(=O)NC(C)C CNP0313716.0 [0,1,0,0,0,1|2,0,0]=4 147 B9R0.53 CC(C)OC(C)OC(C)C CNP0324928.0 [0,1,0,0,0,1|0,2,0]=4 148 B9R0.53 CC(C)OP(=O)OC(C)C CNP0511332.0 [0,1,0,0,0,1|0,2,0]=4 149 B9R0.23 CC[C@@H](C)C(=O)OC(C)C CNP0190185.1 [0,2,0,0,0,0|1,1,0]=4 150 B9R0.24 CC=C(C)SSC(=CC)C CNP0569014.0 [0,2,0,0,0,0|0,0,2]=4 151 B9R0.24 CCC(C)CCC(C)CC CNP0597985.0 [0,2,0,0,0,0|2,0,0]=4 152 B9R0.24 CC[C@@H](C)SS[C@H](C)CC CNP0145468.1 [0,2,0,0,0,0|0,0,0]=2 153 B9R0.24 CSC(C)SSC(C)SC CNP0251620.0 [0,2,0,0,0,0|0,0,0]=2 154 B9R0.42 CC[C@@H](C)OC(=O)C(C)C CNP0424563.1 [0,2,0,0,0,0|1,1,0]=4 155 B9R0.43 CCC(CC)CCC(C)C CNP0312262.0 [0,2,0,0,0,0|2,0,0]=4 156 B9R0.79 CC(C)[C@@H](O)[C@@H](O)C(C)C CNP0336723.1 [0,2,0,0,0,0|2,0,0]=4 157 B9R0.77 CC(C)(C)N=NC(C)(C)C CNP0583169.0 [0,2,0,0,0,0|2,0,0]=4 158 B9R0.77 CC(C)(O)C#CC(C)(C)O CNP0046877.0 [0,2,0,0,0,0|2,0,0]=4 159 B7R1.2 C[C@@H]1CC[C@@H](C1)C CNP0177457.1 [1,0,0,1,0,0|2,0,0]=4 160 B7R1.2 C[C@@H]1SS[C@@H](S1)C CNP0162364.1 [1,0,0,1,0,0|1,0,0]=3 161 B7R1.3 CC1CCCCC1 CNP0191222.0 [1,0,0,1,0,0|2,0,0]=4 162 B7R1.3 CC1CCCCO1 CNP0292894.0 [1,0,0,1,0,0|1,1,0]=4 163 B7R1.3 CC1SCCSS1 CNP0344509.0 [1,0,0,1,0,0|1,0,0]=3 164 B7R1.3 C[C@@H]1CCCCN1 CNP0238241.1 [1,0,0,1,0,0|2,0,0]=4 165 B7R1.3 C[C@@H]1CCSSS1 CNP0310531.2 [1,0,0,1,0,0|1,0,0]=3 166 B7R1.3 C[C@@H]1OCCCS1 CNP0153942.1 [1,0,0,1,0,0|2,0,0]=4 167 B7R1.3 C[C@H]1CCCCN1 CNP0238241.2 [1,0,0,1,0,0|2,0,0]=4 168 B7R1.3 C[C@H]1CCSSS1 CNP0310531.1 [1,0,0,1,0,0|1,0,0]=3 169 B7R1.3 C[C@H]1CSSSS1 CNP0251938.1 [1,0,0,1,0,0|2,0,0]=4 170 B7R1.14 CC1(CCCC1)C CNP0125073.0 [1,0,0,1,0,0|2,0,0]=4 171 B7R1.14 CC1(CCCS1)S CNP0002611.0 [1,0,0,1,0,0|2,0,0]=4 172 B7R1.14 CC1(CCSS1)C CNP0245767.0 [1,0,0,1,0,0|0,0,0]=2 173 B7R1.14 CC1(CSSS1)C CNP0283830.0 [1,0,0,1,0,0|1,0,0]=3 174 B7R1.23 CCC1OC1(C)C CNP0495056.0 [1,0,0,1,0,0|1,1,0]=4 175 B9R1.66 C[C@H]1CC=CC(C1)(C)C CNP0096572.1 [0,0,0,1,0,1|2,0,0]=4 176 B9R1.66 C[C@H]1CCCC(C1)(C)C CNP0230826.1 [0,0,0,1,0,1|2,0,0]=4 177 B9R1.161 CC(C)C1OC1C(C)C CNP0501079.0 [0,0,0,1,0,1|1,1,0]=4 178 B9R1.1 CC[C@H]1CC[C@@H](CC1)C CNP0336780.1 [0,1,0,1,0,0|2,0,0]=4 179 B9R1.69 CC1OC(C(CS1)C)C CNP0552382.0 [0,1,0,1,0,0|2,0,0]=4 180 B9R1.69 C[C@@H]1CC[C@@H](C(=O)O1)C CNP0186029.3 [0,1,0,1,0,0|1,1,0]=4 181 B9R1.69 C[C@@H]1CC[C@@H](OC1=O)C CNP0186029.1 [0,1,0,1,0,0|1,1,0]=4 182 B9R1.69 C[C@@H]1CC[C@H](C(=O)O1)C CNP0186029.2 [0,1,0,1,0,0|1,1,0]=4 183 B9R1.69 C[C@@H]1CC[C@H]([C@@H](C1)C)C CNP0283819.1 [0,1,0,1,0,0|2,0,0]=4 184 B9R1.36 C[C@H]1CC(CC1=O)(C)C CNP0151852.1 [0,1,0,1,0,0|2,0,0]=4 185 B9R1.153 CC1(OC(=O)C1(C)C)C CNP0024798.0 [0,1,0,1,0,0|1,1,0]=4 186 B9R1.146 CC1(CCC(O1)(C)C)C CNP0103388.0 [0,1,0,1,0,0|2,0,0]=4 187 B9R2.49 C1=CC2CCC1CC2 CNP0168880.0 [0,0,0,2,0,0|2,0,0]=4 188 B9R2.49 C1CC2CCC1CO2 CNP0513490.0 [0,0,0,2,0,0|1,1,0]=4 189 B9R2.49 C1C[C@H]2CC[C@@H]1N=N2 CNP0063584.1 [0,0,0,2,0,0|2,0,0]=4 190 B5R0.5 CC(=C(C)C)C CNP0192659.0 [0,0,0,0,2,0|0,0,2]=4 191 B5R0.5 CC(=O)C(C)C CNP0209504.0 [0,0,0,0,2,0|1,0,1]=4 192 B5R0.5 CC(C)C(C)C CNP0183010.0 [0,0,0,0,2,0|0,0,0]=2 193 B5R0.5 CC(C)N(C)C CNP0419243.0 [0,0,0,0,2,0|1,0,0]=3 194 B5R0.5 CC(C)[C@@H](C)N CNP0573557.1 [0,0,0,0,2,0|1,0,0]=3 195 B5R0.5 CC(C)[C@@H](C)O CNP0315380.1 [0,0,0,0,2,0|1,0,0]=3 196 B5R0.5 CC(C)[C@@H](C)S CNP0316317.1 [0,0,0,0,2,0|1,0,0]=3 197 B5R0.5 CC(C)[C@H](C)O CNP0315380.2 [0,0,0,0,2,0|1,0,0]=3 198 B5R0.5 CC(O)C(C)S CNP0002511.0 [0,0,0,0,2,0|2,0,0]=4 199 B5R0.5 CC(S)C(C)S CNP0003531.0 [0,0,0,0,2,0|2,0,0]=4 200 B5R0.5 C[C@@H](O)[C@@H](C)O CNP0115674.2 [0,0,0,0,2,0|2,0,0]=4 201 B5R0.5 C[C@H](O)[C@@H](C)O CNP0115674.1 [0,0,0,0,2,0|2,0,0]=4 202 B5R0.5 C[C@H](O)[C@H](C)O CNP0115674.3 [0,0,0,0,2,0|2,0,0]=4 203 B9R0.55 CC(C)C#CC=CC(C)C CNP0164536.0 [0,0,0,0,0,2|2,0,0]=4 204 B9R0.55 CC(C)CCCCC(C)C CNP0111147.0 [0,0,0,0,0,2|2,0,0]=4 205 B9R0.55 CC(C)CSSCC(C)C CNP0113206.0 [0,0,0,0,0,2|0,0,0]=2