0 B8R0.29 CC(=O)CCC(C)(C)O MCULE-8412947781 [0,0,0,0,0,0|4,0,0]=4 1 B8R0.29 CC(=O)CCS(=O)(=O)C MCULE-3749048069 [0,0,0,0,0,0|3,0,1]=4 2 B8R0.29 CC(=O)NCP(=O)(O)O MCULE-6441383987 [0,0,0,0,0,0|2,0,0]=2 3 B8R0.29 CC(C)(C)CCC(=O)O MCULE-8929874481 [0,0,0,0,0,0|4,0,0]=4 4 B8R0.29 CC(C)(N)CCC(=O)O MCULE-1195501366 [0,0,0,0,0,0|4,0,0]=4 5 B8R0.29 CC(C)(N)CCC(=O)O MCULE-3901764815 [0,0,0,0,0,0|4,0,0]=4 6 B8R0.29 CC(C)(O)CCC(=O)[O-] MCULE-1599861039 [0,0,0,0,0,0|3,0,1]=4 7 B8R0.29 CC(C)(O)CCC(=O)[O-] MCULE-4576125997 [0,0,0,0,0,0|3,0,1]=4 8 B8R0.29 CC(C)(O)CCC(=O)[O-] MCULE-9770985354 [0,0,0,0,0,0|3,0,1]=4 9 B8R0.29 CC(C)(S)CCC(=O)O MCULE-7771494478 [0,0,0,0,0,0|3,1,0]=4 10 B8R0.29 CC(F)(F)CCC(=O)O MCULE-6694097155 [0,0,0,0,0,0|4,0,0]=4 11 B8R0.29 CP(=O)(C)CCC(=O)O MCULE-4161237740 [0,0,0,0,0,0|2,0,0]=2 12 B8R0.29 CP(=O)(O)CCC(=O)O MCULE-7722406670 [0,0,0,0,0,0|1,0,0]=1 13 B8R0.29 CP(=S)(C)CCC(=O)O MCULE-5422068119 [0,0,0,0,0,0|2,1,0]=3 14 B8R0.29 CS(=O)(=NCC(=O)O)C MCULE-1962520069 [0,0,0,0,0,0|4,0,0]=4 15 B8R0.29 CS(=O)(=O)CCC(=O)O MCULE-6100062469 [0,0,0,0,0,0|2,0,1]=3 16 B8R0.29 CS(=O)(=O)NCC(=O)O MCULE-6239662408 [0,0,0,0,0,0|3,0,1]=4 17 B8R0.29 CS(=O)(=O)OCC(=O)O MCULE-5511249618 [0,0,0,0,0,0|3,0,1]=4 18 B8R0.29 C[Si](C)(C)CCC(=O)O MCULE-7609579135 [0,0,0,0,0,0|4,0,0]=4 19 B8R0.29 NS(=O)(=O)CCC(=O)O MCULE-7062523969 [0,0,0,0,0,0|2,0,1]=3 20 B8R0.29 O=C(O)CCC(Cl)(Cl)Cl MCULE-2127623168 [0,0,0,0,0,0|4,0,0]=4 21 B8R0.29 O=C(O)CCC(F)(F)F MCULE-9968667608 [0,0,0,0,0,0|4,0,0]=4 22 B8R0.29 O=C(O)CCP(=O)(O)O MCULE-5647723204 [0,0,0,0,0,0|0,0,0]=0 23 B8R0.29 O=C(O)CCS(=O)(=O)O MCULE-8973025218 [0,0,0,0,0,0|1,0,1]=2 24 B8R0.29 O=C([O-])CCS(=O)(=O)[O-] MCULE-7929163880 [0,0,0,0,0,0|1,0,3]=4 25 B8R0.29 O=C([O-])CC[Si](O)(O)O MCULE-2020093645 [0,0,0,0,0,0|1,0,2]=3 26 B8R0.29 O=C([O-])CC[Si](O)(O)O MCULE-4188223321 [0,0,0,0,0,0|1,0,2]=3 27 B7R0.6 C=C(Br)CCC(=O)O MCULE-5257916083 [1,0,0,0,0,0|3,0,0]=4 28 B7R0.6 C=C(C)CCC(=O)O MCULE-8738532812 [1,0,0,0,0,0|3,0,0]=4 29 B7R0.6 C=C(Cl)CCC(=O)O MCULE-8617886776 [1,0,0,0,0,0|3,0,0]=4 30 B7R0.6 CC(=O)CCC(=O)C MCULE-3166810473 [1,0,0,0,0,0|3,0,0]=4 31 B7R0.6 CC(=O)CCC(=O)N MCULE-8943258659 [1,0,0,0,0,0|3,0,0]=4 32 B7R0.6 CC(=O)CCC(=O)O MCULE-1392778065 [1,0,0,0,0,0|2,0,0]=3 33 B7R0.6 CC(=O)CCC(=O)[O-] MCULE-4975344808 [1,0,0,0,0,0|2,0,1]=4 34 B7R0.6 CC(=O)CCN(=O)=O MCULE-4726243654 [1,0,0,0,0,0|1,1,1]=4 35 B7R0.6 CC(=O)NCC(=O)O MCULE-5811325186 [1,0,0,0,0,0|3,0,0]=4 36 B7R0.6 CC(=O)OCC(=O)O MCULE-6837320824 [1,0,0,0,0,0|3,0,0]=4 37 B7R0.6 CC(=O)SCC(=O)O MCULE-1974657694 [1,0,0,0,0,0|3,0,0]=4 38 B7R0.6 CC(C)CCC(=O)O MCULE-7691755837 [1,0,0,0,0,0|3,0,0]=4 39 B7R0.6 CC(N)CCC(=O)O MCULE-3711689460 [1,0,0,0,0,0|3,0,0]=4 40 B7R0.6 CC(N)CCC(=O)O MCULE-5008572656 [1,0,0,0,0,0|3,0,0]=4 41 B7R0.6 CC(O)CCC(=O)O MCULE-6352217997 [1,0,0,0,0,0|2,0,0]=3 42 B7R0.6 CC(O)CCC(=O)[O-] MCULE-5872581098 [1,0,0,0,0,0|2,0,1]=4 43 B7R0.6 CC(S)CCC(=O)O MCULE-9612173883 [1,0,0,0,0,0|2,1,0]=4 44 B7R0.6 CN(C)CCC(=O)O MCULE-5553815845 [1,0,0,0,0,0|2,1,0]=4 45 B7R0.6 CN(C)CCC(=O)O MCULE-7454823322 [1,0,0,0,0,0|2,1,0]=4 46 B7R0.6 CS(=O)CCC(=O)O MCULE-8243349779 [1,0,0,0,0,0|2,0,0]=3 47 B7R0.6 C[C@@H](N)CCC(=O)O MCULE-3295260637 [1,0,0,0,0,0|3,0,0]=4 48 B7R0.6 C[C@@H](N)CCC(=O)O MCULE-5409083898 [1,0,0,0,0,0|3,0,0]=4 49 B7R0.6 C[C@@H](N)CCC(=O)O MCULE-6530230723 [1,0,0,0,0,0|3,0,0]=4 50 B7R0.6 C[C@@H](N)CCC(=O)O MCULE-7530095699 [1,0,0,0,0,0|3,0,0]=4 51 B7R0.6 C[C@@H](O)COC(=O)O MCULE-3794886346 [1,0,0,0,0,0|3,0,0]=4 52 B7R0.6 C[C@H](N)CCC(=O)O MCULE-3621527632 [1,0,0,0,0,0|3,0,0]=4 53 B7R0.6 C[C@H](N)CCC(=O)O MCULE-7670557122 [1,0,0,0,0,0|3,0,0]=4 54 B7R0.6 C[S+](C)CCC(=O)O MCULE-8115187503 [1,0,0,0,0,0|3,0,0]=4 55 B7R0.6 C[S+](C)CCC(=O)O MCULE-9668037011 [1,0,0,0,0,0|3,0,0]=4 56 B7R0.6 NC(=O)CCC(=O)N MCULE-2107382817 [1,0,0,0,0,0|3,0,0]=4 57 B7R0.6 NC(=O)CCC(=O)O MCULE-5813999826 [1,0,0,0,0,0|2,0,0]=3 58 B7R0.6 NC(=O)NCC(=O)O MCULE-7640310218 [1,0,0,0,0,0|3,0,0]=4 59 B7R0.6 NC(=O)SCC(=O)O MCULE-2409074226 [1,0,0,0,0,0|3,0,0]=4 60 B7R0.6 O=C(Cl)CCC(=O)Cl MCULE-6220065982 [1,0,0,0,0,0|3,0,0]=4 61 B7R0.6 O=C(O)/C=C/C(=O)O MCULE-3549142744 [1,0,0,0,0,0|1,0,2]=4 62 B7R0.6 O=C(O)/C=C/C(=O)O MCULE-5263906793 [1,0,0,0,0,0|1,0,2]=4 63 B7R0.6 O=C(O)/C=C\C(=O)O MCULE-1113222985 [1,0,0,0,0,0|1,0,2]=4 64 B7R0.6 O=C(O)C#CC(=O)O MCULE-3952041688 [1,0,0,0,0,0|1,0,2]=4 65 B7R0.6 O=C(O)C=CC(=O)O MCULE-5329407890 [1,0,0,0,0,0|1,0,2]=4 66 B7R0.6 O=C(O)C=CC(=O)O MCULE-7492596773 [1,0,0,0,0,0|1,0,2]=4 67 B7R0.6 O=C(O)C=CC(=O)O MCULE-8076793268 [1,0,0,0,0,0|1,0,2]=4 68 B7R0.6 O=C(O)C=CC(=O)O MCULE-9488315563 [1,0,0,0,0,0|1,0,2]=4 69 B7R0.6 O=C(O)C=CC(=O)O MCULE-9920754312 [1,0,0,0,0,0|1,0,2]=4 70 B7R0.6 O=C(O)CCB(O)O MCULE-9351023222 [1,0,0,0,0,0|1,0,0]=2 71 B7R0.6 O=C(O)CCC(=O)O MCULE-1233211613 [1,0,0,0,0,0|1,0,0]=2 72 B7R0.6 O=C(O)CCC(=O)O MCULE-5889111640 [1,0,0,0,0,0|1,0,0]=2 73 B7R0.6 O=C(O)CCC(F)F MCULE-6002651269 [1,0,0,0,0,0|3,0,0]=4 74 B7R0.6 O=C(O)CCN(=O)=O MCULE-1879231817 [1,0,0,0,0,0|0,1,1]=3 75 B7R0.6 O=C(O)N=NC(=O)O MCULE-6858626658 [1,0,0,0,0,0|3,0,0]=4 76 B7R0.6 O=C([O-])CCC(=O)O MCULE-9149947862 [1,0,0,0,0,0|1,0,1]=3 77 B7R0.6 O=C([O-])CCC(=O)[O-] MCULE-6304944077 [1,0,0,0,0,0|1,0,2]=4 78 B7R0.8 CCCCP(=O)(O)O MCULE-8779445551 [1,0,0,0,0,0|1,0,1]=3 79 B7R0.8 CP(=O)(O)CCCN MCULE-1158131505 [1,0,0,0,0,0|2,0,1]=4 80 B7R0.8 CP(=O)(O)CCCN MCULE-8748054523 [1,0,0,0,0,0|2,0,1]=4 81 B7R0.8 CS(=O)(=O)CCC=O MCULE-1821843669 [1,0,0,0,0,0|2,0,1]=4 82 B7R0.8 NCCCP(=O)(O)O MCULE-7175026527 [1,0,0,0,0,0|1,0,1]=3 83 B7R0.8 NCCOP(=O)(O)O MCULE-8775715246 [1,0,0,0,0,0|2,0,1]=4 84 B7R0.8 O=P(O)(O)CCCBr MCULE-8428985634 [1,0,0,0,0,0|1,0,1]=3 85 B7R0.8 O=P(O)(O)CCCCl MCULE-9259107636 [1,0,0,0,0,0|1,0,1]=3 86 B7R0.8 O=S(=O)(O)CCCO MCULE-2005221071 [1,0,0,0,0,0|1,0,2]=4 87 B9R0.10 CC(C)C[C@@H](N)P(=O)(O)O MCULE-4058698477 [0,1,0,0,0,0|2,0,1]=4 88 B9R0.10 CC(CC(=O)O)C(C)(C)O MCULE-5216715591 [0,1,0,0,0,0|3,0,0]=4 89 B9R0.21 COC(=O)CCS(=O)(=O)C MCULE-4450384265 [0,1,0,0,0,0|2,0,1]=4 90 B9R0.21 COC(=O)CCS(=O)(=O)Cl MCULE-9750988258 [0,1,0,0,0,0|2,0,1]=4 91 B9R0.21 COC(=O)CCS(=O)(=O)F MCULE-9045673816 [0,1,0,0,0,0|2,0,1]=4 92 B9R0.21 COC(=O)CCS(=O)(=O)N MCULE-6764009838 [0,1,0,0,0,0|2,0,1]=4 93 B9R0.21 O=C(CO)COP(=O)(O)O MCULE-3352535301 [0,1,0,0,0,0|1,0,0]=2 94 B9R0.21 O=C(CO)COP(=O)([O-])[O-] MCULE-1009530625 [0,1,0,0,0,0|1,0,2]=4 95 B9R0.21 O=CC(O)COP(=O)(O)O MCULE-3089825671 [0,1,0,0,0,0|1,0,1]=3 96 B9R0.21 O=C[C@@H](O)COP(=O)(O)O MCULE-2424291446 [0,1,0,0,0,0|1,0,1]=3 97 B9R0.21 O=P(O)(O)OCC(O)CO MCULE-1053997818 [0,1,0,0,0,0|1,0,2]=4 98 B9R0.21 O=P(O)(O)OC[C@H](O)CO MCULE-1337563082 [0,1,0,0,0,0|1,0,2]=4 99 B9R0.21 O=P(O)(O)OC[C@H](O)CO MCULE-2982304745 [0,1,0,0,0,0|1,0,2]=4 100 B9R0.21 O=P(O)(O)OC[C@H](O)CO MCULE-9577432755 [0,1,0,0,0,0|1,0,2]=4 101 B9R0.57 C=C(OP(=O)(O)O)C(=O)O MCULE-3602390360 [0,1,0,0,0,0|1,0,1]=3 102 B9R0.57 C=C(OP(=O)(O)O)C(=O)O MCULE-8044116150 [0,1,0,0,0,0|1,0,1]=3 103 B9R0.57 C=C(OP(=O)(O)O)C(=O)[O-] MCULE-7660464274 [0,1,0,0,0,0|1,0,2]=4 104 B9R0.57 CC(CS(=O)(=O)C)C(=O)O MCULE-2992876868 [0,1,0,0,0,0|2,0,1]=4 105 B9R0.57 CS(=O)(=O)C[C@H](N)C(=O)O MCULE-1117561111 [0,1,0,0,0,0|2,0,1]=4 106 B9R0.57 CS(=O)(=O)C[C@H](N)C(=O)O MCULE-3044564695 [0,1,0,0,0,0|2,0,1]=4 107 B9R0.57 NC(CP(=O)(O)O)C(=O)O MCULE-3742656954 [0,1,0,0,0,0|0,0,0]=1 108 B9R0.57 NC(CS(=O)(=O)O)C(=O)O MCULE-3360025136 [0,1,0,0,0,0|1,0,1]=3 109 B9R0.57 NC(CS(=O)(=O)O)C(=O)O MCULE-4680118250 [0,1,0,0,0,0|1,0,1]=3 110 B9R0.57 N[C@@H](CP(=O)(O)O)C(=O)O MCULE-6935567843 [0,1,0,0,0,0|0,0,0]=1 111 B9R0.57 N[C@@H](CS(=O)(=O)O)C(=O)O MCULE-1558128725 [0,1,0,0,0,0|1,0,1]=3 112 B9R0.57 N[C@@H](CS(=O)(=O)O)C(=O)O MCULE-6109276112 [0,1,0,0,0,0|1,0,1]=3 113 B9R0.57 O=C(O)C(O)OP(=O)(O)O MCULE-2072428473 [0,1,0,0,0,0|1,0,0]=2 114 B9R0.64 CCS(=O)(=O)CCC(=O)O MCULE-6074163165 [0,1,0,0,0,0|2,0,1]=4 115 B9R0.64 CNS(=O)(=O)CCC(=O)O MCULE-4872511761 [0,1,0,0,0,0|2,0,1]=4 116 B9R0.64 NCP(=O)(O)CCC(=O)O MCULE-8895842344 [0,1,0,0,0,0|1,0,0]=2 117 B9R0.77 O=P(O)(O)CCP(=O)(O)O MCULE-4998633006 [0,1,0,0,0,0|1,0,0]=2 118 B9R0.77 O=S(=O)(O)CCS(=O)(=O)O MCULE-1278358457 [0,1,0,0,0,0|2,0,1]=4 119 B9R1.147 O=C(O)CCC1(CC1)O MCULE-2890628610 [0,0,0,1,0,0|3,0,0]=4 120 B9R1.164 CC1(CC(C1)C(=O)O)O MCULE-2222519984 [0,0,0,1,0,0|3,0,0]=4 121 B9R1.164 C[C@@]1(C[C@@H](C1)C(=O)O)O MCULE-4467958139 [0,0,0,1,0,0|3,0,0]=4 122 B9R1.164 C[C@@]1(C[C@H](C1)C(=O)O)O MCULE-3757447768 [0,0,0,1,0,0|3,0,0]=4 123 B9R1.164 O=C(O)C1CS(=O)(=O)C1 MCULE-7280424141 [0,0,0,1,0,0|2,0,1]=4 124 B7R0.9 CC(=O)OP(=O)(O)O MCULE-3093243474 [0,0,0,0,1,0|2,0,0]=3 125 B7R0.9 CC(C)(O)CC(=O)O MCULE-3649642958 [0,0,0,0,1,0|3,0,0]=4 126 B7R0.9 CC(C)CP(=O)(O)O MCULE-5164389604 [0,0,0,0,1,0|2,0,1]=4 127 B7R0.9 CS(=O)(=O)CC(=O)O MCULE-1982886035 [0,0,0,0,1,0|2,0,1]=4 128 B7R0.9 NC(=O)OP(=O)(O)O MCULE-8071699770 [0,0,0,0,1,0|2,0,0]=3 129 B7R0.9 NS(=O)(=O)CC(=O)O MCULE-1039009855 [0,0,0,0,1,0|2,0,1]=4 130 B7R0.9 O=C(O)CP(=O)(O)O MCULE-7055994360 [0,0,0,0,1,0|0,0,0]=1 131 B7R0.9 O=C(O)CS(=O)(=O)O MCULE-4846153382 [0,0,0,0,1,0|1,0,1]=3 132 B9R0.56 CC(=O)NCCS(=O)(=O)O MCULE-4053951959 [0,0,0,0,0,1|2,0,1]=4 133 B9R0.56 CC(=O)SCCS(=O)(=O)O MCULE-4519705338 [0,0,0,0,0,1|2,0,1]=4 134 B9R0.56 CS(=O)(=O)CCCC(=O)O MCULE-2515518184 [0,0,0,0,0,1|2,0,1]=4 135 B9R0.56 CS(=O)(=O)NCCC(=O)O MCULE-7823027792 [0,0,0,0,0,1|2,0,1]=4 136 B9R0.56 NC(=O)NCCS(=O)(=O)O MCULE-6567400181 [0,0,0,0,0,1|2,0,1]=4 137 B9R0.56 NS(=O)(=O)CCCC(=O)O MCULE-8548216682 [0,0,0,0,0,1|2,0,1]=4 138 B9R0.56 NS(=O)(=O)NCCC(=O)O MCULE-7564527970 [0,0,0,0,0,1|2,0,1]=4 139 B9R0.56 O=C(O)CCCP(=O)(O)O MCULE-9510971866 [0,0,0,0,0,1|0,0,0]=1 140 B9R0.56 O=C(O)CNCP(=O)(O)O MCULE-3308266821 [0,0,0,0,0,1|0,0,0]=1 141 B9R0.56 O=C([O-])CNCP(=O)(O)O MCULE-8648426476 [0,0,0,0,0,1|0,0,1]=2 142 B6R0.4 C#CCCC(=O)O MCULE-6669146060 [2,0,0,0,0,0|2,0,0]=4 143 B6R0.4 C=CCCB(O)O MCULE-9431650735 [2,0,0,0,0,0|2,0,0]=4 144 B6R0.4 C=CCCC(=O)O MCULE-6221951425 [2,0,0,0,0,0|2,0,0]=4 145 B6R0.4 CC(=O)CCC=O MCULE-4767690464 [2,0,0,0,0,0|2,0,0]=4 146 B6R0.4 CC(=O)CCCO MCULE-1335342150 [2,0,0,0,0,0|2,0,0]=4 147 B6R0.4 CCCCC(=O)O MCULE-2333640078 [2,0,0,0,0,0|2,0,0]=4 148 B6R0.4 CNCCC(=O)O MCULE-3627988097 [2,0,0,0,0,0|1,1,0]=4 149 B6R0.4 CNCCC(=O)O MCULE-9858204248 [2,0,0,0,0,0|1,1,0]=4 150 B6R0.4 COCCC(=O)O MCULE-3436347115 [2,0,0,0,0,0|2,0,0]=4 151 B6R0.4 CSCCC(=O)O MCULE-9550032941 [2,0,0,0,0,0|2,0,0]=4 152 B6R0.4 N#CCCC(=O)O MCULE-3165189228 [2,0,0,0,0,0|2,0,0]=4 153 B6R0.4 NC(=O)CCCO MCULE-3779341561 [2,0,0,0,0,0|2,0,0]=4 154 B6R0.4 NCCCC(=O)O MCULE-3615304273 [2,0,0,0,0,0|2,0,0]=4 155 B6R0.4 NCCCC(=O)O MCULE-7613134021 [2,0,0,0,0,0|2,0,0]=4 156 B6R0.4 NOCCC(=O)O MCULE-1529492904 [2,0,0,0,0,0|2,0,0]=4 157 B6R0.4 NOCCC(=O)O MCULE-6297331357 [2,0,0,0,0,0|2,0,0]=4 158 B6R0.4 O=C(O)CCCBr MCULE-5669825022 [2,0,0,0,0,0|2,0,0]=4 159 B6R0.4 O=C(O)CCCCl MCULE-7721427391 [2,0,0,0,0,0|2,0,0]=4 160 B6R0.4 O=C(O)CCCF MCULE-2415675768 [2,0,0,0,0,0|2,0,0]=4 161 B6R0.4 O=C(O)CCCI MCULE-7794841553 [2,0,0,0,0,0|2,0,0]=4 162 B6R0.4 O=C(O)CCCS MCULE-3352840152 [2,0,0,0,0,0|1,1,0]=4 163 B6R0.4 O=C(O)CNCO MCULE-4092998319 [2,0,0,0,0,0|2,0,0]=4 164 B6R0.4 O=CCCC(=O)O MCULE-7183864722 [2,0,0,0,0,0|1,0,0]=3 165 B6R0.4 O=CCCN(=O)=O MCULE-3692892497 [2,0,0,0,0,0|0,1,1]=4 166 B6R0.4 O=CNCC(=O)O MCULE-3251128290 [2,0,0,0,0,0|2,0,0]=4 167 B6R0.5 C/C=C\P(=O)(O)O MCULE-8382984782 [2,0,0,0,0,0|1,0,1]=4 168 B6R0.5 CC=CP(=O)(O)O MCULE-3593796042 [2,0,0,0,0,0|1,0,1]=4 169 B6R0.5 CCCP(=O)(O)O MCULE-3928382731 [2,0,0,0,0,0|0,0,1]=3 170 B6R0.5 CNCP(=O)(O)O MCULE-6684762988 [2,0,0,0,0,0|1,0,1]=4 171 B6R0.5 NCCP(=O)(O)O MCULE-6030069631 [2,0,0,0,0,0|1,0,0]=3 172 B6R0.5 NCCP(=O)(O)O MCULE-7710471805 [2,0,0,0,0,0|1,0,0]=3 173 B6R0.5 O=CCS(=O)(=O)O MCULE-1262210475 [2,0,0,0,0,0|1,0,1]=4 174 B6R0.5 O=P(O)(O)CCBr MCULE-3355549967 [2,0,0,0,0,0|1,0,0]=3 175 B6R0.5 O=P(O)(O)CCCl MCULE-4131416773 [2,0,0,0,0,0|1,0,0]=3 176 B6R0.5 O=P(O)(O)CCO MCULE-9752100956 [2,0,0,0,0,0|0,0,0]=2 177 B6R0.5 O=S(=O)(O)CCO MCULE-8075949368 [2,0,0,0,0,0|1,0,1]=4 178 B8R0.9 CC(=NO)CCC(=O)O MCULE-2481442220 [1,1,0,0,0,0|2,0,0]=4 179 B8R0.9 CCC(=O)CCC(=O)O MCULE-4505750030 [1,1,0,0,0,0|2,0,0]=4 180 B8R0.9 CCC(O)CCC(=O)O MCULE-1512608136 [1,1,0,0,0,0|2,0,0]=4 181 B8R0.9 CCS(=O)CCC(=O)O MCULE-4027618720 [1,1,0,0,0,0|2,0,0]=4 182 B8R0.9 CNC(=O)CCC(=O)O MCULE-8340443315 [1,1,0,0,0,0|2,0,0]=4 183 B8R0.9 COC(=O)CCC(=O)C MCULE-6324755148 [1,1,0,0,0,0|2,0,0]=4 184 B8R0.9 COC(=O)CCC(=O)Cl MCULE-2684320402 [1,1,0,0,0,0|2,0,0]=4 185 B8R0.9 COC(=O)CCC(=O)N MCULE-1154081515 [1,1,0,0,0,0|2,0,0]=4 186 B8R0.9 COC(=O)CCC(=O)O MCULE-4083173324 [1,1,0,0,0,0|1,0,0]=3 187 B8R0.9 COC(=O)CCN(=O)=O MCULE-3836108700 [1,1,0,0,0,0|0,1,1]=4 188 B8R0.9 COC(=O)CCS(=O)O MCULE-4935012562 [1,1,0,0,0,0|1,0,0]=3 189 B8R0.9 COC(=O)CCS(=O)[O-] MCULE-5802411922 [1,1,0,0,0,0|1,0,1]=4 190 B8R0.9 COC(=O)NCC(=O)O MCULE-3693365728 [1,1,0,0,0,0|2,0,0]=4 191 B8R0.9 COC(C)CCC(=O)O MCULE-5873043454 [1,1,0,0,0,0|2,0,0]=4 192 B8R0.9 NCC(=O)CCC(=O)O MCULE-6371115085 [1,1,0,0,0,0|2,0,0]=4 193 B8R0.9 NCC(=O)CCC(=O)O MCULE-8125179397 [1,1,0,0,0,0|2,0,0]=4 194 B8R0.9 NCC(=O)CCC(=O)O MCULE-8676354165 [1,1,0,0,0,0|2,0,0]=4 195 B8R0.9 NNC(=O)CCC(=O)O MCULE-7643180740 [1,1,0,0,0,0|2,0,0]=4 196 B8R0.9 NNC(=O)CCC(=O)O MCULE-9888193887 [1,1,0,0,0,0|2,0,0]=4 197 B8R0.9 N[C@H](CO)CCC(=O)O MCULE-1233079264 [1,1,0,0,0,0|2,0,0]=4 198 B8R0.9 N[C@H](CO)CCC(=O)O MCULE-8091475267 [1,1,0,0,0,0|2,0,0]=4 199 B8R0.9 O=C(O)CCC(=O)CBr MCULE-8373387398 [1,1,0,0,0,0|2,0,0]=4 200 B8R0.9 O=C(O)CCC(=O)NO MCULE-2226202964 [1,1,0,0,0,0|1,0,0]=3 201 B8R0.9 O=C(O)CCP(=O)CO MCULE-3163541128 [1,1,0,0,0,0|0,0,0]=2 202 B8R0.9 O=C(O)COC(=O)CO MCULE-4022202206 [1,1,0,0,0,0|2,0,0]=4 203 B8R0.23 C(N)(CS(=O)C)C(=O)O MCULE-3320985154 [1,1,0,0,0,0|2,0,0]=4 204 B8R0.23 C=C(CC(=O)O)C(=O)O MCULE-5221256796 [1,1,0,0,0,0|1,0,1]=4 205 B8R0.23 CC(=O)C(C)CC(=O)O MCULE-9095166615 [1,1,0,0,0,0|2,0,0]=4 206 B8R0.23 CC(=O)C(N)CC(=O)O MCULE-7043175556 [1,1,0,0,0,0|2,0,0]=4 207 B8R0.23 CC(=O)CC(C)C(=O)O MCULE-4640477792 [1,1,0,0,0,0|2,0,0]=4 208 B8R0.23 CC(=O)CC(N)C(=O)O MCULE-6275652695 [1,1,0,0,0,0|2,0,0]=4 209 B8R0.23 CC(=O)CC(N)C(=O)O MCULE-6690241894 [1,1,0,0,0,0|2,0,0]=4 210 B8R0.23 CC(=O)CC(O)C(=O)O MCULE-4728629069 [1,1,0,0,0,0|2,0,0]=4 211 B8R0.23 CC(CC(=O)N)C(=O)O MCULE-8238400356 [1,1,0,0,0,0|2,0,0]=4 212 B8R0.23 CC(CC(=O)O)C(=O)O MCULE-4824634360 [1,1,0,0,0,0|1,0,0]=3 213 B8R0.23 CC(CC(=O)O)C(=O)O MCULE-8116748590 [1,1,0,0,0,0|1,0,0]=3 214 B8R0.23 CC(CS(=O)C)C(=O)O MCULE-4855592077 [1,1,0,0,0,0|2,0,0]=4 215 B8R0.23 CC(O)C(N)CC(=O)O MCULE-5161755443 [1,1,0,0,0,0|2,0,0]=4 216 B8R0.23 CC(O)C(N)CC(=O)O MCULE-6370326858 [1,1,0,0,0,0|2,0,0]=4 217 B8R0.23 CS(=O)CC(N)C(=O)O MCULE-5699602621 [1,1,0,0,0,0|2,0,0]=4 218 B8R0.23 CS(=O)C[C@@H](N)C(=O)O MCULE-8253087333 [1,1,0,0,0,0|2,0,0]=4 219 B8R0.23 CS(=O)C[C@H](N)C(=O)O MCULE-5080098254 [1,1,0,0,0,0|2,0,0]=4 220 B8R0.23 C[C@@H](CC(=O)O)C(=O)O MCULE-1711994689 [1,1,0,0,0,0|1,0,0]=3 221 B8R0.23 C[C@@H](CC(=O)O)C(=O)O MCULE-6107805812 [1,1,0,0,0,0|1,0,0]=3 222 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-1416044737 [1,1,0,0,0,0|2,0,0]=4 223 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-2990511228 [1,1,0,0,0,0|2,0,0]=4 224 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-3178455647 [1,1,0,0,0,0|2,0,0]=4 225 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-4413833682 [1,1,0,0,0,0|2,0,0]=4 226 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-7332826518 [1,1,0,0,0,0|2,0,0]=4 227 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-7552978009 [1,1,0,0,0,0|2,0,0]=4 228 B8R0.23 C[C@H](CC(=O)O)C(=O)O MCULE-2738295504 [1,1,0,0,0,0|1,0,0]=3 229 B8R0.23 C[C@H](CC(=O)O)C(=O)O MCULE-4544789339 [1,1,0,0,0,0|1,0,0]=3 230 B8R0.23 C[C@H](O)[C@@H](N)CC(=O)O MCULE-8673070329 [1,1,0,0,0,0|2,0,0]=4 231 B8R0.23 C[S@](=O)C[C@@H](N)C(=O)O MCULE-4004385080 [1,1,0,0,0,0|2,0,0]=4 232 B8R0.23 NC(=O)C(N)CC(=O)O MCULE-2277575843 [1,1,0,0,0,0|2,0,0]=4 233 B8R0.23 NC(=O)CC(Br)C(=O)O MCULE-2823539046 [1,1,0,0,0,0|2,0,0]=4 234 B8R0.23 NC(=O)CC(N)C(=O)O MCULE-1395307434 [1,1,0,0,0,0|2,0,0]=4 235 B8R0.23 NC(=O)C[C@@H](N)C(=O)O MCULE-5685974579 [1,1,0,0,0,0|2,0,0]=4 236 B8R0.23 NC(=O)C[C@@H](N)C(=O)O MCULE-6923060287 [1,1,0,0,0,0|2,0,0]=4 237 B8R0.23 NC(=O)C[C@H](N)C(=O)O MCULE-1868046141 [1,1,0,0,0,0|2,0,0]=4 238 B8R0.23 NC(=O)C[C@H](N)C(=O)O MCULE-8248953574 [1,1,0,0,0,0|2,0,0]=4 239 B8R0.23 NC(=O)[C@@H](N)CC(=O)O MCULE-1924512659 [1,1,0,0,0,0|2,0,0]=4 240 B8R0.23 NC(=O)[C@@H](N)CC(=O)O MCULE-5836180326 [1,1,0,0,0,0|2,0,0]=4 241 B8R0.23 NC(=O)[C@@H](N)CC(=O)O MCULE-8799617587 [1,1,0,0,0,0|2,0,0]=4 242 B8R0.23 NC(=O)[C@@H](N)CC(=O)O MCULE-9477928215 [1,1,0,0,0,0|2,0,0]=4 243 B8R0.23 NC(=O)[C@H](N)CC(=O)O MCULE-5316198498 [1,1,0,0,0,0|2,0,0]=4 244 B8R0.23 NC(=O)[C@H](N)CC(=O)O MCULE-9833023193 [1,1,0,0,0,0|2,0,0]=4 245 B8R0.23 NC(CC(=O)O)C(=O)O MCULE-1247865301 [1,1,0,0,0,0|1,0,0]=3 246 B8R0.23 NC(CC(=O)O)C(=O)O MCULE-9328817309 [1,1,0,0,0,0|1,0,0]=3 247 B8R0.23 NC(CC(=O)O)C(=O)[O-] MCULE-5149469296 [1,1,0,0,0,0|1,0,1]=4 248 B8R0.23 NC(CC(=O)O)C(=O)[O-] MCULE-6655576025 [1,1,0,0,0,0|1,0,1]=4 249 B8R0.23 NC(CC(=O)[O-])C(=O)O MCULE-9221777365 [1,1,0,0,0,0|1,0,1]=4 250 B8R0.23 N[C@@H](CC(=O)O)C(=O)O MCULE-3710241722 [1,1,0,0,0,0|1,0,0]=3 251 B8R0.23 N[C@@H](CC(=O)O)C(=O)O MCULE-6700641640 [1,1,0,0,0,0|1,0,0]=3 252 B8R0.23 N[C@@H](CC(=O)O)C(=O)[O-] MCULE-6196524297 [1,1,0,0,0,0|1,0,1]=4 253 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)O MCULE-5793000569 [1,1,0,0,0,0|1,0,1]=4 254 B8R0.23 N[C@@H](CS(=O)O)C(=O)O MCULE-6647925908 [1,1,0,0,0,0|1,0,0]=3 255 B8R0.23 N[C@@H](CS(=O)O)C(=O)O MCULE-7596867929 [1,1,0,0,0,0|1,0,0]=3 256 B8R0.23 N[C@H](CC(=O)O)C(=O)O MCULE-8102700760 [1,1,0,0,0,0|1,0,0]=3 257 B8R0.23 O=C(O)CC(=O)C(=O)O MCULE-6059222019 [1,1,0,0,0,0|1,0,1]=4 258 B8R0.23 O=C(O)CC(Br)C(=O)O MCULE-8178780603 [1,1,0,0,0,0|1,0,0]=3 259 B8R0.23 O=C(O)CC(Cl)C(=O)O MCULE-6357456691 [1,1,0,0,0,0|1,0,0]=3 260 B8R0.23 O=C(O)CC(F)C(=O)O MCULE-8433198001 [1,1,0,0,0,0|1,0,0]=3 261 B8R0.23 O=C(O)CC(O)C(=O)O MCULE-5852208511 [1,1,0,0,0,0|1,0,0]=3 262 B8R0.23 O=C(O)CC(O)C(=O)O MCULE-9713558868 [1,1,0,0,0,0|1,0,0]=3 263 B8R0.23 O=C(O)CC(O)C(=O)O MCULE-9924961830 [1,1,0,0,0,0|1,0,0]=3 264 B8R0.23 O=C(O)CC(S)C(=O)O MCULE-7005300961 [1,1,0,0,0,0|1,0,0]=3 265 B8R0.23 O=C(O)C[C@@H](Br)C(=O)O MCULE-4598056907 [1,1,0,0,0,0|1,0,0]=3 266 B8R0.23 O=C(O)C[C@@H](Br)C(=O)O MCULE-7861798045 [1,1,0,0,0,0|1,0,0]=3 267 B8R0.23 O=C(O)C[C@@H](O)C(=O)O MCULE-2239273084 [1,1,0,0,0,0|1,0,0]=3 268 B8R0.23 O=C(O)C[C@@H](O)C(=O)O MCULE-4984266891 [1,1,0,0,0,0|1,0,0]=3 269 B8R0.23 O=C(O)C[C@H](Br)C(=O)O MCULE-6763472515 [1,1,0,0,0,0|1,0,0]=3 270 B8R0.23 O=C(O)C[C@H](Br)C(=O)O MCULE-7524683930 [1,1,0,0,0,0|1,0,0]=3 271 B8R0.23 O=C(O)C[C@H](F)C(=O)O MCULE-9607625100 [1,1,0,0,0,0|1,0,0]=3 272 B8R0.23 O=C(O)C[C@H](O)C(=O)O MCULE-8339271078 [1,1,0,0,0,0|1,0,0]=3 273 B8R0.23 O=C(O)C[C@H](O)C(=O)O MCULE-8865188741 [1,1,0,0,0,0|1,0,0]=3 274 B8R0.23 O=C(O)C[C@H](O)C(=O)[O-] MCULE-1033530810 [1,1,0,0,0,0|1,0,1]=4 275 B8R0.23 O=C(O)C[C@H](S)C(=O)O MCULE-6393371024 [1,1,0,0,0,0|1,0,0]=3 276 B8R0.23 [C@@H](N)(CC(=O)O)C(=O)O MCULE-7899824165 [1,1,0,0,0,0|1,0,0]=3 277 B8R0.23 [C@H](N)(CS(=O)C)C(=O)O MCULE-5084638505 [1,1,0,0,0,0|2,0,0]=4 278 B8R0.23 [NH3+]C(CS(=O)[O-])C(=O)O MCULE-5293441756 [1,1,0,0,0,0|1,0,1]=4 279 B8R0.21 CCCCOP(=O)(O)O MCULE-7637624598 [1,1,0,0,0,0|1,0,1]=4 280 B8R0.21 N#CCCOP(=O)(O)O MCULE-3863159262 [1,1,0,0,0,0|1,0,1]=4 281 B8R0.21 NCCCCP(=O)(O)O MCULE-2632534074 [1,1,0,0,0,0|1,0,1]=4 282 B8R0.21 O=P(O)(O)CCCCBr MCULE-5686227952 [1,1,0,0,0,0|1,0,1]=4 283 B8R0.24 CN(C=O)CP(=O)(O)O MCULE-5250485746 [1,1,0,0,0,0|1,0,0]=3 284 B8R0.24 O=C(CP(=O)(O)O)NO MCULE-2272923571 [1,1,0,0,0,0|1,0,1]=4 285 B8R0.24 [NH3+]CC(O)CP(=O)(O)O MCULE-1909194599 [1,1,0,0,0,0|1,0,1]=4 286 B8R0.24 [NH3+]CC(O)CP(=O)(O)O MCULE-2988447435 [1,1,0,0,0,0|1,0,1]=4 287 B8R0.25 NCCCP(=O)(O)CO MCULE-2944312169 [1,1,0,0,0,0|1,0,1]=4 288 B8R0.27 CC(C(=O)O)P(=O)(O)O MCULE-8565461015 [0,1,0,0,1,0|0,0,0]=2 289 B8R0.27 CP(=O)(C)C(O)C(=O)O MCULE-6921301874 [0,1,0,0,1,0|2,0,0]=4 290 B8R0.27 O=C(O)C(Cl)P(=O)(O)O MCULE-8492715834 [0,1,0,0,1,0|0,0,0]=2 291 B8R0.27 O=C(O)C(O)P(=O)(O)O MCULE-5564177953 [0,1,0,0,1,0|0,0,0]=2 292 B8R0.33 O=P(O)(O)CP(=O)(O)O MCULE-3698902523 [0,1,0,0,1,0|1,0,0]=3 293 B8R0.33 O=P(O)(O)OP(=O)(O)Cl MCULE-1736654180 [0,1,0,0,1,0|2,0,0]=4 294 B8R0.33 O=P(O)(O)OP(=O)(O)O MCULE-7221126244 [0,1,0,0,1,0|2,0,0]=4 295 B8R0.34 O=C(O)CP(=O)(O)OO MCULE-4846368706 [0,1,0,0,1,0|0,0,0]=2 296 B8R0.34 O=C([O-])CP(=O)([O-])CO MCULE-3115316649 [0,1,0,0,1,0|0,0,2]=4 297 B8R0.34 O=C([O-])CP(=O)([O-])CO MCULE-8841838500 [0,1,0,0,1,0|0,0,2]=4 298 B10R0.12 O=C(O)CCC(=O)P(=O)(O)O MCULE-3743459791 [0,1,0,0,0,1|0,0,0]=2 299 B10R0.31 NC(=CC(=O)O)CP(=O)(O)O MCULE-1305156195 [0,1,0,0,0,1|0,0,1]=3 300 B10R0.31 NC(=O)NC(=O)CP(=O)(O)O MCULE-3971513778 [0,1,0,0,0,1|1,0,1]=4 301 B10R0.31 NC(=O)NC(=O)CP(=O)(O)O MCULE-7873324486 [0,1,0,0,0,1|1,0,1]=4 302 B10R0.60 COC(=O)CCCP(=O)(O)O MCULE-1591689771 [0,1,0,0,0,1|0,0,0]=2 303 B10R0.60 COC(=O)CNCP(=O)(O)O MCULE-3846537792 [0,1,0,0,0,1|0,0,0]=2 304 B10R0.60 O=CN(O)CCCP(=O)(O)O MCULE-2546868747 [0,1,0,0,0,1|1,0,0]=3 305 B10R0.60 O=CN(O)CCCP(=O)([O-])O MCULE-1343930312 [0,1,0,0,0,1|1,0,1]=4 306 B10R0.92 CP(=O)(O)CCC(=O)C(=O)O MCULE-1980572351 [0,1,0,0,0,1|1,0,0]=3 307 B10R0.92 CP(=O)(O)CCC(N)C(=O)O MCULE-1038057082 [0,1,0,0,0,1|1,0,0]=3 308 B10R0.92 CP(=O)(O)CCC(N)C(=O)O MCULE-7761179555 [0,1,0,0,0,1|1,0,0]=3 309 B10R0.92 NC(CCP(=O)(O)O)C(=O)O MCULE-2756478197 [0,1,0,0,0,1|0,0,0]=2 310 B10R0.92 NC(CCS(=O)(=O)O)C(=O)O MCULE-7377602601 [0,1,0,0,0,1|1,0,1]=4 311 B10R0.92 NC(COP(=O)(O)O)C(=O)O MCULE-1695816394 [0,1,0,0,0,1|0,0,0]=2 312 B10R0.92 NC(COS(=O)(=O)O)C(=O)O MCULE-5049646882 [0,1,0,0,0,1|1,0,1]=4 313 B10R0.92 N[C@@H](CCP(=O)(O)O)C(=O)O MCULE-3863533502 [0,1,0,0,0,1|0,0,0]=2 314 B10R0.92 N[C@@H](CCP(=O)(O)O)C(=O)O MCULE-3988880216 [0,1,0,0,0,1|0,0,0]=2 315 B10R0.92 N[C@@H](CCS(=O)(=O)O)C(=O)O MCULE-8204260402 [0,1,0,0,0,1|1,0,1]=4 316 B10R0.92 N[C@@H](COP(=O)(O)O)C(=O)O MCULE-3199737084 [0,1,0,0,0,1|0,0,0]=2 317 B10R0.92 N[C@@H](COP(=O)(O)O)C(=O)O MCULE-4907212979 [0,1,0,0,0,1|0,0,0]=2 318 B10R0.92 N[C@@H](COS(=O)(=O)O)C(=O)O MCULE-3746813647 [0,1,0,0,0,1|1,0,1]=4 319 B10R0.92 N[C@@H](COS(=O)(=O)O)C(=O)O MCULE-9474608832 [0,1,0,0,0,1|1,0,1]=4 320 B10R0.92 N[C@@H](CSS(=O)(=O)O)C(=O)O MCULE-5127296011 [0,1,0,0,0,1|1,0,1]=4 321 B10R0.92 N[C@H](CCP(=O)(O)O)C(=O)O MCULE-4319868114 [0,1,0,0,0,1|0,0,0]=2 322 B10R0.92 N[C@H](CCP(=O)([O-])O)C(=O)O MCULE-5292220353 [0,1,0,0,0,1|0,0,1]=3 323 B10R0.92 N[C@H](COP(=O)(O)O)C(=O)O MCULE-4002733556 [0,1,0,0,0,1|0,0,0]=2 324 B10R0.92 N[C@H](COP(=O)(O)O)C(=O)O MCULE-5554704102 [0,1,0,0,0,1|0,0,0]=2 325 B10R0.92 O=C(O)C(=O)COP(=O)(O)O MCULE-6558415212 [0,1,0,0,0,1|0,0,1]=3 326 B10R0.92 O=C(O)C(O)COP(=O)(O)O MCULE-4022388447 [0,1,0,0,0,1|0,0,0]=2 327 B10R0.92 O=C(O)C(O)COP(=O)([O-])[O-] MCULE-4186908433 [0,1,0,0,0,1|0,0,2]=4 328 B10R0.92 O=C([O-])C(O)COP(=O)(O)O MCULE-5885787577 [0,1,0,0,0,1|0,0,1]=3 329 B10R0.92 O=C([O-])C(O)COP(=O)([O-])O MCULE-6234171535 [0,1,0,0,0,1|0,0,2]=4 330 B10R0.92 O=C([O-])[C@H](O)COP(=O)([O-])O MCULE-3595347032 [0,1,0,0,0,1|0,0,2]=4 331 B10R0.92 O=C([O-])[C@H](O)COP(=O)([O-])O MCULE-8994292484 [0,1,0,0,0,1|0,0,2]=4 332 B10R0.92 [C@H](N)(CSS(=O)(=O)O)C(=O)O MCULE-9668444815 [0,1,0,0,0,1|1,0,1]=4 333 B10R0.113 O=P(O)(O)CCCP(=O)(O)O MCULE-6593590984 [0,1,0,0,0,1|1,0,0]=3 334 B10R0.113 O=P(O)(O)CNCP(=O)(O)O MCULE-9667516901 [0,1,0,0,0,1|1,0,0]=3 335 B10R0.114 O=P(O)(O)CC(O)P(=O)(O)O MCULE-9975303224 [0,2,0,0,0,0|1,0,0]=3 336 B10R0.109 CCOC(=O)CCS(=O)(=O)O MCULE-7845227975 [0,2,0,0,0,0|1,0,1]=4 337 B10R0.109 CCOC(=O)CCS(=O)(=O)O MCULE-9842660255 [0,2,0,0,0,0|1,0,1]=4 338 B10R0.95 O=C(O)C(CO)OP(=O)(O)O MCULE-7283219699 [0,2,0,0,0,0|1,0,0]=3 339 B10R0.105 CCOP(=O)(C)CCC(=O)C MCULE-7229030956 [0,2,0,0,0,0|2,0,0]=4 340 B10R0.105 O=C(O)CCS(=O)(=O)CCO MCULE-1223279473 [0,2,0,0,0,0|1,0,1]=4 341 B8R1.3 O=C1CCC(=O)OC1 MCULE-5478039984 [1,0,0,1,0,0|2,0,0]=4 342 B8R1.3 O=C1CCC(CO1)O MCULE-6372408261 [1,0,0,1,0,0|2,0,0]=4 343 B8R1.23 C1(CC(=O)N1)C(=O)O MCULE-3416083471 [1,0,0,1,0,0|2,0,0]=4 344 B8R1.23 O=C(O)C1CC(C1)O MCULE-4341192467 [1,0,0,1,0,0|2,0,0]=4 345 B8R1.23 O=C(O)[C@H]1C[C@@H](C1)O MCULE-9908072079 [1,0,0,1,0,0|2,0,0]=4 346 B8R1.23 O=C(O)[C@H]1C[C@H](C1)O MCULE-5181925767 [1,0,0,1,0,0|2,0,0]=4 347 B8R1.23 O=C1CC(C1)C(=O)O MCULE-8672788982 [1,0,0,1,0,0|2,0,0]=4 348 B8R1.23 O=C1CC(N1)C(=O)O MCULE-3167823583 [1,0,0,1,0,0|2,0,0]=4 349 B8R1.23 O=C1CC(O1)C(=O)O MCULE-1791104685 [1,0,0,1,0,0|1,0,0]=3 350 B8R1.23 O=C1C[C@@H](N1)C(=O)O MCULE-2118093307 [1,0,0,1,0,0|2,0,0]=4 351 B8R1.23 O=C1C[C@@H](N1)C(=O)O MCULE-7784171286 [1,0,0,1,0,0|2,0,0]=4 352 B8R1.23 O=C1C[C@H](N1)C(=O)O MCULE-1255798587 [1,0,0,1,0,0|2,0,0]=4 353 B8R1.23 O=C1C[C@H](N1)C(=O)O MCULE-6947698869 [1,0,0,1,0,0|2,0,0]=4 354 B8R1.35 O=C(O)CCC1CO1 MCULE-1859826371 [1,0,0,1,0,0|2,0,0]=4 355 B8R1.51 CP1(=O)CCC(=O)O1 MCULE-3689691243 [1,0,0,1,0,0|1,0,0]=3 356 B8R1.51 O=C1CCS(=O)(=O)O1 MCULE-1696670151 [1,0,0,1,0,0|1,0,1]=4 357 B10R1.307 O=P1(CCCP(=O)(C1)O)O MCULE-1671228402 [0,0,0,1,0,1|2,0,0]=4 358 B6R0.2 CC(=O)CC(=O)O MCULE-2601276539 [1,0,0,0,1,0|2,0,0]=4 359 B6R0.2 CC(O)CC(=O)O MCULE-3566732882 [1,0,0,0,1,0|2,0,0]=4 360 B6R0.2 CC(O)CC(=O)O MCULE-6537877725 [1,0,0,0,1,0|2,0,0]=4 361 B6R0.2 C[C@@H](O)CC(=O)O MCULE-2545577683 [1,0,0,0,1,0|2,0,0]=4 362 B6R0.2 C[C@@H](O)CC(=O)O MCULE-4159227891 [1,0,0,0,1,0|2,0,0]=4 363 B6R0.2 C[C@H](O)CC(=O)O MCULE-2857686566 [1,0,0,0,1,0|2,0,0]=4 364 B6R0.2 C[C@H](O)CC(=O)O MCULE-3362266278 [1,0,0,0,1,0|2,0,0]=4 365 B6R0.2 NC(=O)CC(=O)O MCULE-1168254626 [1,0,0,0,1,0|2,0,0]=4 366 B6R0.2 O=C(O)CB(O)O MCULE-6408403753 [1,0,0,0,1,0|1,0,0]=3 367 B6R0.2 O=C(O)CC(=O)O MCULE-5893043131 [1,0,0,0,1,0|1,0,0]=3 368 B6R0.2 O=C(O)CN(=O)=O MCULE-4962751453 [1,0,0,0,1,0|0,1,1]=4 369 B6R0.7 C=C(C)P(=O)(O)O MCULE-4023318169 [0,0,0,0,2,0|2,0,0]=4 370 B6R0.7 O=C(O)P(=O)(O)O MCULE-6294437098 [0,0,0,0,2,0|0,0,0]=2 371 B8R0.28 CC(=O)CCCC(=O)O MCULE-2498129200 [1,0,0,0,0,1|2,0,0]=4 372 B8R0.28 CC(=O)NCCC(=O)O MCULE-8867286578 [1,0,0,0,0,1|2,0,0]=4 373 B8R0.28 CC(=O)OCCC(=O)O MCULE-6617841906 [1,0,0,0,0,1|2,0,0]=4 374 B8R0.28 CC(=O)SCCC(=O)O MCULE-2263963171 [1,0,0,0,0,1|2,0,0]=4 375 B8R0.28 CC(O)CCCC(=O)O MCULE-6696855762 [1,0,0,0,0,1|2,0,0]=4 376 B8R0.28 NC(=O)CCCC(=O)O MCULE-9714346244 [1,0,0,0,0,1|2,0,0]=4 377 B8R0.28 NC(=O)CNCC(=O)O MCULE-2816922286 [1,0,0,0,0,1|2,0,0]=4 378 B8R0.28 NC(=O)COCC(=O)O MCULE-3868584388 [1,0,0,0,0,1|2,0,0]=4 379 B8R0.28 NC(=O)CSCC(=O)O MCULE-1419621262 [1,0,0,0,0,1|2,0,0]=4 380 B8R0.28 NC(=O)NCCC(=O)O MCULE-3799706782 [1,0,0,0,0,1|2,0,0]=4 381 B8R0.28 O=C(O)/C=C/CC(=O)O MCULE-3754065542 [1,0,0,0,0,1|1,0,1]=4 382 B8R0.28 O=C(O)C=CCC(=O)O MCULE-2034660220 [1,0,0,0,0,1|1,0,1]=4 383 B8R0.28 O=C(O)CCCC(=O)O MCULE-4286022994 [1,0,0,0,0,1|1,0,0]=3 384 B8R0.28 O=C(O)CCCN(=O)=O MCULE-2601801792 [1,0,0,0,0,1|0,1,1]=4 385 B8R0.28 O=C(O)CNCC(=O)O MCULE-4131542591 [1,0,0,0,0,1|1,0,0]=3 386 B8R0.28 O=C(O)COCC(=O)O MCULE-5687758679 [1,0,0,0,0,1|1,0,0]=3 387 B8R0.28 O=C(O)CSCC(=O)O MCULE-8112166808 [1,0,0,0,0,1|1,0,0]=3 388 B8R0.28 O=C([O-])COCC(=O)O MCULE-3773620396 [1,0,0,0,0,1|1,0,1]=4 389 B8R0.28 O=C([O-])COCC(=O)O MCULE-5768077440 [1,0,0,0,0,1|1,0,1]=4 390 B10R0.15 O=C(O)CCCCP(=O)(O)O MCULE-9230270330 [0,0,0,0,0,2|0,0,0]=2