0 B14R0.337 C#CC(O)CCCCCCCCCCC MCULE-1894988558 [0,0,0,0,0,0|1,0,3]=4 1 B14R0.337 C#CCCCCCCCCCC(=O)OC MCULE-2600718880 [0,0,0,0,0,0|0,0,2]=2 2 B14R0.337 C=CC(=O)OCCCCCCCCCC MCULE-3709831969 [0,0,0,0,0,0|2,0,1]=3 3 B14R0.337 C=CCCCCCCCCCC(=O)OC MCULE-1906791288 [0,0,0,0,0,0|0,0,2]=2 4 B14R0.337 CCCCCC=CCCC=CC(=O)OC MCULE-5740536964 [0,0,0,0,0,0|0,0,4]=4 5 B14R0.337 CCCCCCCCCCCC(=N)OC MCULE-5898572032 [0,0,0,0,0,0|1,0,0]=1 6 B14R0.337 CCCCCCCCCCCC(=N)OC MCULE-8778239925 [0,0,0,0,0,0|1,0,0]=1 7 B14R0.337 CCCCCCCCCCCC(=O)CC MCULE-2582968261 [0,0,0,0,0,0|1,0,0]=1 8 B14R0.337 CCCCCCCCCCCC(=O)NC MCULE-2342575514 [0,0,0,0,0,0|1,0,0]=1 9 B14R0.337 CCCCCCCCCCCC(=O)NN MCULE-7169996147 [0,0,0,0,0,0|2,0,0]=2 10 B14R0.337 CCCCCCCCCCCC(=O)OC MCULE-5588995078 [0,0,0,0,0,0|0,0,0]=0 11 B14R0.337 CCCCCCCCCCCC(Cl)CCl MCULE-9094665356 [0,0,0,0,0,0|3,0,1]=4 12 B14R0.337 CCCCCCCCCCCC([NH3+])CO MCULE-2365829470 [0,0,0,0,0,0|3,0,1]=4 13 B14R0.337 CCCCCCCCCCCC([NH3+])CO MCULE-3278971603 [0,0,0,0,0,0|3,0,1]=4 14 B14R0.337 CCCCCCCCCCCN(C)CC MCULE-3111741726 [0,0,0,0,0,0|3,0,0]=3 15 B14R0.337 CCCCCCCCCCNC(=O)CBr MCULE-9700566039 [0,0,0,0,0,0|3,0,0]=3 16 B14R0.337 CCCCCCCCCCNC(=O)CCl MCULE-9148882207 [0,0,0,0,0,0|3,0,0]=3 17 B14R0.337 CCCCCCCCCCNC(=S)NN MCULE-3954684394 [0,0,0,0,0,0|3,1,0]=4 18 B14R0.337 CCCCCCCCCCOC(=O)CC MCULE-5080633291 [0,0,0,0,0,0|2,0,0]=2 19 B14R0.337 CCCCCCCCCCOC(=O)CCl MCULE-7984482986 [0,0,0,0,0,0|3,0,0]=3 20 B14R0.337 CCCCCCCCCCOC(=O)CN MCULE-5542693903 [0,0,0,0,0,0|3,0,0]=3 21 B14R0.337 CCCCCCCCNCCC(=O)OC MCULE-3052571159 [0,0,0,0,0,0|1,0,0]=1 22 B14R0.337 COC(=O)CCCCCCCCCCBr MCULE-8632429257 [0,0,0,0,0,0|1,0,0]=1 23 B14R0.337 COC(=O)CCCCCCCCCCCl MCULE-4470603458 [0,0,0,0,0,0|1,0,0]=1 24 B14R0.337 COC(=O)CCCCCCCCCCI MCULE-2171087302 [0,0,0,0,0,0|1,0,0]=1 25 B14R0.337 COC(=O)CCCCCCCCCCN MCULE-5833366967 [0,0,0,0,0,0|1,0,0]=1 26 B14R0.337 COC(=O)CCCCCCCCCCN MCULE-9980770025 [0,0,0,0,0,0|1,0,0]=1 27 B13R0.54 C#CCCCCCCCCCC(=O)O MCULE-3493346393 [1,0,0,0,0,0|0,0,2]=3 28 B13R0.54 C(=CCCCCOC(=O)C)CCCC MCULE-1642216097 [1,0,0,0,0,0|1,0,2]=4 29 B13R0.54 C=C(C)CCCCCCCCCCC MCULE-6486590493 [1,0,0,0,0,0|1,0,0]=2 30 B13R0.54 C=CCCCCCCCCCC(=C)C MCULE-9813642699 [1,0,0,0,0,0|1,0,2]=4 31 B13R0.54 C=CCCCCCCCCCC(=O)C MCULE-5730123957 [1,0,0,0,0,0|0,0,2]=3 32 B13R0.54 C=CCCCCCCCCCC(=O)O MCULE-6330367894 [1,0,0,0,0,0|0,0,2]=3 33 B13R0.54 C=CCCCCCCCCOC(=O)C MCULE-3987813819 [1,0,0,0,0,0|1,0,2]=4 34 B13R0.54 CC(C)CCCCCCCCCCO MCULE-3770739954 [1,0,0,0,0,0|2,0,1]=4 35 B13R0.54 CCCC/C=C\CCCCOC(=O)C MCULE-9938541488 [1,0,0,0,0,0|1,0,2]=4 36 B13R0.54 CCCCCC/C=C\CCCC(=O)O MCULE-9454929405 [1,0,0,0,0,0|0,0,2]=3 37 B13R0.54 CCCCCCC=CCCCC(=O)O MCULE-1299148519 [1,0,0,0,0,0|0,0,2]=3 38 B13R0.54 CCCCCCCC=CCOC(=O)C MCULE-7547263092 [1,0,0,0,0,0|1,0,2]=4 39 B13R0.54 CCCCCCCCC/C=C/C(=O)O MCULE-8068052432 [1,0,0,0,0,0|0,0,2]=3 40 B13R0.54 CCCCCCCCCC=CC(=O)O MCULE-5397880976 [1,0,0,0,0,0|0,0,2]=3 41 B13R0.54 CCCCCCCCCCCC(=N)N MCULE-2355708247 [1,0,0,0,0,0|2,0,0]=3 42 B13R0.54 CCCCCCCCCCCC(=O)C MCULE-9311016763 [1,0,0,0,0,0|0,0,0]=1 43 B13R0.54 CCCCCCCCCCCC(=O)Cl MCULE-9866142193 [1,0,0,0,0,0|1,0,0]=2 44 B13R0.54 CCCCCCCCCCCC(=O)N MCULE-2324074583 [1,0,0,0,0,0|1,0,0]=2 45 B13R0.54 CCCCCCCCCCCC(=O)O MCULE-2795129925 [1,0,0,0,0,0|0,0,0]=1 46 B13R0.54 CCCCCCCCCCCC(=O)[O-] MCULE-4306276668 [1,0,0,0,0,0|0,0,1]=2 47 B13R0.54 CCCCCCCCCCCC(=O)[O-] MCULE-5989799433 [1,0,0,0,0,0|0,0,1]=2 48 B13R0.54 CCCCCCCCCCCC(=O)[O-] MCULE-7873290711 [1,0,0,0,0,0|0,0,1]=2 49 B13R0.54 CCCCCCCCCCCC(=O)[O-] MCULE-8752609733 [1,0,0,0,0,0|0,0,1]=2 50 B13R0.54 CCCCCCCCCCCC(C)N MCULE-3980418920 [1,0,0,0,0,0|1,0,1]=3 51 B13R0.54 CCCCCCCCCCCC(C)O MCULE-3181779723 [1,0,0,0,0,0|0,0,2]=3 52 B13R0.54 CCCCCCCCCCCN(=O)=O MCULE-4760203332 [1,0,0,0,0,0|1,0,1]=3 53 B13R0.54 CCCCCCCCCCCN(C)C MCULE-5478138058 [1,0,0,0,0,0|2,0,0]=3 54 B13R0.54 CCCCCCCCCCNC(=O)N MCULE-8422314743 [1,0,0,0,0,0|2,0,0]=3 55 B13R0.54 CCCCCCCCCCNC(=S)N MCULE-1226316897 [1,0,0,0,0,0|2,1,0]=4 56 B13R0.54 CCCCCCCCCCOC(=O)C MCULE-7452399897 [1,0,0,0,0,0|1,0,0]=2 57 B13R0.54 CCCCCCCCCCOC(=O)Cl MCULE-8601514194 [1,0,0,0,0,0|2,0,0]=3 58 B13R0.54 CCCCCCCCCCOC(=S)[S-] MCULE-8121799109 [1,0,0,0,0,0|1,2,0]=4 59 B13R0.54 CCCCCCCCCCOC(=S)[S-] MCULE-8750716716 [1,0,0,0,0,0|1,2,0]=4 60 B13R0.54 CCCCCCCCOCCC(=O)O MCULE-1079344518 [1,0,0,0,0,0|1,0,0]=2 61 B13R0.54 CCCCCCCCSCCC(=O)N MCULE-3514095129 [1,0,0,0,0,0|2,0,0]=3 62 B13R0.54 CCCCCCCCSCCC(=O)O MCULE-4405987007 [1,0,0,0,0,0|1,0,0]=2 63 B13R0.54 CCCCCCCCSCCC(=O)[O-] MCULE-2242790491 [1,0,0,0,0,0|1,0,1]=3 64 B13R0.54 CCCCCNCCCCCC(=O)O MCULE-7344928222 [1,0,0,0,0,0|1,0,0]=2 65 B13R0.54 CCCCOCCOCCOC(=O)C MCULE-7207932009 [1,0,0,0,0,0|3,0,0]=4 66 B13R0.54 CCCCSCCCCCCC(=O)O MCULE-8131072528 [1,0,0,0,0,0|1,0,0]=2 67 B13R0.54 COCCOCCOCCCC(=O)O MCULE-5833620933 [1,0,0,0,0,0|3,0,0]=4 68 B13R0.54 N#N=NCCCCCCCCC(=O)O MCULE-9217828089 [1,0,0,0,0,0|3,0,0]=4 69 B13R0.54 NC(=O)CCCCCCCCCCBr MCULE-6636357331 [1,0,0,0,0,0|2,0,0]=3 70 B13R0.54 NCCCCCCCCCCC(=O)O MCULE-1751028538 [1,0,0,0,0,0|1,0,0]=2 71 B13R0.54 NCCCCCCCCCCC(=O)[O-] MCULE-8171823933 [1,0,0,0,0,0|1,0,1]=3 72 B13R0.54 O=C(Cl)CCCCCCCCCCBr MCULE-9607447068 [1,0,0,0,0,0|2,0,0]=3 73 B13R0.54 O=C(O)CCCCCCC/C=C/CO MCULE-9542952039 [1,0,0,0,0,0|1,0,2]=4 74 B13R0.54 O=C(O)CCCCCCCCC#CBr MCULE-4630465471 [1,0,0,0,0,0|1,0,2]=4 75 B13R0.54 O=C(O)CCCCCCCCCCBr MCULE-9911407009 [1,0,0,0,0,0|1,0,0]=2 76 B13R0.54 O=C(O)CCCCCCCCCCCl MCULE-7412307649 [1,0,0,0,0,0|1,0,0]=2 77 B13R0.54 O=C(O)CCCCCCCCCCO MCULE-8232897652 [1,0,0,0,0,0|1,0,0]=2 78 B13R0.54 O=C(O)CCCCCCCCCCS MCULE-9528951895 [1,0,0,0,0,0|1,0,0]=2 79 B13R0.54 O=C(O)CCCCCCCCCOO MCULE-9572784167 [1,0,0,0,0,0|2,0,0]=3 80 B13R0.54 O=N(=O)CCCCCCCCCCBr MCULE-8717758522 [1,0,0,0,0,0|2,0,1]=4 81 B13R0.54 O=N(=O)CCCCCCCCCCO MCULE-1367838470 [1,0,0,0,0,0|2,0,1]=4 82 B13R0.147 C#CCCCCCCCCC(=O)OC MCULE-3643245325 [1,0,0,0,0,0|0,0,2]=3 83 B13R0.147 C=CC(=O)OCCCCCCCCC MCULE-7661811427 [1,0,0,0,0,0|2,0,1]=4 84 B13R0.147 C=CCCCCCCCCC(=O)OC MCULE-5551120975 [1,0,0,0,0,0|0,0,2]=3 85 B13R0.147 CCCCCCC/C=C/CC(=O)CC MCULE-1079348180 [1,0,0,0,0,0|1,0,2]=4 86 B13R0.147 CCCCCCCCC#CC(=O)OC MCULE-6573014150 [1,0,0,0,0,0|0,0,2]=3 87 B13R0.147 CCCCCCCCCCC(=N)NO MCULE-8351830126 [1,0,0,0,0,0|3,0,0]=4 88 B13R0.147 CCCCCCCCCCC(=O)NN MCULE-5566881162 [1,0,0,0,0,0|2,0,0]=3 89 B13R0.147 CCCCCCCCCCC(=O)OC MCULE-4524637821 [1,0,0,0,0,0|0,0,0]=1 90 B13R0.147 CCCCCCCCCNC(=O)CCl MCULE-5058546046 [1,0,0,0,0,0|3,0,0]=4 91 B13R0.147 CCCCCCCNCCC(=O)NC MCULE-6698644143 [1,0,0,0,0,0|2,0,0]=3 92 B13R0.147 CCCCCCCNCCC(=O)NN MCULE-6182063140 [1,0,0,0,0,0|3,0,0]=4 93 B13R0.147 CCCCCCCNCCC(=O)OC MCULE-4012206227 [1,0,0,0,0,0|1,0,0]=2 94 B13R0.147 COC(=O)CCCCCCCCC=O MCULE-9755822433 [1,0,0,0,0,0|1,0,1]=3 95 B13R0.147 COC(=O)CCCCCCCCCBr MCULE-4125973468 [1,0,0,0,0,0|1,0,0]=2 96 B13R0.147 COC(=O)CCCCCCCCCN MCULE-2996113147 [1,0,0,0,0,0|1,0,0]=2 97 B13R0.147 COC(=O)CCCCCCCCCN MCULE-5692626711 [1,0,0,0,0,0|1,0,0]=2 98 B13R0.147 COC(=O)CCCCCCCCCO MCULE-2254055588 [1,0,0,0,0,0|1,0,0]=2 99 B13R0.336 C#CCCCCCCCCCCCC MCULE-4146985591 [1,0,0,0,0,0|1,0,2]=4 100 B13R0.336 C=CCCCCCCCCCCCC MCULE-5148675782 [1,0,0,0,0,0|1,0,2]=4 101 B13R0.336 CCCCCCCCCCC=CC#N MCULE-5311798650 [1,0,0,0,0,0|2,0,1]=4 102 B13R0.336 CCCCCCCCCCC=CCO MCULE-7248316175 [1,0,0,0,0,0|2,0,1]=4 103 B13R0.336 CCCCCCCCCCCCC#N MCULE-2240447839 [1,0,0,0,0,0|2,0,1]=4 104 B13R0.336 CCCCCCCCCCCCC=O MCULE-6267230462 [1,0,0,0,0,0|2,0,1]=4 105 B13R0.336 CCCCCCCCCCCCCBr MCULE-4920949706 [1,0,0,0,0,0|2,0,1]=4 106 B13R0.336 CCCCCCCCCCCCCC MCULE-7442374993 [1,0,0,0,0,0|1,0,1]=3 107 B13R0.336 CCCCCCCCCCCCCCl MCULE-5597677663 [1,0,0,0,0,0|2,0,1]=4 108 B13R0.336 CCCCCCCCCCCCCI MCULE-8848884635 [1,0,0,0,0,0|2,0,1]=4 109 B13R0.336 CCCCCCCCCCCCCN MCULE-1771591728 [1,0,0,0,0,0|2,0,1]=4 110 B13R0.336 CCCCCCCCCCCCCO MCULE-4385103550 [1,0,0,0,0,0|2,0,1]=4 111 B13R0.336 CCCCCCCCCCCCNC MCULE-6157278006 [1,0,0,0,0,0|1,0,1]=3 112 B13R0.336 CCCCCCCCCCCCON MCULE-8050164267 [1,0,0,0,0,0|1,0,1]=3 113 B13R0.336 CCCCCCCCCCCCSC MCULE-8837710331 [1,0,0,0,0,0|0,1,1]=3 114 B13R0.336 CCCCCCCCCCCSCC MCULE-7247079771 [1,0,0,0,0,0|2,0,0]=3 115 B13R0.336 CCCCCCCCCCNCCC MCULE-5779059384 [1,0,0,0,0,0|2,0,1]=4 116 B13R0.336 CCCCCCCCC[NH2+]CCCC MCULE-3004462204 [1,0,0,0,0,0|2,0,1]=4 117 B13R0.336 CCCCCCCCC[NH2+]CCCC MCULE-3338948197 [1,0,0,0,0,0|2,0,1]=4 118 B13R0.336 CCCCCCCCNCCOCC MCULE-6476025295 [1,0,0,0,0,0|3,0,0]=4 119 B13R0.336 CCCCCCCC[NH2+]CCOCC MCULE-4163142812 [1,0,0,0,0,0|3,0,0]=4 120 B13R0.336 CCCCCCCNCCCNCC MCULE-4051699159 [1,0,0,0,0,0|3,0,0]=4 121 B15R0.81 CCCCCCCCCCCCC(=O)OC MCULE-6268749120 [0,1,0,0,0,0|0,0,0]=1 122 B15R0.81 COC(=O)CCCCCCCCCCC#N MCULE-3424341580 [0,1,0,0,0,0|0,0,1]=2 123 B15R0.81 COC(=O)CCCCCCCCCCCBr MCULE-7032517210 [0,1,0,0,0,0|0,0,0]=1 124 B15R0.81 COC(=O)CCCCCCCCCCCN MCULE-2097053515 [0,1,0,0,0,0|0,0,0]=1 125 B15R0.81 COC(=O)CCCCCCCCCCCN MCULE-6460421950 [0,1,0,0,0,0|0,0,0]=1 126 B15R0.81 COC(=O)CCOCCOCCOCCO MCULE-9203137549 [0,1,0,0,0,0|3,0,0]=4 127 B15R0.84 CCCCCCCCCCCC(=O)N(C)C MCULE-4021126089 [0,1,0,0,0,0|1,0,0]=2 128 B15R0.84 CCCCCCCCCCSC(=S)N(C)C MCULE-1899156333 [0,1,0,0,0,0|2,1,0]=4 129 B15R0.172 CCC(C)CCCCCCCCC(=O)OC MCULE-9269565507 [0,1,0,0,0,0|0,0,0]=1 130 B15R0.172 COC(=O)CCCCCCCCC(=O)OC MCULE-8633671524 [0,1,0,0,0,0|1,0,1]=3 131 B15R0.172 COC(=O)CCCCCCCCC(O)CO MCULE-4669620712 [0,1,0,0,0,0|1,0,0]=2 132 B15R0.247 COC(=O)CCCCCCCCCC(=O)O MCULE-6347713742 [0,1,0,0,0,0|1,0,1]=3 133 B15R0.247 COC(=O)CCCCCCCCCC(C)C MCULE-6194864064 [0,1,0,0,0,0|0,0,0]=1 134 B15R0.253 CCCCCCCCCCCC(OC)OC MCULE-2265269953 [0,1,0,0,0,0|0,0,2]=3 135 B15R0.324 CCCCCCCCCCC(O)C(=O)OC MCULE-7036030326 [0,1,0,0,0,0|0,0,0]=1 136 B15R0.324 CCCCCCCCNCC(C)C(=O)OC MCULE-3775062330 [0,1,0,0,0,0|1,0,0]=2 137 B15R0.324 CCCCOCCCNCC(C)C(=O)OC MCULE-2255353960 [0,1,0,0,0,0|2,0,0]=3 138 B15R0.366 C=CCCCCCCCCCC(=O)OCC MCULE-7999165590 [0,1,0,0,0,0|0,0,2]=3 139 B15R0.366 C=COC(=O)CCCCCCCCCCC MCULE-4112696875 [0,1,0,0,0,0|0,0,1]=2 140 B15R0.366 CCCCCCCCC/C=C/C(=O)OCC MCULE-9164260564 [0,1,0,0,0,0|0,0,2]=3 141 B15R0.366 CCCCCCCCC=NNC(=O)OCC MCULE-3507647310 [0,1,0,0,0,0|2,0,1]=4 142 B15R0.366 CCCCCCCCCC=CC(=O)OCC MCULE-3827280556 [0,1,0,0,0,0|0,0,2]=3 143 B15R0.366 CCCCCCCCCCCC(=O)NCC MCULE-4785540132 [0,1,0,0,0,0|1,0,0]=2 144 B15R0.366 CCCCCCCCCCCC(=O)OCC MCULE-6150658986 [0,1,0,0,0,0|0,0,0]=1 145 B15R0.366 CCCCCCCCCCCC(=O)OCCl MCULE-7622384571 [0,1,0,0,0,0|0,0,0]=1 146 B15R0.366 CCCCCCCCCCOC(=O)CC#N MCULE-3934095862 [0,1,0,0,0,0|2,0,1]=4 147 B15R0.366 CCCCCCCCNCCC(=O)OCC MCULE-7089762363 [0,1,0,0,0,0|1,0,0]=2 148 B15R0.366 CCCCCCCCSCCC(=O)OCC MCULE-2446708021 [0,1,0,0,0,0|1,0,0]=2 149 B15R0.366 CCOC(=O)CCCCCCCCCCBr MCULE-2219675372 [0,1,0,0,0,0|1,0,0]=2 150 B15R0.3221 CCCCCCC=CCC(O)CC(=O)OC MCULE-5871228230 [0,1,0,0,0,0|0,0,2]=3 151 B15R0.3221 CCCCCCCCCC(=O)CC(=O)OC MCULE-9878066874 [0,1,0,0,0,0|0,0,1]=2 152 B15R0.3221 CCCCCCCCCC(O)CC(=O)OC MCULE-2317645071 [0,1,0,0,0,0|0,0,0]=1 153 B15R0.3221 CCCCCCCCC[C@@H](O)CC(=O)OC MCULE-3527439520 [0,1,0,0,0,0|0,0,0]=1 154 B15R0.3221 CCCCCCCCNC(C)CC(=O)OC MCULE-6956447346 [0,1,0,0,0,0|1,0,0]=2 155 B15R0.3221 CCCCOCCCNC(C)CC(=O)OC MCULE-1361341353 [0,1,0,0,0,0|2,0,0]=3 156 B15R1.12 CCCCCCCCC1CCC(=O)CC1 MCULE-3877943983 [0,0,0,1,0,0|1,0,0]=2 157 B15R1.12 CCCCOCCOC1CCC(=O)CC1 MCULE-4651102103 [0,0,0,1,0,0|3,0,0]=4 158 B15R1.962 COC(=O)CCNCCC1=CCCCC1 MCULE-3116434239 [0,0,0,1,0,0|1,0,2]=4 159 B15R1.962 COC(=O)CCOCCC1CCCCN1 MCULE-2243506378 [0,0,0,1,0,0|2,0,0]=3 160 B15R1.962 COC(=O)CCOCCC1CCCCN1 MCULE-9984127406 [0,0,0,1,0,0|2,0,0]=3 161 B15R1.962 COC(=O)CCOCCC1CCCNC1 MCULE-7573726351 [0,0,0,1,0,0|2,0,0]=3 162 B15R1.962 COC(=O)CCOCCC1CCCNC1 MCULE-9822401352 [0,0,0,1,0,0|2,0,0]=3 163 B15R1.962 COC(=O)CCOCCC1CCNCC1 MCULE-6018435191 [0,0,0,1,0,0|2,0,0]=3 164 B15R1.962 COC(=O)CCOCCC1CCNCC1 MCULE-6345196247 [0,0,0,1,0,0|2,0,0]=3 165 B15R1.962 COC(=O)NN=CCCC1CCCCC1 MCULE-3245308869 [0,0,0,1,0,0|2,0,1]=4 166 B15R1.1052 CCCCC1CCCCC1OC(=O)CC MCULE-7582349458 [0,0,0,1,0,0|2,0,0]=3 167 B15R1.6326 CCCCCCCCC1CC1C(=O)NO MCULE-9235033063 [0,0,0,1,0,0|2,0,0]=3 168 B15R1.6595 O=C1CCCCCCCCCCCCO1 MCULE-3692667490 [0,0,0,1,0,0|0,0,0]=1 169 B15R1.11631 COC(=O)CCCCCCCCC1CO1 MCULE-1178066242 [0,0,0,1,0,0|1,0,0]=2 170 B12R0.5 C#CCCCCCCCCCCC MCULE-4966581415 [2,0,0,0,0,0|0,0,2]=4 171 B12R0.5 C=CCCCCCCCCCC=O MCULE-4798960934 [2,0,0,0,0,0|0,0,2]=4 172 B12R0.5 C=CCCCCCCCCCCBr MCULE-1450832602 [2,0,0,0,0,0|1,0,1]=4 173 B12R0.5 C=CCCCCCCCCCCC MCULE-7790972998 [2,0,0,0,0,0|0,0,1]=3 174 B12R0.5 C=CCCCCCCCCCCO MCULE-9436785815 [2,0,0,0,0,0|1,0,1]=4 175 B12R0.5 C=COCCCCCCCCCC MCULE-9853638067 [2,0,0,0,0,0|1,0,1]=4 176 B12R0.5 C=CSCCCCCCCCCC MCULE-4125685210 [2,0,0,0,0,0|1,0,1]=4 177 B12R0.5 CCCCCCCCC/C=C/C=O MCULE-3924650225 [2,0,0,0,0,0|0,0,2]=4 178 B12R0.5 CCCCCCCCCC/C=C/I MCULE-7924200766 [2,0,0,0,0,0|1,0,1]=4 179 B12R0.5 CCCCCCCCCC=CC=O MCULE-6984246846 [2,0,0,0,0,0|0,0,2]=4 180 B12R0.5 CCCCCCCCCCCC#N MCULE-4898299264 [2,0,0,0,0,0|1,0,1]=4 181 B12R0.5 CCCCCCCCCCCC=O MCULE-3814557174 [2,0,0,0,0,0|0,0,0]=2 182 B12R0.5 CCCCCCCCCCCCBr MCULE-2442495006 [2,0,0,0,0,0|1,0,1]=4 183 B12R0.5 CCCCCCCCCCCCC MCULE-7749861366 [2,0,0,0,0,0|0,0,1]=3 184 B12R0.5 CCCCCCCCCCCCCl MCULE-6025385532 [2,0,0,0,0,0|1,0,1]=4 185 B12R0.5 CCCCCCCCCCCCF MCULE-3563531940 [2,0,0,0,0,0|1,0,1]=4 186 B12R0.5 CCCCCCCCCCCCI MCULE-6449418786 [2,0,0,0,0,0|1,0,1]=4 187 B12R0.5 CCCCCCCCCCCCN MCULE-1282419209 [2,0,0,0,0,0|1,0,1]=4 188 B12R0.5 CCCCCCCCCCCCN MCULE-1312431857 [2,0,0,0,0,0|1,0,1]=4 189 B12R0.5 CCCCCCCCCCCCN MCULE-3936839656 [2,0,0,0,0,0|1,0,1]=4 190 B12R0.5 CCCCCCCCCCCCN MCULE-8497998841 [2,0,0,0,0,0|1,0,1]=4 191 B12R0.5 CCCCCCCCCCCCN MCULE-9101484482 [2,0,0,0,0,0|1,0,1]=4 192 B12R0.5 CCCCCCCCCCCCO MCULE-3423087499 [2,0,0,0,0,0|0,0,1]=3 193 B12R0.5 CCCCCCCCCCCCO MCULE-9381688904 [2,0,0,0,0,0|0,0,1]=3 194 B12R0.5 CCCCCCCCCCCCS MCULE-8388213802 [2,0,0,0,0,0|0,1,1]=4 195 B12R0.5 CCCCCCCCCCCNC MCULE-4232799137 [2,0,0,0,0,0|1,0,0]=3 196 B12R0.5 CCCCCCCCCCCNC MCULE-9324463288 [2,0,0,0,0,0|1,0,0]=3 197 B12R0.5 CCCCCCCCCCNC=O MCULE-2199641461 [2,0,0,0,0,0|1,0,0]=3 198 B12R0.5 CCCCCCCCCCSCC MCULE-4046728399 [2,0,0,0,0,0|1,0,1]=4 199 B12R0.5 CCCCCCCCCSCCO MCULE-1890346670 [2,0,0,0,0,0|1,0,1]=4 200 B12R0.5 CCCCCCCCNCCCC MCULE-6370859761 [2,0,0,0,0,0|1,0,1]=4 201 B12R0.5 CCCCCCCCNCCOC MCULE-9794668613 [2,0,0,0,0,0|1,0,0]=3 202 B12R0.5 CCCCCCCCOCCNC MCULE-3720493532 [2,0,0,0,0,0|2,0,0]=4 203 B12R0.5 CCCCCCCCOCCNC MCULE-6027502699 [2,0,0,0,0,0|2,0,0]=4 204 B12R0.5 CCCCCCCCSCCNC MCULE-1591454214 [2,0,0,0,0,0|2,0,0]=4 205 B12R0.5 CCCCCCCCSCCNC MCULE-9041733565 [2,0,0,0,0,0|2,0,0]=4 206 B12R0.5 CCCCCCCNCCCNC MCULE-3143160534 [2,0,0,0,0,0|2,0,0]=4 207 B12R0.5 CCCCCCCOCCCC=O MCULE-7580382219 [2,0,0,0,0,0|1,0,0]=3 208 B12R0.5 CCCCCCCOCCCCO MCULE-4232162406 [2,0,0,0,0,0|1,0,1]=4 209 B12R0.5 CCCCCCNCCCCCC MCULE-3670409724 [2,0,0,0,0,0|1,0,1]=4 210 B12R0.5 CCCCCCNCCCCCC MCULE-4867029659 [2,0,0,0,0,0|1,0,1]=4 211 B12R0.5 CCCCCCNCCCCCC MCULE-9932038203 [2,0,0,0,0,0|1,0,1]=4 212 B12R0.5 CCCCCCOCCCCCC MCULE-3976538682 [2,0,0,0,0,0|1,0,1]=4 213 B12R0.5 CCCCCCSCCCCCC MCULE-2928486782 [2,0,0,0,0,0|1,0,1]=4 214 B12R0.5 CCCOCCCCCCCCO MCULE-6159515912 [2,0,0,0,0,0|1,0,1]=4 215 B12R0.5 CCOCCCCCCCCCO MCULE-6343777651 [2,0,0,0,0,0|1,0,1]=4 216 B12R0.5 NCCCCCCCCCCCO MCULE-5135515993 [2,0,0,0,0,0|1,0,1]=4 217 B12R0.5 O=CCCCCCCCCCCBr MCULE-8057974781 [2,0,0,0,0,0|1,0,0]=3 218 B12R0.5 OCCCCCCCCCCCBr MCULE-5881088914 [2,0,0,0,0,0|1,0,1]=4 219 B12R0.5 OCCCCCCCCCCCO MCULE-6987509130 [2,0,0,0,0,0|1,0,1]=4 220 B12R0.5 OCCCCCCCCCCCS MCULE-4791107478 [2,0,0,0,0,0|1,0,1]=4 221 B12R0.5 [NH2+](CCCC)CCCCCCCC MCULE-9696707679 [2,0,0,0,0,0|1,0,1]=4 222 B12R0.234 C#CCCCCCCCCC(=O)O MCULE-2483655428 [2,0,0,0,0,0|0,0,2]=4 223 B12R0.234 C=C(Br)CCCCCCCCCC MCULE-6429692740 [2,0,0,0,0,0|1,0,1]=4 224 B12R0.234 C=C(C)CCCCCCCCCC MCULE-5430192671 [2,0,0,0,0,0|1,0,0]=3 225 B12R0.234 C=C(Cl)CCCCCCCCCC MCULE-5277185113 [2,0,0,0,0,0|1,0,1]=4 226 B12R0.234 C=CCCCCCCCCC(=O)C MCULE-8465504630 [2,0,0,0,0,0|0,0,2]=4 227 B12R0.234 C=CCCCCCCCCC(=O)O MCULE-7928135942 [2,0,0,0,0,0|0,0,2]=4 228 B12R0.234 CC#CCCCCCCCC(=O)O MCULE-8975663292 [2,0,0,0,0,0|0,0,2]=4 229 B12R0.234 CC(=O)OCCCCCCCCBr MCULE-4728650316 [2,0,0,0,0,0|2,0,0]=4 230 B12R0.234 CCCCCCC/C=C/CC(=O)C MCULE-6992455059 [2,0,0,0,0,0|0,0,2]=4 231 B12R0.234 CCCCCCCC/C=C/C(=O)O MCULE-6786701242 [2,0,0,0,0,0|0,0,2]=4 232 B12R0.234 CCCCCCCCC=CC(=O)O MCULE-7750983255 [2,0,0,0,0,0|0,0,2]=4 233 B12R0.234 CCCCCCCCCCB(O)O MCULE-6277841305 [2,0,0,0,0,0|1,0,1]=4 234 B12R0.234 CCCCCCCCCCC(=O)C MCULE-3936750617 [2,0,0,0,0,0|0,0,0]=2 235 B12R0.234 CCCCCCCCCCC(=O)Cl MCULE-1131766423 [2,0,0,0,0,0|1,0,0]=3 236 B12R0.234 CCCCCCCCCCC(=O)N MCULE-7086521203 [2,0,0,0,0,0|1,0,0]=3 237 B12R0.234 CCCCCCCCCCC(=O)O MCULE-5110587542 [2,0,0,0,0,0|0,0,0]=2 238 B12R0.234 CCCCCCCCCCC(C)N MCULE-6206499625 [2,0,0,0,0,0|1,0,1]=4 239 B12R0.234 CCCCCCCCCCC(C)O MCULE-9407036721 [2,0,0,0,0,0|0,0,2]=4 240 B12R0.234 CCCCCCCCCCN(=O)=O MCULE-9525688454 [2,0,0,0,0,0|1,0,1]=4 241 B12R0.234 CCCCCCCCCCN(C)C MCULE-5051937267 [2,0,0,0,0,0|2,0,0]=4 242 B12R0.234 CCCCCCCCCCS(=O)C MCULE-1607212944 [2,0,0,0,0,0|1,0,0]=3 243 B12R0.234 CCCCCCCCCOC(=O)C MCULE-7712513310 [2,0,0,0,0,0|1,0,0]=3 244 B12R0.234 CCCCCCCCCOC(=O)Cl MCULE-4937657236 [2,0,0,0,0,0|2,0,0]=4 245 B12R0.234 CCCCCCCCOCC(=O)O MCULE-8710960938 [2,0,0,0,0,0|1,0,0]=3 246 B12R0.234 CCCCCCCCSCC(=O)N MCULE-3095528852 [2,0,0,0,0,0|2,0,0]=4 247 B12R0.234 CCCCCCCCSCC(=O)O MCULE-8082253480 [2,0,0,0,0,0|1,0,0]=3 248 B12R0.234 CCCCCCCC[NH2+]CC(=O)O MCULE-1736831432 [2,0,0,0,0,0|1,0,0]=3 249 B12R0.234 CCCCCCCC[NH2+]CC(=O)O MCULE-8284012398 [2,0,0,0,0,0|1,0,0]=3 250 B12R0.234 CCCCCCCNCCC(=O)N MCULE-9973742738 [2,0,0,0,0,0|2,0,0]=4 251 B12R0.234 CCOCCCCCCCC(=O)O MCULE-4393917993 [2,0,0,0,0,0|1,0,0]=3 252 B12R0.234 N#CCCCCCCCCC(=O)O MCULE-1219422242 [2,0,0,0,0,0|1,0,1]=4 253 B12R0.234 NCCCCCCCCCC(=O)O MCULE-1324986945 [2,0,0,0,0,0|1,0,0]=3 254 B12R0.234 O=C(O)CCCCCCCCCBr MCULE-5728710095 [2,0,0,0,0,0|1,0,0]=3 255 B12R0.234 O=C(O)CCCCCCCCCF MCULE-1907577974 [2,0,0,0,0,0|1,0,0]=3 256 B12R0.234 O=C(O)CCCCCCCCCO MCULE-3771681317 [2,0,0,0,0,0|1,0,0]=3 257 B12R0.248 C=CCCCCCCCC(=O)OC MCULE-1843303649 [2,0,0,0,0,0|0,0,2]=4 258 B12R0.248 CCCCCCCCCC(=O)CC MCULE-8070056231 [2,0,0,0,0,0|1,0,0]=3 259 B12R0.248 CCCCCCCCCC(=O)NC MCULE-5903490737 [2,0,0,0,0,0|1,0,0]=3 260 B12R0.248 CCCCCCCCCC(=O)NN MCULE-5225093755 [2,0,0,0,0,0|2,0,0]=4 261 B12R0.248 CCCCCCCCCC(=O)NO MCULE-3922115888 [2,0,0,0,0,0|2,0,0]=4 262 B12R0.248 CCCCCCCCCC(=O)OC MCULE-3080392178 [2,0,0,0,0,0|0,0,0]=2 263 B12R0.248 CCCCCCCCOC(=O)CC MCULE-3871560069 [2,0,0,0,0,0|2,0,0]=4 264 B12R0.248 CCCCCCCSCC(=O)OC MCULE-8419218207 [2,0,0,0,0,0|1,0,0]=3 265 B12R0.248 CNCCCCCCCC(=O)OC MCULE-2073535841 [2,0,0,0,0,0|1,0,0]=3 266 B12R0.248 COC(=O)CCCCCCCC=O MCULE-8962678443 [2,0,0,0,0,0|1,0,1]=4 267 B12R0.248 COC(=O)CCCCCCCCBr MCULE-8360143365 [2,0,0,0,0,0|1,0,0]=3 268 B12R0.248 COC(=O)CCCCCCCCO MCULE-5867988584 [2,0,0,0,0,0|1,0,0]=3 269 B14R0.2 CCCCCCCC(=O)CCCC(=O)O MCULE-7869619246 [1,1,0,0,0,0|0,0,1]=3 270 B14R0.2 CCCCCCCC(=O)NCCC(=O)O MCULE-8282090533 [1,1,0,0,0,0|1,0,1]=4 271 B14R0.2 CCCCCCCC(O)CCCC(=O)O MCULE-5858594058 [1,1,0,0,0,0|0,0,0]=2 272 B14R0.68 CC(=O)CCCCCCCCCC(=O)O MCULE-2777579719 [1,1,0,0,0,0|0,0,1]=3 273 B14R0.68 CC(=O)CCCCCCCCNC(=O)C MCULE-5569964910 [1,1,0,0,0,0|1,0,1]=4 274 B14R0.68 CC(=O)NCCCCCCCCC(=O)O MCULE-6693735666 [1,1,0,0,0,0|1,0,1]=4 275 B14R0.68 CC(C)CCCCCCC/C=C\C(=O)O MCULE-6085372462 [1,1,0,0,0,0|0,0,2]=4 276 B14R0.68 CC(C)CCCCCCCC=CC(=O)O MCULE-2095727186 [1,1,0,0,0,0|0,0,2]=4 277 B14R0.68 CC(C)CCCCCCCCCC(=O)O MCULE-8259958688 [1,1,0,0,0,0|0,0,0]=2 278 B14R0.68 CC(O)CCCCCCCCCC(=O)O MCULE-5368688925 [1,1,0,0,0,0|0,0,0]=2 279 B14R0.68 O=C(O)CCCCCCCCCC(=O)O MCULE-3587613382 [1,1,0,0,0,0|1,0,1]=4 280 B14R0.88 CCCCCCCCCCCC(C)(C)S MCULE-9956928254 [1,1,0,0,0,0|0,1,1]=4 281 B14R0.88 CCCCCCCCCCCP(=O)(O)O MCULE-1217279150 [1,1,0,0,0,0|1,0,0]=3 282 B14R0.88 CCCCCCCCCCCS(=O)(=O)[O-] MCULE-3066318526 [1,1,0,0,0,0|1,0,1]=4 283 B14R0.88 CCCCCCCCCCCS(=O)(=O)[O-] MCULE-7737058858 [1,1,0,0,0,0|1,0,1]=4 284 B14R0.88 CCCCCCCCCCC[N+](C)(C)[O-] MCULE-7281407013 [1,1,0,0,0,0|1,0,1]=4 285 B14R0.88 CCCCCCCCCCOP(=O)(O)O MCULE-6182561553 [1,1,0,0,0,0|2,0,0]=4 286 B14R0.88 CCCCCCCCCCOP(=O)([O-])O MCULE-7698287185 [1,1,0,0,0,0|2,0,0]=4 287 B14R0.88 CCCCCCCCCCOS(=O)(=O)O MCULE-5411467830 [1,1,0,0,0,0|2,0,0]=4 288 B14R0.88 NCCCCCCCCCCP(=O)(O)O MCULE-5353498495 [1,1,0,0,0,0|2,0,0]=4 289 B14R0.88 NCCCCCCCCCCP(=O)(O)O MCULE-8370982773 [1,1,0,0,0,0|2,0,0]=4 290 B14R0.88 O=P(O)(O)CCCCCCCCCCBr MCULE-8137402085 [1,1,0,0,0,0|2,0,0]=4 291 B14R0.153 CCCCC(=O)CCCCCCC(=O)O MCULE-9203558568 [1,1,0,0,0,0|0,0,1]=3 292 B14R0.153 CCCCC(O)CCCCCCC(=O)O MCULE-9749358521 [1,1,0,0,0,0|0,0,0]=2 293 B14R0.231 CCCCCC(=O)CCCCCC(=O)O MCULE-3463709825 [1,1,0,0,0,0|0,0,1]=3 294 B14R0.231 CCCCCC(=O)NCCCCC(=O)O MCULE-9650195842 [1,1,0,0,0,0|1,0,1]=4 295 B14R0.231 CCCCCC(O)CCCCCC(=O)O MCULE-1531878545 [1,1,0,0,0,0|0,0,0]=2 296 B14R0.305 CCC(=O)CCCCCCCCC(=O)O MCULE-6679639032 [1,1,0,0,0,0|0,0,1]=3 297 B14R0.305 CCC(C)CCCCCCCCC(=O)O MCULE-9730846585 [1,1,0,0,0,0|0,0,0]=2 298 B14R0.305 COC(=O)CCCCCCCCC(=O)O MCULE-8938642997 [1,1,0,0,0,0|1,0,1]=4 299 B14R0.305 O=C(O)CCCCCCCCC(O)CO MCULE-9638168645 [1,1,0,0,0,0|1,0,0]=3 300 B14R0.340 CCCCCCCCCCC(Br)C(=O)O MCULE-8612961366 [1,1,0,0,0,0|0,0,0]=2 301 B14R0.340 CCCCCCCCCCC(C)C(=O)O MCULE-9255156956 [1,1,0,0,0,0|0,0,0]=2 302 B14R0.340 CCCCCCCCCCC(Cl)C(=O)O MCULE-6251475162 [1,1,0,0,0,0|0,0,0]=2 303 B14R0.340 CCCCCCCCCCC(N)C(=O)O MCULE-3310366500 [1,1,0,0,0,0|0,0,0]=2 304 B14R0.340 CCCCCCCCCCC(O)C(=O)O MCULE-5171743084 [1,1,0,0,0,0|0,0,0]=2 305 B14R0.340 CCCCCCCCCC[C@@H](N)C(=O)O MCULE-6652767353 [1,1,0,0,0,0|0,0,0]=2 306 B14R0.340 CCCCCCCCCC[C@H](N)C(=O)O MCULE-4936998730 [1,1,0,0,0,0|0,0,0]=2 307 B14R0.340 CCCCCCCCCC[C@H](N)C(=O)O MCULE-6114365319 [1,1,0,0,0,0|0,0,0]=2 308 B14R0.340 NCCCCNCCCC[C@H](N)C(=O)O MCULE-6406203156 [1,1,0,0,0,0|2,0,0]=4 309 B14R0.344 CCCCCCCCC(=O)CCC(=O)O MCULE-8037408561 [1,1,0,0,0,0|0,0,1]=3 310 B14R0.344 CCCCCCCCC(C)CCC(=O)O MCULE-9191627113 [1,1,0,0,0,0|0,0,0]=2 311 B14R0.344 CCCCCCCCC(O)CCC(=O)O MCULE-6470944503 [1,1,0,0,0,0|0,0,0]=2 312 B14R0.344 CCCCCCCCC(O)CCC(=O)[O-] MCULE-2857603909 [1,1,0,0,0,0|0,0,1]=3 313 B14R0.344 CCCCCCCCS(=O)CCC(=O)N MCULE-4064667650 [1,1,0,0,0,0|2,0,0]=4 314 B14R0.344 CCCCCCCCS(=O)CCC(=O)O MCULE-6503950443 [1,1,0,0,0,0|1,0,0]=3 315 B14R0.344 CCCCCCCNC(=O)CCC(=O)O MCULE-7895735111 [1,1,0,0,0,0|1,0,1]=4 316 B14R0.391 CCCCCC/C=C\CC(O)CC(=O)O MCULE-2404322318 [1,1,0,0,0,0|0,0,2]=4 317 B14R0.391 CCCCCCCCCC(C)CC(=O)O MCULE-2198601753 [1,1,0,0,0,0|0,0,0]=2 318 B14R0.391 CCCCCCCCCC(O)CC(=O)O MCULE-8054557225 [1,1,0,0,0,0|0,0,0]=2 319 B14R0.391 CCCCCCCCC[C@@H](O)CC(=O)O MCULE-9862158900 [1,1,0,0,0,0|0,0,0]=2 320 B14R0.391 CCCCCCCCNC(=O)CC(=O)O MCULE-5427245082 [1,1,0,0,0,0|1,0,1]=4 321 B14R0.391 CCCCCCCCOC(=O)CC(=O)C MCULE-8441732366 [1,1,0,0,0,0|1,0,1]=4 322 B14R0.394 C#CCCCCCCCCCCC(=O)O MCULE-5450003719 [1,1,0,0,0,0|0,0,1]=3 323 B14R0.394 C=C(C)CCCCCCCCCCCC MCULE-1660064186 [1,1,0,0,0,0|1,0,0]=3 324 B14R0.394 C=CCCCCCCCCCCC(=C)C MCULE-2402891038 [1,1,0,0,0,0|1,0,1]=4 325 B14R0.394 C=CCCCCCCCCCCC(=O)O MCULE-9793800000 [1,1,0,0,0,0|0,0,1]=3 326 B14R0.394 C=CCCCCCCCCCSC(=O)C MCULE-4760117307 [1,1,0,0,0,0|0,0,2]=4 327 B14R0.394 CCCCC#CCCCCCCC(=O)O MCULE-8024164485 [1,1,0,0,0,0|0,0,1]=3 328 B14R0.394 CCCCCCCCCCC=CC(=O)O MCULE-4178586146 [1,1,0,0,0,0|0,0,1]=3 329 B14R0.394 CCCCCCCCCCCCB(O)O MCULE-9093678828 [1,1,0,0,0,0|1,0,1]=4 330 B14R0.394 CCCCCCCCCCCCC(=O)C MCULE-2872423248 [1,1,0,0,0,0|0,0,0]=2 331 B14R0.394 CCCCCCCCCCCCC(=O)O MCULE-1430959106 [1,1,0,0,0,0|0,0,0]=2 332 B14R0.394 CCCCCCCCCCCCC(C)C MCULE-7317925183 [1,1,0,0,0,0|1,0,1]=4 333 B14R0.394 CCCCCCCCCCCCC(C)I MCULE-9658991496 [1,1,0,0,0,0|1,0,1]=4 334 B14R0.394 CCCCCCCCCCCCC(C)O MCULE-1888626759 [1,1,0,0,0,0|0,0,2]=4 335 B14R0.394 CCCCCCCCCCCCN(=O)=O MCULE-5400909349 [1,1,0,0,0,0|1,0,1]=4 336 B14R0.394 CCCCCCCCCCCCN(C)C MCULE-7234022591 [1,1,0,0,0,0|2,0,0]=4 337 B14R0.394 CCCCCCCCCCCCS(=O)C MCULE-1846061546 [1,1,0,0,0,0|1,0,0]=3 338 B14R0.394 CCCCCCCCCCCOC(=O)C MCULE-9960804873 [1,1,0,0,0,0|0,0,0]=2 339 B14R0.394 CCCCCCCCCC[NH2+]CC(=O)O MCULE-1390429058 [1,1,0,0,0,0|0,0,0]=2 340 B14R0.394 CCCCCCCCCC[NH2+]CC(=O)O MCULE-7569072874 [1,1,0,0,0,0|0,0,0]=2 341 B14R0.394 CCCCCCCCSCCOC(=O)C MCULE-3293546242 [1,1,0,0,0,0|1,0,0]=3 342 B14R0.394 N#CCCCCCCCCCCC(=O)O MCULE-7550910857 [1,1,0,0,0,0|0,0,1]=3 343 B14R0.394 N#N=NCCCCCCCCCC(=O)O MCULE-9886282931 [1,1,0,0,0,0|2,0,0]=4 344 B14R0.394 NCCCCCCCCCCCC(=O)O MCULE-4152674665 [1,1,0,0,0,0|0,0,0]=2 345 B14R0.394 O=C(O)CCCCCCCCCCCBr MCULE-7401124485 [1,1,0,0,0,0|0,0,0]=2 346 B14R0.394 O=C(O)CCCCCCCCCCCO MCULE-6776936355 [1,1,0,0,0,0|0,0,0]=2 347 B14R0.394 O=C(O)CCCCCCCCCCCS MCULE-7711860322 [1,1,0,0,0,0|0,0,0]=2 348 B14R0.394 O=C(O)COCCOCCCCCCCl MCULE-1118128476 [1,1,0,0,0,0|2,0,0]=4 349 B14R0.394 O=N(=O)CCCCCCCCCCCO MCULE-8940789390 [1,1,0,0,0,0|1,0,1]=4 350 B14R0.394 [NH+](C)(C)CCCCCCCCCCCC MCULE-8328860853 [1,1,0,0,0,0|2,0,0]=4 351 B14R0.432 CCOC(=O)CCCCCCCC(=O)C MCULE-8382585898 [1,1,0,0,0,0|1,0,1]=4 352 B14R0.2224 CCCCCCC(O)CCCCC(=O)O MCULE-1514435932 [1,1,0,0,0,0|0,0,0]=2 353 B14R0.82 CCCCCCCCC(O)CC(=O)OC MCULE-6227515416 [1,1,0,0,0,0|0,0,0]=2 354 B14R0.181 CCCCCCCCCC(O)C(=O)OC MCULE-6591992421 [1,1,0,0,0,0|0,0,0]=2 355 B14R0.197 CCC(C)CCCCCCCC(=O)OC MCULE-6741530079 [1,1,0,0,0,0|0,0,0]=2 356 B14R0.197 COC(=O)CCCCCCCC(=O)OC MCULE-3415352484 [1,1,0,0,0,0|1,0,1]=4 357 B14R0.393 C=CCCCCCCCCC(=O)OCC MCULE-8561484163 [1,1,0,0,0,0|0,0,2]=4 358 B14R0.393 CCCCCCCCC#CC(=O)OCC MCULE-1422889109 [1,1,0,0,0,0|0,0,2]=4 359 B14R0.393 CCCCCCCCCCC(=O)OCC MCULE-7345568612 [1,1,0,0,0,0|0,0,0]=2 360 B14R0.393 CCCCCCCCCCS(=O)CCCl MCULE-1369991528 [1,1,0,0,0,0|2,0,0]=4 361 B14R0.393 CCCCCCCCCCS(=O)CCO MCULE-6360797475 [1,1,0,0,0,0|2,0,0]=4 362 B14R0.393 CCCCCCCCCNC(=O)CCS MCULE-5450463677 [1,1,0,0,0,0|2,0,0]=4 363 B14R0.393 CCCCCCCNCCC(=O)NCC MCULE-8513247916 [1,1,0,0,0,0|2,0,0]=4 364 B14R0.393 CCCCCCCNCCC(=O)OCC MCULE-6058376626 [1,1,0,0,0,0|1,0,0]=3 365 B14R0.393 CCOC(=O)CCCCCCCCC=O MCULE-1701011376 [1,1,0,0,0,0|1,0,1]=4 366 B14R0.393 CCOC(=O)CCCCCCCCCBr MCULE-9108239972 [1,1,0,0,0,0|1,0,0]=3 367 B14R0.393 CCOC(=O)CCCCCCCCCO MCULE-7625421399 [1,1,0,0,0,0|1,0,0]=3 368 B14R0.393 CCOCCCCCCCC(=O)OCC MCULE-2934612920 [1,1,0,0,0,0|1,0,0]=3 369 B14R0.2056 CCCCCCCCCC[Si](C)(C)OC MCULE-9665173477 [1,1,0,0,0,0|1,1,0]=4 370 B14R0.145 CCCCCCCC(O)CCCCCC MCULE-4019916999 [1,1,0,0,0,0|1,0,1]=4 371 B14R0.392 C=COCCCCCCCCCCCC MCULE-1459857080 [1,1,0,0,0,0|0,0,2]=4 372 B14R0.392 CC/C=C/CCCCCCCCCCO MCULE-6147260229 [1,1,0,0,0,0|1,0,1]=4 373 B14R0.392 CC/C=C\CCCCCCCCCCO MCULE-2734666708 [1,1,0,0,0,0|1,0,1]=4 374 B14R0.392 CCC=CCCCCCCCCCCO MCULE-6860357182 [1,1,0,0,0,0|1,0,1]=4 375 B14R0.392 CCCCCCCCCCCCCCBr MCULE-9737491714 [1,1,0,0,0,0|1,0,1]=4 376 B14R0.392 CCCCCCCCCCCCCCC MCULE-1292711626 [1,1,0,0,0,0|1,0,1]=4 377 B14R0.392 CCCCCCCCCCCCCCCl MCULE-4738230795 [1,1,0,0,0,0|1,0,1]=4 378 B14R0.392 CCCCCCCCCCCCCCF MCULE-9767518415 [1,1,0,0,0,0|1,0,1]=4 379 B14R0.392 CCCCCCCCCCCCCCN MCULE-8592595177 [1,1,0,0,0,0|1,0,1]=4 380 B14R0.392 CCCCCCCCCCCCCCO MCULE-8719320111 [1,1,0,0,0,0|1,0,1]=4 381 B14R0.392 CCCCCCCCCCCCCCS MCULE-5679876747 [1,1,0,0,0,0|1,0,1]=4 382 B14R0.392 CCCCCCCCCCCCC[NH2+]C MCULE-4777104073 [1,1,0,0,0,0|1,0,1]=4 383 B14R0.392 CCCCCCCCCCCCC[NH2+]C MCULE-6540647325 [1,1,0,0,0,0|1,0,1]=4 384 B14R0.392 CCCCCCCCCCCCNCC MCULE-6669418249 [1,1,0,0,0,0|1,0,1]=4 385 B14R0.392 CCCCCCCCCCCCOC=O MCULE-6493174878 [1,1,0,0,0,0|0,0,2]=4 386 B14R0.392 CCCCCCCCCCCCSCC MCULE-3847929623 [1,1,0,0,0,0|0,1,1]=4 387 B14R0.392 CCCCCCCCCCCNCCC MCULE-2740020624 [1,1,0,0,0,0|1,0,1]=4 388 B14R0.392 CCCCCCCCCCCOCCO MCULE-9070806750 [1,1,0,0,0,0|2,0,0]=4 389 B14R0.392 CCCCCCCCCNCCCCC MCULE-6073560034 [1,1,0,0,0,0|1,0,1]=4 390 B14R0.392 CCCCCCCCC[NH2+]CCCCC MCULE-8442579178 [1,1,0,0,0,0|1,0,1]=4 391 B14R0.392 CCCCCCCCNCCCCCC MCULE-1148069991 [1,1,0,0,0,0|1,0,1]=4 392 B14R0.392 CCCCCCCNCCCCCCC MCULE-8281252980 [1,1,0,0,0,0|1,0,1]=4 393 B14R0.392 CCCCCCCOCCCCCCC MCULE-7411737646 [1,1,0,0,0,0|1,0,1]=4 394 B14R0.392 CCCCCCCSCCCCCCC MCULE-8546717040 [1,1,0,0,0,0|1,0,1]=4 395 B14R0.392 [NH2+](CC)CCCCCCCCCCCC MCULE-2677553062 [1,1,0,0,0,0|1,0,1]=4 396 B14R0.392 [NH2+](CCC)CCCCCCCCCCC MCULE-1566613456 [1,1,0,0,0,0|1,0,1]=4 397 B16R0.61 CCCCCCCCCCCCC(=O)CCC MCULE-4895448580 [0,2,0,0,0,0|1,0,0]=3 398 B16R0.61 CCCCCCCCCCCCC(=O)OCC MCULE-8945154638 [0,2,0,0,0,0|0,0,0]=2 399 B16R0.61 CCCCCCCCCCCCC(=O)OCCl MCULE-1444257922 [0,2,0,0,0,0|0,0,0]=2 400 B16R0.61 CCOC(=O)CCCCCCCCCCCBr MCULE-8542798971 [0,2,0,0,0,0|0,0,0]=2 401 B16R0.61 CCOC(=O)CCCCCCCCCCCN MCULE-2649272831 [0,2,0,0,0,0|0,0,0]=2 402 B16R0.61 CCOC(=O)CCCCCCCCCCCN MCULE-6362464632 [0,2,0,0,0,0|0,0,0]=2 403 B16R0.61 CCSC(=O)CCCCCCCCCCCO MCULE-6080213440 [0,2,0,0,0,0|0,1,0]=3 404 B16R0.70 CCCCCCCCCCCC(=O)C(O)CC MCULE-9580362062 [0,2,0,0,0,0|1,0,0]=3 405 B16R0.70 CCCCCCCCCCOC(=O)C(N)CC MCULE-7635886305 [0,2,0,0,0,0|2,0,0]=4 406 B16R0.70 CCCCCCCCCCOC(=O)C(N)CC MCULE-9630474412 [0,2,0,0,0,0|2,0,0]=4 407 B16R0.164 CCC(C)CCCCCCCCCC(=O)OC MCULE-3200849129 [0,2,0,0,0,0|0,0,0]=2 408 B16R0.164 COC(=O)CCCCCCCCCC(=O)OC MCULE-1501744824 [0,2,0,0,0,0|0,0,1]=3 409 B16R0.165 COC(=O)CCCCCCCCCCC(=O)Cl MCULE-9470204504 [0,2,0,0,0,0|0,0,1]=3 410 B16R0.165 COC(=O)CCCCCCCCCCC(=O)N MCULE-1607971907 [0,2,0,0,0,0|0,0,1]=3 411 B16R0.165 COC(=O)CCCCCCCCCCC(=O)O MCULE-4901379479 [0,2,0,0,0,0|0,0,1]=3 412 B16R0.165 COC(=O)CCCCCCCCCCC(C)C MCULE-2765994462 [0,2,0,0,0,0|0,0,0]=2 413 B16R0.221 C=CC(=O)NCCCCCCCCCCCC MCULE-9950730044 [0,2,0,0,0,0|1,0,1]=4 414 B16R0.221 C=CC(=O)OCCCCCCCCCCCC MCULE-2937609730 [0,2,0,0,0,0|1,0,1]=4 415 B16R0.221 CCCCC=CCCCCCCCC(=O)OC MCULE-6534469638 [0,2,0,0,0,0|0,0,0]=2 416 B16R0.221 CCCCCCCCCCCCCC(=O)CC MCULE-9117802063 [0,2,0,0,0,0|1,0,0]=3 417 B16R0.221 CCCCCCCCCCCCCC(=O)NN MCULE-3612607907 [0,2,0,0,0,0|2,0,0]=4 418 B16R0.221 CCCCCCCCCCCCCC(=O)OC MCULE-3729213959 [0,2,0,0,0,0|0,0,0]=2 419 B16R0.221 CCCCCCCCCCCCNC(=O)CC MCULE-4783922420 [0,2,0,0,0,0|1,0,0]=3 420 B16R0.221 CCCCCCCCCCCCNC(=O)CCl MCULE-4529382467 [0,2,0,0,0,0|2,0,0]=4 421 B16R0.221 CCCCCCCCCCCCOC(=O)CBr MCULE-2483808028 [0,2,0,0,0,0|2,0,0]=4 422 B16R0.221 CCCCCCCCCCCCOC(=O)CC MCULE-8247406436 [0,2,0,0,0,0|1,0,0]=3 423 B16R0.221 CCCCCCCCCCCCOC(=O)CCl MCULE-6379931852 [0,2,0,0,0,0|2,0,0]=4 424 B16R0.221 CCCCCCCCCCCCOC(=O)CN MCULE-5189541815 [0,2,0,0,0,0|2,0,0]=4 425 B16R0.221 CCCCCCCCCCCCOC(=O)CN MCULE-8545291130 [0,2,0,0,0,0|2,0,0]=4 426 B16R0.221 CCCCCCCCCCCCOC(=O)CS MCULE-8899893008 [0,2,0,0,0,0|2,0,0]=4 427 B16R0.221 CCCCCCCCCCCCS/C(=N/C)/N MCULE-2953617930 [0,2,0,0,0,0|2,0,0]=4 428 B16R0.221 CCCCCCCCCCCCS/C(=N/C)/N MCULE-4652535696 [0,2,0,0,0,0|2,0,0]=4 429 B16R0.221 COC(=O)CCCCCCCCCCCCBr MCULE-1167427070 [0,2,0,0,0,0|0,0,0]=2 430 B16R0.221 COC(=O)CCCCCCCCCCN=N#N MCULE-2789691091 [0,2,0,0,0,0|1,0,0]=3 431 B16R0.222 CCCCCCCCCCCS/C(=N/C)/NC MCULE-2770381059 [0,2,0,0,0,0|2,0,0]=4 432 B16R0.222 CCCCCCCCCCCS/C(=N/C)/NC MCULE-6609216838 [0,2,0,0,0,0|2,0,0]=4 433 B16R0.222 CCCCCCCCCCOCC(OC)OC MCULE-2204991638 [0,2,0,0,0,0|0,0,2]=4 434 B16R0.806 COC(=O)CCCCCCCCC(O)CNO MCULE-2676110608 [0,2,0,0,0,0|1,0,0]=3 435 B16R0.1182 CCCCCCCCCCC(O)CC(=O)OC MCULE-1948600018 [0,2,0,0,0,0|0,0,0]=2 436 B16R0.1182 CCCCCCCCCC[C@@H](O)CC(=O)OC MCULE-4453079421 [0,2,0,0,0,0|0,0,0]=2 437 B16R0.6606 CCCCCCCCCC(C)COC(=O)CCl MCULE-9249023461 [0,2,0,0,0,0|2,0,0]=4 438 B16R0.195 CCCCC(=O)CCCCCCC(=O)OCC MCULE-5361164726 [0,2,0,0,0,0|0,0,1]=3 439 B16R0.299 CCCCCC(=O)CCCCCC(=O)OCC MCULE-4180654502 [0,2,0,0,0,0|0,0,1]=3 440 B16R0.1183 CCCCCCCCCCC(C)C(=O)OCC MCULE-6747298403 [0,2,0,0,0,0|0,0,0]=2 441 B16R0.97 CCOC(=O)CCCCCCCC(=O)OCC MCULE-9630769109 [0,2,0,0,0,0|1,0,1]=4 442 B16R0.154 CCCCCCCCCC(=O)CC(=O)OCC MCULE-4010265533 [0,2,0,0,0,0|0,0,1]=3 443 B16R0.154 CCCCCCCCCC(O)CC(=O)OCC MCULE-1873066901 [0,2,0,0,0,0|0,0,0]=2 444 B16R0.302 CCCCCCCCCCCC(=O)NC(=O)N MCULE-6859082771 [0,2,0,0,0,0|1,0,1]=4 445 B16R0.302 CCCCCCCCCCCC(=O)NC(=S)N MCULE-6657997748 [0,2,0,0,0,0|1,0,1]=4 446 B16R0.302 CCCCCCCCCCCC(=O)OC(C)C MCULE-9116592768 [0,2,0,0,0,0|0,0,0]=2 447 B16R0.302 CCCCCCCCCCNC(=O)OC(C)C MCULE-2107163626 [0,2,0,0,0,0|1,0,0]=3 448 B16R0.302 CCCCCCCCCCOC(=O)CC(=O)C MCULE-4216674513 [0,2,0,0,0,0|2,0,0]=4 449 B16R0.661 CCCCCCCCCCCC(=O)NCCO MCULE-3793069187 [0,2,0,0,0,0|1,0,0]=3 450 B16R0.661 CCCCCCCCCCCC(=O)OCCC MCULE-9916183085 [0,2,0,0,0,0|0,0,0]=2 451 B16R0.661 CCCCCCCCCCCC(=O)OCCCl MCULE-2443572008 [0,2,0,0,0,0|0,0,0]=2 452 B14R1.26 CCCCCCCC1CCCC(=O)O1 MCULE-4837230476 [1,0,0,1,0,0|0,0,0]=2 453 B14R1.26 N#CCCCCCC1CCCC(=O)C1 MCULE-8205747806 [1,0,0,1,0,0|1,0,1]=4 454 B14R1.122 CCCCCCCCC1C=CC(=O)O1 MCULE-5943669264 [1,0,0,1,0,0|0,0,2]=4 455 B14R1.122 CCCCCCCCC1CCC(=O)O1 MCULE-7923543295 [1,0,0,1,0,0|0,0,0]=2 456 B14R1.122 CCCCCCCC[C@H]1CCC(=O)O1 MCULE-9283902739 [1,0,0,1,0,0|0,0,0]=2 457 B14R1.159 CC1CCCCN1CCCCC(=O)O MCULE-6634961753 [1,0,0,1,0,0|1,0,0]=3 458 B14R1.159 CC1CCCCN1CCCCC(=O)O MCULE-7902887603 [1,0,0,1,0,0|1,0,0]=3 459 B14R1.221 CCCCCCCCCCCC1CO1 MCULE-9201050634 [1,0,0,1,0,0|0,0,2]=4 460 B14R1.269 CCCC1CCCCCC1NC(=O)C MCULE-1926366330 [1,0,0,1,0,0|1,0,0]=3 461 B14R1.422 CC(=O)OCCCCC1CCCCN1 MCULE-5119546001 [1,0,0,1,0,0|2,0,0]=4 462 B14R1.422 O=C(O)CCCCCC1CCCCC1 MCULE-7467581189 [1,0,0,1,0,0|0,0,0]=2 463 B14R1.422 O=C(O)CCCCCN1CCCCC1 MCULE-8688134792 [1,0,0,1,0,0|1,0,0]=3 464 B14R1.422 O=C(O)CCCCCN1CCOCC1 MCULE-6803434014 [1,0,0,1,0,0|2,0,0]=4 465 B14R1.422 O=C(O)CCCCOC1CCCCO1 MCULE-9542624487 [1,0,0,1,0,0|2,0,0]=4 466 B14R1.1252 CCCCCCC1CCCCC(=O)N1 MCULE-8020444927 [1,0,0,1,0,0|1,0,0]=3 467 B14R1.4408 O=C1CCCCCCCCCCCN1 MCULE-1851658645 [1,0,0,1,0,0|1,0,0]=3 468 B14R1.4408 O=C1CCCCCCCCCCCO1 MCULE-9380541113 [1,0,0,1,0,0|0,0,0]=2 469 B14R1.4728 CCCCCCCCC1CC1C(=O)N MCULE-3980615271 [1,0,0,1,0,0|1,0,0]=3 470 B14R1.4728 CCCCCCCCC1CC1C(=O)O MCULE-6572964179 [1,0,0,1,0,0|0,0,0]=2 471 B14R1.4972 CC1(CCCCCCCCCCC1)O MCULE-6571841065 [1,0,0,1,0,0|0,0,2]=4 472 B14R1.6388 O=C(O)CCCCCCCCC1CC1 MCULE-4957612029 [1,0,0,1,0,0|0,0,0]=2 473 B14R1.14 CCCCCCCC1CCC(=O)CC1 MCULE-6035418907 [1,0,0,1,0,0|1,0,0]=3 474 B14R1.247 CC1CCCCCCCCCCC1=O MCULE-3023877204 [1,0,0,1,0,0|1,0,0]=3 475 B14R1.247 O=C1CCCCCCCCCCC1Br MCULE-2954229808 [1,0,0,1,0,0|2,0,0]=4 476 B14R1.247 O=C1CCCCCCCCCCC1Cl MCULE-3762267711 [1,0,0,1,0,0|2,0,0]=4 477 B14R1.716 COC(=O)CCNCC1CCOCC1 MCULE-7992153409 [1,0,0,1,0,0|2,0,0]=4 478 B14R1.716 COC(=O)CCNCC1CCOCC1 MCULE-8730345380 [1,0,0,1,0,0|2,0,0]=4 479 B14R1.716 COC(=O)CCOCC1CCCNC1 MCULE-1636667689 [1,0,0,1,0,0|2,0,0]=4 480 B14R1.716 COC(=O)CCOCC1CCCNC1 MCULE-9022240397 [1,0,0,1,0,0|2,0,0]=4 481 B14R1.716 COC(=O)CCOCC1CCNCC1 MCULE-6144506211 [1,0,0,1,0,0|2,0,0]=4 482 B14R1.716 COC(=O)CCOCC1CCNCC1 MCULE-8164602160 [1,0,0,1,0,0|2,0,0]=4 483 B14R1.827 COC(=O)CCCCCCCC1CO1 MCULE-7215534488 [1,0,0,1,0,0|1,0,0]=3 484 B14R1.863 CCC1CCCCN1CCC(=O)OC MCULE-3849914557 [1,0,0,1,0,0|1,0,0]=3 485 B14R1.7684 COC(=O)CCN1CCCCCCC1 MCULE-7632104146 [1,0,0,1,0,0|1,0,0]=3 486 B14R1.62 CCCCCCCC1CCCC1=NO MCULE-7524060431 [1,0,0,1,0,0|2,0,0]=4 487 B14R1.62 CCCCCCCC\1CCC/C1=N/O MCULE-9956165606 [1,0,0,1,0,0|2,0,0]=4 488 B14R1.62 CCCCCCCC\1CCC/C1=N\O MCULE-6607576593 [1,0,0,1,0,0|2,0,0]=4 489 B14R1.123 CCCCCCCCC1CCCCC1 MCULE-9507507212 [1,0,0,1,0,0|1,0,1]=4 490 B14R1.476 CCCCCCC1CCCCC1=NO MCULE-6968797706 [1,0,0,1,0,0|2,0,0]=4 491 B14R1.476 CCCCCCC\1CCCC/C1=N/O MCULE-9076847941 [1,0,0,1,0,0|2,0,0]=4 492 B16R1.402 CC1CCCCCCCCCCCOC1=O MCULE-1334028238 [0,1,0,1,0,0|0,0,0]=2 493 B16R1.402 C[C@H]1CCCCCCCCCCCOC1=O MCULE-7240766244 [0,1,0,1,0,0|0,0,0]=2 494 B16R1.8816 O=C1CCCCCCCCCCCCCC1 MCULE-7713299679 [0,1,0,1,0,0|1,0,0]=3 495 B16R1.8816 O=C1CCCCCCCCCCOCCO1 MCULE-5709281545 [0,1,0,1,0,0|0,0,0]=2 496 B16R1.11022 O=C1CCCCC(=O)OCCCCCCO1 MCULE-1198992324 [0,1,0,1,0,0|1,0,1]=4 497 B16R1.11022 O=C1CCCCCCCCC(=O)OCCO1 MCULE-5372309426 [0,1,0,1,0,0|1,0,1]=4 498 B16R1.26934 CCCCCC1C(=O)CCC1CC(=O)OC MCULE-7597345136 [0,1,0,1,0,0|0,0,1]=3 499 B16R1.26934 CCCCCC1C(CCC1CC(=O)NN)O MCULE-7438855809 [0,1,0,1,0,0|2,0,0]=4 500 B16R1.26934 CCCCCC1C(CCC1CC(=O)OC)O MCULE-7943083245 [0,1,0,1,0,0|0,0,0]=2 501 B16R1.26934 CCCCC[C@H]1C(=O)CC[C@@H]1CC(=O)OC MCULE-5791459104 [0,1,0,1,0,0|0,0,1]=3 502 B16R1.26934 CCCCC[C@H]1C(=O)CC[C@@H]1CC(=O)OC MCULE-7296632884 [0,1,0,1,0,0|0,0,1]=3 503 B16R1.10827 O=C1CCCCCOC(=O)CCCCCO1 MCULE-7410854079 [0,1,0,1,0,0|1,0,1]=4 504 B16R1.4413 CCC(=O)OC1CCCCC1CCC(C)C MCULE-4964108817 [0,1,0,1,0,0|2,0,0]=4 505 B16R1.1193 CCCCCCCCCCCC1=NCCN1 MCULE-7236429521 [0,1,0,1,0,0|2,0,0]=4 506 B16R1.1635 COC(=O)C(C)CNCCN1CCCCC1 MCULE-7158520264 [0,1,0,1,0,0|2,0,0]=4 507 B16R1.2611 COC(=O)C(C)CNC1CCCCCCC1 MCULE-4795699602 [0,1,0,1,0,0|1,0,0]=3 508 B16R1.27 CCCCCCCCCC1CCCC(=O)O1 MCULE-8938614477 [0,1,0,1,0,0|2,0,0]=4 509 B16R1.890 CCOC(=O)CCNCC1CCCN1CC MCULE-5580861420 [0,1,0,1,0,0|2,0,0]=4 510 B16R1.932 CCOC(=O)CCCCOC1CCCCO1 MCULE-7607027416 [0,1,0,1,0,0|2,0,0]=4 511 B16R1.932 CCOC(=O)CCNCCN1CCCCC1 MCULE-3209856698 [0,1,0,1,0,0|2,0,0]=4 512 B16R1.2034 CCOC(=O)CCNC1CCCCCCC1 MCULE-3019018821 [0,1,0,1,0,0|1,0,0]=3 513 B16R1.14009 CCOC(=O)CCCCCC1CCCC1=O MCULE-4045554984 [0,1,0,1,0,0|1,0,1]=4 514 B16R1.1343 COC(=O)CNC(=O)CCC1CCCCC1 MCULE-3978896996 [0,1,0,1,0,0|1,0,1]=4 515 B16R1.849 COC(=O)CC(C)NCCN1CCCCC1 MCULE-7554755388 [0,1,0,1,0,0|2,0,0]=4 516 B16R2.148 COC(=O)[C@H]1CCCN1C2CCNCC2 MCULE-4856188507 [0,0,0,2,0,0|2,0,0]=4 517 B16R2.14939 O=C1NCCCCCCNC2C1CCC2 MCULE-8498917797 [0,0,0,2,0,0|2,0,0]=4 518 B16R2.14939 O=C1NCCCCCCN[C@@H]2[C@H]1CCC2 MCULE-9987782147 [0,0,0,2,0,0|2,0,0]=4 519 B16R2.1160 COC(=O)C1CCCCN1C2CCCC2 MCULE-3019586192 [0,0,0,2,0,0|1,0,0]=3 520 B16R2.134226 O=C1NCCCCCNC2C1CCCC2 MCULE-8985933671 [0,0,0,2,0,0|2,0,0]=4 521 B16R2.134226 O=C1NCCCCCN[C@@H]2[C@H]1CCCC2 MCULE-5866102251 [0,0,0,2,0,0|2,0,0]=4