0 B24R3.423483848 C[N+]1(C2CCC1CC(C2)OC(=O)C(CO)C3=CC=CC=C3)C MCULE-1521238572 [0,0,0,0,0,0|0,0,0]=0 1 B24R3.423483848 C[N+]1(C2CCC1CC(C2)OC(=O)C(CO)C3=CC=CC=C3)C MCULE-7044673430 [0,0,0,0,0,0|0,0,0]=0 2 B24R3.423483848 C[N+]1(C2CCC1CC(C2)OC(=O)C(CO)C3=CC=CC=C3)C MCULE-7662254879 [0,0,0,0,0,0|0,0,0]=0 3 B24R3.423483848 C[N+]1(C2CCC1CC(C2)OC(=O)C(CO)C3=CC=CC=C3)C MCULE-9236781222 [0,0,0,0,0,0|0,0,0]=0 4 B24R3.423483848 C[N+]1(C2CCC1CC(C2)OC(=O)C(CO)C3=CC=CC=C3)[O-] MCULE-2059959503 [0,0,0,0,0,0|1,0,0]=1 5 B24R3.423483848 C[N+]1(C2CCC1CC(C2)OC(=O)C(CO)C3=CC=CC=C3)[O-] MCULE-4838979914 [0,0,0,0,0,0|1,0,0]=1 6 B24R3.423483848 C[N+]1([C@H]2CC[C@@H]1CC(C2)OC(=O)C(CO)C3=CC=CC=C3)C MCULE-7979171950 [0,0,0,0,0,0|0,0,0]=0 7 B24R3.423483848 C[N+]1([C@H]2CC[C@@H]1CC(C2)OC(=O)C(CO)C3=CC=CC=C3)C MCULE-8761814750 [0,0,0,0,0,0|0,0,0]=0 8 B24R3.423483848 C[N+]1([C@H]2CC[C@@H]1CC(C2)OC(=O)C(CO)C3=CC=CC=C3)[O-] MCULE-8322649751 [0,0,0,0,0,0|1,0,0]=1 9 B24R3.423483848 C[N+]1([C@H]2CC[C@@H]1CC(C2)OC(=O)[C@@H](CO)C3=CC=CC=C3)C MCULE-6903192068 [0,0,0,0,0,0|0,0,0]=0 10 B24R3.423483848 C[N+]1([C@H]2CC[C@@H]1CC(C2)OC(=O)[C@@H](CO)C3=CC=CC=C3)C MCULE-9983946385 [0,0,0,0,0,0|0,0,0]=0 11 B24R3.423483848 C[N+]1([C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)C(CO)C3=CC=CC=C3)C MCULE-4092168775 [0,0,0,0,0,0|0,0,0]=0 12 B24R3.423483848 C[N+]1([C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)C(CO)C3=CC=CC=C3)C MCULE-5250866716 [0,0,0,0,0,0|0,0,0]=0 13 B24R3.423483848 C[N+]1([C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)C(CO)C3=CC=CC=C3)C MCULE-5369083465 [0,0,0,0,0,0|0,0,0]=0 14 B24R3.423483848 C[N+]1([C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)C(CO)C3=CC=CC=C3)C MCULE-5695060879 [0,0,0,0,0,0|0,0,0]=0 15 B24R3.423483848 C[N+]1([C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)C(CO)C3=CC=CC=C3)C MCULE-7396014010 [0,0,0,0,0,0|0,0,0]=0 16 B24R3.423483848 C[N+]1([C@H]2CC[C@@H]1C[C@H](C2)OC(=O)C(CO)C3=CC=CC=C3)C MCULE-4263994756 [0,0,0,0,0,0|0,0,0]=0 17 B24R3.423483848 C[N+]1([C@H]2CC[C@@H]1C[C@H](C2)OC(=O)C(CO)C3=CC=CC=C3)C MCULE-8349612160 [0,0,0,0,0,0|0,0,0]=0 18 B23R3.3261798 C1(CC2CCC(C1)N2C)OC(=O)[C@H](CO)C3=CC=CC=C3 MCULE-9178402819 [1,0,0,0,0,0|0,0,1]=2 19 B23R3.3261798 C12CCC([NH+]1C)CC(C2)OC(=O)C(CO)C3=CC=CC=C3 MCULE-2140948986 [1,0,0,0,0,0|0,0,0]=1 20 B23R3.3261798 CCC(C(=O)OC1CC2CCC(C1)N2C)C3=CC=CC=C3 MCULE-5782685780 [1,0,0,0,0,0|1,0,1]=3 21 B23R3.3261798 CCC(C(=O)OC1CC2CCC(C1)N2C)C3=CC=CC=C3 MCULE-9502913097 [1,0,0,0,0,0|1,0,1]=3 22 B23R3.3261798 CN1C2CCC1CC(C2)OC(=O)C(CO)C3=CC=CC=C3 MCULE-9094179165 [1,0,0,0,0,0|0,0,1]=2 23 B23R3.3261798 CN1C2CCC1CC(C2)OC(=O)C(CO)C3=CC=CC=C3 MCULE-9477832352 [1,0,0,0,0,0|0,0,1]=2 24 B23R3.3261798 CN1C2CCC1CC(C2)OC(=O)[C@H](CO)C3=CC=CC=C3 MCULE-1995972770 [1,0,0,0,0,0|0,0,1]=2 25 B23R3.3261798 CN1C2CCC1CC(C2)OC(=O)[C@H](CO)C3=CC=CC=C3 MCULE-6227272163 [1,0,0,0,0,0|0,0,1]=2 26 B23R3.3261798 CN1C2CCC1CC(C2)OC(=O)[C@H](CO)C3=CC=CC=C3 MCULE-7696375201 [1,0,0,0,0,0|0,0,1]=2 27 B23R3.3261798 CN1[C@H]2CC[C@@H]1CC(C2)OC(=O)C(CO)C3=CC=CC=C3 MCULE-2464043401 [1,0,0,0,0,0|0,0,1]=2 28 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[C@@H]12CC[C@@H](N1C)C[C@@H](C2)OC(=O)C(CO)C3=CC=CC=C3 MCULE-8634022491 [1,0,0,0,0,0|0,0,1]=2 38 B23R3.3261798 [C@H](CO)(C(=O)O[C@@H]1C[C@@H]2CC[C@H](C1)N2C)C3=CC=CC=C3 MCULE-1764209130 [1,0,0,0,0,0|0,0,1]=2 39 B23R3.19475724 C[N+]1(C2CCC1CC(C2)OC(=O)C(O)C3=CC=CC=C3)C MCULE-1966757857 [1,0,0,0,0,0|0,0,0]=1 40 B23R3.19475724 C[N+]1(C2CCC1CC(C2)OC(=O)C(O)C3=CC=CC=C3)C MCULE-4330080118 [1,0,0,0,0,0|0,0,0]=1 41 B23R3.19475724 C[N+]1([C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)C(O)C3=CC=CC=C3)C MCULE-2278006757 [1,0,0,0,0,0|0,0,0]=1 42 B23R3.19475724 C[N+]1([C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)C(O)C3=CC=CC=C3)C MCULE-2762308009 [1,0,0,0,0,0|0,0,0]=1 43 B23R3.19475724 C[N+]1([C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)C(O)C3=CC=CC=C3)C MCULE-5352177607 [1,0,0,0,0,0|0,0,0]=1 44 B23R3.19475724 C[N+]1([C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)C(O)C3=CC=CC=C3)C MCULE-8251315137 [1,0,0,0,0,0|0,0,0]=1 45 B23R3.19475724 C[N+]1([C@H]2CC[C@@H]1C[C@H](C2)OC(=O)C(O)C3=CC=CC=C3)C MCULE-5853408564 [1,0,0,0,0,0|0,0,0]=1 46 B23R3.19475724 C[N+]1([C@H]2CC[C@@H]1C[C@H](C2)OC(=O)C(O)C3=CC=CC=C3)C MCULE-6682798166 [1,0,0,0,0,0|0,0,0]=1 47 B25R3.393911431 C[N+]1(C2CC(CC1C(C2)O)OC(=O)C(CO)C3=CC=CC=C3)C MCULE-3451066591 [0,1,0,0,0,0|0,0,0]=1 48 B25R3.393911431 C[N+]1(C2CC(CC1C(C2)O)OC(=O)C(CO)C3=CC=CC=C3)C MCULE-5497893443 [0,1,0,0,0,0|0,0,0]=1 49 B22R3.375913 CN1C2CCC1CC(C2)OC(=O)C(O)C3=CC=CC=C3 MCULE-7109134658 [2,0,0,0,0,0|0,0,1]=3 50 B22R3.375913 CN1C2CCC1CC(C2)OC(=O)C(O)C3=CC=CC=C3 MCULE-8960409513 [2,0,0,0,0,0|0,0,1]=3 51 B22R3.375913 CN1C2CCC1CC(C2)OC(=O)C(O)C3=CC=CC=C3 MCULE-9922406047 [2,0,0,0,0,0|0,0,1]=3 52 B22R3.375913 CN1[C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)C(O)C3=CC=CC=C3 MCULE-1275068124 [2,0,0,0,0,0|0,0,1]=3 53 B22R3.375913 CN1[C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)C(O)C3=CC=CC=C3 MCULE-3595780804 [2,0,0,0,0,0|0,0,1]=3 54 B22R3.375913 CN1[C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)C(O)C3=CC=CC=C3 MCULE-6704779683 [2,0,0,0,0,0|0,0,1]=3 55 B22R3.375913 CN1[C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)C(O)C3=CC=CC=C3 MCULE-7405337835 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CN1C2C[C@@H](CC1[C@H](C2)O)OC(=O)[C@H](CO)C3=CC=CC=C3 MCULE-3237506333 [1,1,0,0,0,0|0,0,1]=3 66 B24R3.423483894 CN1C2C[C@@H](CC1[C@H](C2)O)OC(=O)[C@H](CO)C3=CC=CC=C3 MCULE-3755644767 [1,1,0,0,0,0|0,0,1]=3 67 B24R3.423483894 CN1[C@H]2C[C@@H](C[C@@H]1[C@H](C2)O)OC(=O)[C@H](CO)C3=CC=CC=C3 MCULE-4539230825 [1,1,0,0,0,0|0,0,1]=3 68 B24R3.423483894 CN1[C@H]2C[C@@H](C[C@@H]1[C@H](C2)O)OC(=O)[C@H](CO)C3=CC=CC=C3 MCULE-9631538545 [1,1,0,0,0,0|0,0,1]=3 69 B24R3.423483894 C[NH+]1C2CC(CC1C(C2)O)OC(=O)C(CO)C3=CC=CC=C3 MCULE-9174494260 [1,1,0,0,0,0|0,0,0]=2 70 B24R3.423483894 [C@@H]12C[C@@H](C[C@@H](N1C)[C@H](C2)O)OC(=O)[C@H](CO)C3=CC=CC=C3 MCULE-2186113389 [1,1,0,0,0,0|0,0,1]=3 71 B24R3.423483894 [C@H](CO)(C(=O)O[C@@H]1C[C@@H]2C[C@H]([C@H](C1)N2C)O)C3=CC=CC=C3 MCULE-2778105839 [1,1,0,0,0,0|0,0,1]=3 72 B24R3.423483894 [C@H](CO)(C(=O)O[C@@H]1C[C@@H]2C[C@H]([C@H](C1)N2C)O)C3=CC=CC=C3 MCULE-3161322920 [1,1,0,0,0,0|0,0,1]=3 73 B24R3.423483894 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[0,2,0,0,0,0|0,0,0]=2 82 B26R3.1212558624 CC(C)[N+]1([C@H]2CC[C@@H]1CC(C2)OC(=O)C(CO)C3=CC=CC=C3)C MCULE-1081843869 [0,2,0,0,0,0|0,0,0]=2 83 B26R3.1212558624 CC(C)[N+]1([C@H]2CC[C@@H]1CC(C2)OC(=O)C(CO)C3=CC=CC=C3)C MCULE-2233606184 [0,2,0,0,0,0|0,0,0]=2 84 B26R3.1212558624 CC(C)[N+]1([C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)C(CO)C3=CC=CC=C3)C MCULE-4938137351 [0,2,0,0,0,0|0,0,0]=2 85 B26R3.1212558624 CC(C)[N+]1([C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)C(CO)C3=CC=CC=C3)C MCULE-7518113023 [0,2,0,0,0,0|0,0,0]=2 86 B26R3.1212558624 CC(C)[N+]1([C@H]2CC[C@@H]1C[C@H](C2)OC(=O)C(CO)C3=CC=CC=C3)C MCULE-4120158249 [0,2,0,0,0,0|0,0,0]=2 87 B26R3.1212558624 CC(C)[N+]1([C@H]2CC[C@@H]1C[C@H](C2)OC(=O)C(CO)C3=CC=CC=C3)C MCULE-5337197642 [0,2,0,0,0,0|0,0,0]=2 88 B26R3.1212558624 CC(C)[N@+]1([C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)C(CO)C3=CC=CC=C3)C MCULE-7145384959 [0,2,0,0,0,0|0,0,0]=2 89 B26R3.1212558624 CC(C)[N@+]1([C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)C(CO)C3=CC=CC=C3)C MCULE-8593062695 [0,2,0,0,0,0|0,0,0]=2 90 B26R3.1212558624 [C@@H]12CC[C@@H]([N+]1(C)C(C)C)C[C@@H](C2)OC(=O)C(CO)C3=CC=CC=C3 MCULE-5739373075 [0,2,0,0,0,0|0,0,0]=2 91 B26R3.1212558624 [C@@H]12CC[C@@H]([N+]1(C)C(C)C)C[C@@H](C2)OC(=O)C(CO)C3=CC=CC=C3 MCULE-7375681433 [0,2,0,0,0,0|0,0,0]=2 92 B26R3.1212558878 CC[N+]1(C2CC(CC1C(C2)O)OC(=O)C(CO)C3=CC=CC=C3)C MCULE-4322140120 [0,2,0,0,0,0|0,0,0]=2 93 B26R3.1212558878 CC[N+]1(C2CC(CC1C(C2)O)OC(=O)C(CO)C3=CC=CC=C3)C MCULE-4946701713 [0,2,0,0,0,0|0,0,0]=2 94 B26R3.827781108 CCC(CO)(C(=O)OC1CC2CCC(C1)[N+]2(C)C)C3=CC=CC=C3 MCULE-4352645763 [0,2,0,0,0,0|0,0,0]=2 95 B26R3.827781108 CCC(CO)(C(=O)OC1CC2CCC(C1)[N+]2(C)C)C3=CC=CC=C3 MCULE-5598343768 [0,2,0,0,0,0|0,0,0]=2 96 B26R3.827781108 [C@@H]12CC[C@@H]([N+]1(C)C)C[C@@H](C2)OC(=O)C(CC)(CO)C3=CC=CC=C3 MCULE-4977727771 [0,2,0,0,0,0|0,0,0]=2 97 B26R3.827781108 [C@@H]12CC[C@@H]([N+]1(C)C)C[C@@H](C2)OC(=O)C(CC)(CO)C3=CC=CC=C3 MCULE-6315345864 [0,2,0,0,0,0|0,0,0]=2 98 B26R4.633963423 C[N+]1(C2CC(CC1C3C2O3)OC(=O)C(CO)C4=CC=CC=C4)C MCULE-4003028645 [0,0,0,1,0,1|0,0,0]=2 99 B26R4.633963423 C[N+]1(C2CC(CC1C3C2O3)OC(=O)C(CO)C4=CC=CC=C4)C MCULE-9148232132 [0,0,0,1,0,1|0,0,0]=2 100 B26R4.633963423 C[N+]1([C@H]2CC(C[C@@H]1[C@@H]3[C@H]2O3)OC(=O)[C@H](CO)C4=CC=CC=C4)[O-] MCULE-3778548269 [0,0,0,1,0,1|1,0,0]=3 101 B26R4.633963423 C[N+]1([C@H]2CC(C[C@@H]1[C@@H]3[C@H]2O3)OC(=O)[C@H](CO)C4=CC=CC=C4)[O-] MCULE-9189204513 [0,0,0,1,0,1|1,0,0]=3 102 B26R4.633963423 C[N+]1([C@H]2C[C@@H](C[C@@H]1[C@@H]3[C@H]2O3)OC(=O)[C@H](CO)C4=CC=CC=C4)C MCULE-2387598119 [0,0,0,1,0,1|0,0,0]=2 103 B26R4.633963423 C[N+]1([C@H]2C[C@@H](C[C@@H]1[C@@H]3[C@H]2O3)OC(=O)[C@H](CO)C4=CC=CC=C4)C MCULE-4842611277 [0,0,0,1,0,1|0,0,0]=2 104 B26R4.633963423 C[N+]1([C@H]2C[C@@H](C[C@@H]1[C@@H]3[C@H]2O3)OC(=O)[C@H](CO)C4=CC=CC=C4)C MCULE-7324716873 [0,0,0,1,0,1|0,0,0]=2 105 B26R4.633963423 [C@@H]12O[C@@H]1[C@H]3C[C@H](C[C@@H]2[N+]3(C)C)OC(=O)[C@H](CO)C4=CC=CC=C4 MCULE-1049895234 [0,0,0,1,0,1|0,0,0]=2 106 B24R3.4032016 CN1C2CCC(CC1CC2)OC(=O)C(CO)C3=CC=CC=C3 MCULE-1522379809 [1,0,0,0,0,1|0,0,1]=3 107 B24R3.31217222 CCC(SC1=CC=CC=C1)C(=O)OC2C[C@@H]3CC[C@H](C2)N3C MCULE-4928083985 [1,0,0,0,0,1|1,0,1]=4 108 B24R3.31217222 CCC(SC1=CC=CC=C1)C(=O)OC2C[C@@H]3CC[C@H](C2)N3C MCULE-6330191614 [1,0,0,0,0,1|1,0,1]=4