0 B9R0.56 C=C(Br)CCCC(C)(C)C MCULE-5139420207 [0,0,0,0,0,0|3,0,0]=3 1 B9R0.56 C=C(C)CCCC(C)(C)C MCULE-4242513604 [0,0,0,0,0,0|3,0,0]=3 2 B9R0.56 C=C(Cl)CCCC(C)(C)C MCULE-9600452003 [0,0,0,0,0,0|3,0,0]=3 3 B9R0.56 CC(=O)CCOC(C)(C)C MCULE-7564146395 [0,0,0,0,0,0|3,0,0]=3 4 B9R0.56 CC(=O)NCC[N+](C)(C)C MCULE-8496483723 [0,0,0,0,0,0|2,0,0]=2 5 B9R0.56 CC(=O)NCC[N+](C)(C)C MCULE-8521440659 [0,0,0,0,0,0|2,0,0]=2 6 B9R0.56 CC(=O)OCC[N+](C)(C)C MCULE-4295517590 [0,0,0,0,0,0|2,0,0]=2 7 B9R0.56 CC(=O)OCC[N+](C)(C)C MCULE-4407610890 [0,0,0,0,0,0|2,0,0]=2 8 B9R0.56 CC(=O)OCC[N+](C)(C)C MCULE-6461445841 [0,0,0,0,0,0|2,0,0]=2 9 B9R0.56 CC(=O)OCC[N+](C)(C)C MCULE-7765616505 [0,0,0,0,0,0|2,0,0]=2 10 B9R0.56 CC(=O)OCC[N+](C)(C)C MCULE-9336983715 [0,0,0,0,0,0|2,0,0]=2 11 B9R0.56 CC(=O)OCC[Si](C)(C)Cl MCULE-8932068563 [0,0,0,0,0,0|4,0,0]=4 12 B9R0.56 CC(=O)SCC[N+](C)(C)C MCULE-2411681405 [0,0,0,0,0,0|2,0,0]=2 13 B9R0.56 CC(=O)SCC[N+](C)(C)C MCULE-4617747505 [0,0,0,0,0,0|2,0,0]=2 14 B9R0.56 CC(=O)SCC[N+](C)(C)C MCULE-6838656617 [0,0,0,0,0,0|2,0,0]=2 15 B9R0.56 CC(=O)SCC[N+](C)(C)C MCULE-7762832237 [0,0,0,0,0,0|2,0,0]=2 16 B9R0.56 CC(=O)SCC[Si](C)(C)C MCULE-5870722900 [0,0,0,0,0,0|3,0,0]=3 17 B9R0.56 CC(C)(C)CCCC(=O)O MCULE-2659832762 [0,0,0,0,0,0|1,0,0]=1 18 B9R0.56 CC(C)(C)CNCC(=O)O MCULE-1268208354 [0,0,0,0,0,0|2,0,0]=2 19 B9R0.56 CC(C)(C)CNCC(=O)O MCULE-5430860345 [0,0,0,0,0,0|2,0,0]=2 20 B9R0.56 CC(C)(C)COCC(=O)Cl MCULE-1692426636 [0,0,0,0,0,0|3,0,0]=3 21 B9R0.56 CC(C)(C)NCCC(=O)N MCULE-5827810099 [0,0,0,0,0,0|3,0,0]=3 22 B9R0.56 CC(C)(C)OCCC(=O)O MCULE-2627981612 [0,0,0,0,0,0|2,0,0]=2 23 B9R0.56 CC(C)(C)SCCC(=O)O MCULE-3380271202 [0,0,0,0,0,0|2,0,0]=2 24 B9R0.56 CC(C)(N)COCC(=O)O MCULE-6736911202 [0,0,0,0,0,0|3,0,0]=3 25 B9R0.56 CS(=O)(=O)CCCC(=O)O MCULE-2515518184 [0,0,0,0,0,0|3,0,0]=3 26 B9R0.56 CS(=O)(=O)NCCC(=O)O MCULE-7823027792 [0,0,0,0,0,0|4,0,0]=4 27 B9R0.56 C[N+](C)(C)C/C=C\C(=O)[O-] MCULE-6215685987 [0,0,0,0,0,0|0,0,3]=3 28 B9R0.56 C[N+](C)(C)CCCC(=O)O MCULE-2639547018 [0,0,0,0,0,0|0,0,0]=0 29 B9R0.56 C[N+](C)(C)CCCC(=O)[O-] MCULE-4081752151 [0,0,0,0,0,0|0,0,1]=1 30 B9R0.56 C[N+](C)(C)CCNC(=[NH2+])N MCULE-2962817790 [0,0,0,0,0,0|3,0,0]=3 31 B9R0.56 C[N+](C)(C)CCNC(=[NH2+])N MCULE-3996881562 [0,0,0,0,0,0|3,0,0]=3 32 B9R0.56 C[N+](C)(C)CCOC(=O)N MCULE-5642570831 [0,0,0,0,0,0|2,0,0]=2 33 B9R0.56 C[N+](C)(C)CCOC(=O)N MCULE-9644162883 [0,0,0,0,0,0|2,0,0]=2 34 B9R0.56 C[N+](C)(C)CCSC(=[NH2+])N MCULE-1815112393 [0,0,0,0,0,0|3,0,0]=3 35 B9R0.56 C[N+](C)(C)CCSC(=[NH2+])N MCULE-7114533051 [0,0,0,0,0,0|3,0,0]=3 36 B9R0.56 C[N+](C)(C)NCCC(=O)[O-] MCULE-5927819751 [0,0,0,0,0,0|1,0,1]=2 37 B9R0.56 C[Si](C)(C)CCCC(=O)O MCULE-6750746548 [0,0,0,0,0,0|1,0,0]=1 38 B9R0.56 C[Si](C)(C)CCOC(=O)Cl MCULE-1008452969 [0,0,0,0,0,0|3,0,0]=3 39 B9R0.56 NS(=O)(=O)CCCC(=O)O MCULE-8548216682 [0,0,0,0,0,0|4,0,0]=4 40 B9R0.56 O=C(O)CCCC(F)(F)F MCULE-4498764296 [0,0,0,0,0,0|4,0,0]=4 41 B9R0.56 O=C(O)CCCP(=O)(O)O MCULE-9510971866 [0,0,0,0,0,0|3,1,0]=4 42 B8R0.21 C=CCCCC(C)(C)C MCULE-8091417826 [1,0,0,0,0,0|2,0,0]=3 43 B8R0.21 CC(C)(C)CCCCBr MCULE-3306918988 [1,0,0,0,0,0|2,0,1]=4 44 B8R0.21 CC(C)(C)CCCCN MCULE-4696814283 [1,0,0,0,0,0|2,0,1]=4 45 B8R0.21 CC(C)(C)CCCCO MCULE-6188842430 [1,0,0,0,0,0|1,0,1]=3 46 B8R0.21 CC(C)(C)CNCCO MCULE-3218044438 [1,0,0,0,0,0|2,0,1]=4 47 B8R0.21 CC(C)(C)NCCCO MCULE-5350891631 [1,0,0,0,0,0|2,0,1]=4 48 B8R0.21 CC(C)(C)NCCCO MCULE-6255503510 [1,0,0,0,0,0|2,0,1]=4 49 B8R0.21 CC(C)(C)OCCCO MCULE-9923433921 [1,0,0,0,0,0|2,0,1]=4 50 B8R0.21 CC(C)(C)SCCCO MCULE-2353391810 [1,0,0,0,0,0|2,0,1]=4 51 B8R0.21 CC(C)(O)CCCCO MCULE-2749019232 [1,0,0,0,0,0|2,0,1]=4 52 B8R0.21 CC(C)(S)CCOC=O MCULE-5575032713 [1,0,0,0,0,0|3,0,0]=4 53 B8R0.21 CCCCCC(C)(C)C MCULE-4223197735 [1,0,0,0,0,0|2,0,1]=4 54 B8R0.21 CNCCCC(C)(C)C MCULE-5292331415 [1,0,0,0,0,0|3,0,0]=4 55 B8R0.21 CNCCCC(C)(C)C MCULE-7104440465 [1,0,0,0,0,0|3,0,0]=4 56 B8R0.21 C[N+](C)(C)CCCCN MCULE-2482234407 [1,0,0,0,0,0|1,0,1]=3 57 B8R0.21 C[N+](C)(C)CCCCN MCULE-7843905367 [1,0,0,0,0,0|1,0,1]=3 58 B8R0.21 C[N+](C)(C)CCNC=O MCULE-2444996406 [1,0,0,0,0,0|1,0,0]=2 59 B8R0.21 C[N+](C)(C)CCNC=O MCULE-5608803399 [1,0,0,0,0,0|1,0,0]=2 60 B8R0.21 C[Si](C)(C)CCCC#N MCULE-9039946637 [1,0,0,0,0,0|2,0,1]=4 61 B8R0.21 C[Si](C)(C)CCCCO MCULE-3464039288 [1,0,0,0,0,0|1,0,1]=3 62 B8R0.28 C=C(Br)CCCC(=O)O MCULE-5394609034 [1,0,0,0,0,0|2,0,1]=4 63 B8R0.28 C=C(C)CCCC(=O)O MCULE-1282031449 [1,0,0,0,0,0|1,0,1]=3 64 B8R0.28 C=C(C)CCCC(C)C MCULE-5830488183 [1,0,0,0,0,0|3,0,0]=4 65 B8R0.28 C=C(Cl)CCCC(=O)O MCULE-9525654231 [1,0,0,0,0,0|2,0,1]=4 66 B8R0.28 CC(=CCCC(=O)O)C MCULE-5848388333 [1,0,0,0,0,0|1,0,1]=3 67 B8R0.28 CC(=O)CCC=C(C)C MCULE-3832720881 [1,0,0,0,0,0|2,0,1]=4 68 B8R0.28 CC(=O)CCCC(=O)C MCULE-9250637004 [1,0,0,0,0,0|3,0,0]=4 69 B8R0.28 CC(=O)CCCC(=O)N MCULE-8753142022 [1,0,0,0,0,0|3,0,0]=4 70 B8R0.28 CC(=O)CCCC(=O)O MCULE-2498129200 [1,0,0,0,0,0|2,0,0]=3 71 B8R0.28 CC(=O)CCCC(C)C MCULE-7256575819 [1,0,0,0,0,0|2,0,0]=3 72 B8R0.28 CC(=O)CCCN(C)C MCULE-8876627134 [1,0,0,0,0,0|1,0,1]=3 73 B8R0.28 CC(=O)CCOC(C)C MCULE-5907441510 [1,0,0,0,0,0|3,0,0]=4 74 B8R0.28 CC(=O)CNCC(C)C MCULE-3943786157 [1,0,0,0,0,0|3,0,0]=4 75 B8R0.28 CC(=O)CNCC(C)C MCULE-9329085422 [1,0,0,0,0,0|3,0,0]=4 76 B8R0.28 CC(=O)CSCC(C)C MCULE-1710631404 [1,0,0,0,0,0|3,0,0]=4 77 B8R0.28 CC(=O)NCCC(=O)O MCULE-8867286578 [1,0,0,0,0,0|3,0,0]=4 78 B8R0.28 CC(=O)NCCC(C)C MCULE-7572826846 [1,0,0,0,0,0|3,0,0]=4 79 B8R0.28 CC(=O)OCCC(=O)O MCULE-6617841906 [1,0,0,0,0,0|3,0,0]=4 80 B8R0.28 CC(=O)OCCC(C)C MCULE-3274854886 [1,0,0,0,0,0|3,0,0]=4 81 B8R0.28 CC(=O)OCCN(C)C MCULE-2915953466 [1,0,0,0,0,0|2,0,1]=4 82 B8R0.28 CC(=O)SCCC(=O)O MCULE-2263963171 [1,0,0,0,0,0|3,0,0]=4 83 B8R0.28 CC(C)/C=C/CC(=O)O MCULE-6288178603 [1,0,0,0,0,0|1,0,2]=4 84 B8R0.28 CC(C)C=CCC(=O)O MCULE-1057297040 [1,0,0,0,0,0|1,0,2]=4 85 B8R0.28 CC(C)CC=CC(=O)O MCULE-4966710694 [1,0,0,0,0,0|1,0,2]=4 86 B8R0.28 CC(C)CCCC(=O)O MCULE-3645348479 [1,0,0,0,0,0|1,0,0]=2 87 B8R0.28 CC(C)CCCC(C)O MCULE-6655675430 [1,0,0,0,0,0|2,0,1]=4 88 B8R0.28 CC(C)CCCN(=O)=O MCULE-2817926193 [1,0,0,0,0,0|2,0,1]=4 89 B8R0.28 CC(C)CCNC(=O)N MCULE-7857218878 [1,0,0,0,0,0|3,0,0]=4 90 B8R0.28 CC(C)CCOC(=O)Cl MCULE-1140125816 [1,0,0,0,0,0|3,0,0]=4 91 B8R0.28 CC(C)CNCC(=O)N MCULE-6834225327 [1,0,0,0,0,0|3,0,0]=4 92 B8R0.28 CC(C)CNCC(=O)N MCULE-8464570977 [1,0,0,0,0,0|3,0,0]=4 93 B8R0.28 CC(C)CNCC(=O)O MCULE-4695293444 [1,0,0,0,0,0|2,0,0]=3 94 B8R0.28 CC(C)CNCC(=O)O MCULE-9936739681 [1,0,0,0,0,0|2,0,0]=3 95 B8R0.28 CC(C)COCC(=O)N MCULE-8148336060 [1,0,0,0,0,0|3,0,0]=4 96 B8R0.28 CC(C)COCC(=O)O MCULE-8643896966 [1,0,0,0,0,0|2,0,0]=3 97 B8R0.28 CC(C)CSCC(=O)O MCULE-5182400762 [1,0,0,0,0,0|2,0,0]=3 98 B8R0.28 CC(C)NCCC(=O)N MCULE-4812986605 [1,0,0,0,0,0|3,0,0]=4 99 B8R0.28 CC(C)NCCC(=O)O MCULE-2087792459 [1,0,0,0,0,0|2,0,0]=3 100 B8R0.28 CC(C)NCCC(=O)O MCULE-6893587807 [1,0,0,0,0,0|2,0,0]=3 101 B8R0.28 CC(C)OCCC(=O)O MCULE-6533666992 [1,0,0,0,0,0|2,0,0]=3 102 B8R0.28 CC(C)SCCC(=O)O MCULE-1434094352 [1,0,0,0,0,0|2,0,0]=3 103 B8R0.28 CC(Cl)CCCC(=O)Cl MCULE-6993455396 [1,0,0,0,0,0|3,0,0]=4 104 B8R0.28 CC(O)CCCC(=O)O MCULE-6696855762 [1,0,0,0,0,0|2,0,0]=3 105 B8R0.28 CC(O)CCCC(=O)[O-] MCULE-7722587632 [1,0,0,0,0,0|2,0,1]=4 106 B8R0.28 CN(C)C/C=C/C(=O)O MCULE-2726508724 [1,0,0,0,0,0|0,0,3]=4 107 B8R0.28 CN(C)C/C=C/C(=O)O MCULE-2945466855 [1,0,0,0,0,0|0,0,3]=4 108 B8R0.28 CN(C)CC#CC(=O)O MCULE-3155038032 [1,0,0,0,0,0|0,0,3]=4 109 B8R0.28 CN(C)CC#CC(=O)O MCULE-3234500613 [1,0,0,0,0,0|0,0,3]=4 110 B8R0.28 CN(C)CC=CC(=O)O MCULE-5265576987 [1,0,0,0,0,0|0,0,3]=4 111 B8R0.28 CN(C)CC=CC(=O)O MCULE-6262530852 [1,0,0,0,0,0|0,0,3]=4 112 B8R0.28 CN(C)CCCC(=O)Cl MCULE-4211417336 [1,0,0,0,0,0|1,0,1]=3 113 B8R0.28 CN(C)CCCC(=O)Cl MCULE-6854328742 [1,0,0,0,0,0|1,0,1]=3 114 B8R0.28 CN(C)CCCC(=O)O MCULE-5562283434 [1,0,0,0,0,0|0,0,1]=2 115 B8R0.28 CN(C)CCCC(=O)O MCULE-5657963851 [1,0,0,0,0,0|0,0,1]=2 116 B8R0.28 CN(C)CCNC(=O)N MCULE-5420989663 [1,0,0,0,0,0|2,0,1]=4 117 B8R0.28 CN(C)CCNC(=O)N MCULE-6784836791 [1,0,0,0,0,0|2,0,1]=4 118 B8R0.28 NC(=O)CCCC(=O)O MCULE-9714346244 [1,0,0,0,0,0|3,0,0]=4 119 B8R0.28 O=C(O)CCCC(=O)O MCULE-4286022994 [1,0,0,0,0,0|3,0,0]=4 120 B8R0.28 O=C(O)CCCC(F)F MCULE-1906281877 [1,0,0,0,0,0|3,0,0]=4 121 B8R0.28 O=C(O)CCCN(=O)=O MCULE-2601801792 [1,0,0,0,0,0|2,0,1]=4 122 B10R0.12 CC(C)(C)C(=O)CCC(=O)O MCULE-4165319809 [0,1,0,0,0,0|1,0,1]=3 123 B10R0.12 CC(C)(C)C(=O)NCC(=O)O MCULE-9533520941 [0,1,0,0,0,0|2,0,1]=4 124 B10R0.12 CC(C)(C)C(Cl)CCC(=O)Cl MCULE-9820825868 [0,1,0,0,0,0|2,0,0]=3 125 B10R0.12 CC(C)(C)S(=O)CCC(=O)O MCULE-3865170112 [0,1,0,0,0,0|2,0,0]=3 126 B10R0.31 C(O)(CC(=O)O)C[N+](C)(C)C MCULE-1943868159 [0,1,0,0,0,0|0,0,0]=1 127 B10R0.31 C(O)(CC(=O)[O-])C[N+](C)(C)C MCULE-6179607288 [0,1,0,0,0,0|0,0,1]=2 128 B10R0.31 CC(=O)CC(C)CC(C)(C)C MCULE-9082084348 [0,1,0,0,0,0|2,0,0]=3 129 B10R0.31 CC(=O)OC(C)C[N+](C)(C)C MCULE-3342474130 [0,1,0,0,0,0|2,0,0]=3 130 B10R0.31 CC(=O)OC(C)C[N+](C)(C)C MCULE-6246299571 [0,1,0,0,0,0|2,0,0]=3 131 B10R0.31 CC(=O)OC(C)C[N+](C)(C)C MCULE-8410768394 [0,1,0,0,0,0|2,0,0]=3 132 B10R0.31 CC(C)(C)CC(N)CC(=O)O MCULE-6200056500 [0,1,0,0,0,0|1,0,0]=2 133 B10R0.31 CC(C)(C)CC(N)CC(=O)O MCULE-8474644246 [0,1,0,0,0,0|1,0,0]=2 134 B10R0.31 CC(C)(C)CC(O)CC(=O)O MCULE-2681590744 [0,1,0,0,0,0|1,0,0]=2 135 B10R0.31 CC(C)(C)C[C@H](N)CC(=O)O MCULE-4145699901 [0,1,0,0,0,0|1,0,0]=2 136 B10R0.31 CC(C)(C)OC(=O)CC(=O)O MCULE-2439488581 [0,1,0,0,0,0|2,0,1]=4 137 B10R0.31 CC(CC(=O)Cl)CC(C)(C)C MCULE-1318704435 [0,1,0,0,0,0|2,0,0]=3 138 B10R0.31 CC(CC(=O)N)CC(C)(C)C MCULE-2949303662 [0,1,0,0,0,0|2,0,0]=3 139 B10R0.31 CC(CC(=O)O)CC(C)(C)C MCULE-6835808948 [0,1,0,0,0,0|1,0,0]=2 140 B10R0.31 CC(C[N+](C)(C)C)OC(=N)[O-] MCULE-4959115853 [0,1,0,0,0,0|2,0,1]=4 141 B10R0.31 CC(C[N+](C)(C)C)OC(=O)N MCULE-3425585639 [0,1,0,0,0,0|2,0,0]=3 142 B10R0.31 CN(CC(=O)O)CC(C)(C)C MCULE-2314044769 [0,1,0,0,0,0|2,0,0]=3 143 B10R0.31 CN(CC(=O)O)CC(C)(C)C MCULE-2348805903 [0,1,0,0,0,0|2,0,0]=3 144 B10R0.31 C[C@@H](C[N+](C)(C)C)OC(=O)N MCULE-1662441506 [0,1,0,0,0,0|2,0,0]=3 145 B10R0.31 C[C@@H](C[N+](C)(C)C)OC(=O)N MCULE-5191975275 [0,1,0,0,0,0|2,0,0]=3 146 B10R0.31 C[C@H](C[N+](C)(C)C)OC(=O)N MCULE-6417112913 [0,1,0,0,0,0|2,0,0]=3 147 B10R0.31 C[C@H](C[N+](C)(C)C)OC(=O)N MCULE-6597981085 [0,1,0,0,0,0|2,0,0]=3 148 B10R0.31 C[N+](C)(C)CC(O)CC(=O)O MCULE-9799777407 [0,1,0,0,0,0|0,0,0]=1 149 B10R0.31 C[N+](C)(C)CC(O)CC(=O)[O-] MCULE-4215013152 [0,1,0,0,0,0|0,0,1]=2 150 B10R0.31 C[N+](C)(C)CC(O)CC(=O)[O-] MCULE-6432281267 [0,1,0,0,0,0|0,0,1]=2 151 B10R0.31 C[N+](C)(C)C[C@@H](O)CC(=O)O MCULE-6301932098 [0,1,0,0,0,0|0,0,0]=1 152 B10R0.31 C[N+](C)(C)C[C@@H](O)CC(=O)O MCULE-6758278502 [0,1,0,0,0,0|0,0,0]=1 153 B10R0.31 C[N+](C)(C)C[C@@H](O)CC(=O)[O-] MCULE-3915866279 [0,1,0,0,0,0|0,0,1]=2 154 B10R0.31 C[N+](C)(C)C[C@@H](O)CC(=O)[O-] MCULE-4950238841 [0,1,0,0,0,0|0,0,1]=2 155 B10R0.31 C[N+](C)(C)C[C@@H](O)CC(=O)[O-] MCULE-8431671488 [0,1,0,0,0,0|0,0,1]=2 156 B10R0.31 C[N+](C)(C)C[C@H](N)CC(=O)[O-] MCULE-3388545789 [0,1,0,0,0,0|0,0,1]=2 157 B10R0.31 C[N+](C)(C)C[C@H](N)CC(=O)[O-] MCULE-6702045523 [0,1,0,0,0,0|0,0,1]=2 158 B10R0.31 C[N+](C)(C)C[C@H](O)CC(=O)O MCULE-4113750610 [0,1,0,0,0,0|0,0,0]=1 159 B10R0.31 C[N+](C)(C)C[C@H](O)CC(=O)O MCULE-4318855847 [0,1,0,0,0,0|0,0,0]=1 160 B10R0.31 C[N+](C)(C)C[C@H](O)CC(=O)O MCULE-5320163057 [0,1,0,0,0,0|0,0,0]=1 161 B10R0.31 C[N+](C)(C)C[C@H](O)CC(=O)O MCULE-6774081051 [0,1,0,0,0,0|0,0,0]=1 162 B10R0.31 C[N+](C)(C)C[C@H](O)CC(=O)O MCULE-7974436035 [0,1,0,0,0,0|0,0,0]=1 163 B10R0.31 C[N+](C)(C)C[C@H](O)CC(=O)O MCULE-8897088367 [0,1,0,0,0,0|0,0,0]=1 164 B10R0.31 C[N+](C)(C)C[C@H](O)CC(=O)[O-] MCULE-1032244867 [0,1,0,0,0,0|0,0,1]=2 165 B10R0.31 C[N+](C)(C)C[C@H](O)CC(=O)[O-] MCULE-8136306463 [0,1,0,0,0,0|0,0,1]=2 166 B10R0.31 C[N+](C)(C)C[C@H](O)CC(=O)[O-] MCULE-9434451542 [0,1,0,0,0,0|0,0,1]=2 167 B10R0.60 C=CC(=O)OCC[N+](C)(C)C MCULE-6271573439 [0,1,0,0,0,0|2,0,0]=3 168 B10R0.60 C=CC(=O)OCC[N+](C)(C)C MCULE-9847015860 [0,1,0,0,0,0|2,0,0]=3 169 B10R0.60 CC(C)(C)CCNC(=O)CCl MCULE-7708571812 [0,1,0,0,0,0|3,0,0]=4 170 B10R0.60 CC(C)(C)NCCC(=O)NN MCULE-9179899816 [0,1,0,0,0,0|3,0,0]=4 171 B10R0.60 CCC(=O)OCC[N+](C)(C)C MCULE-6521370136 [0,1,0,0,0,0|2,0,0]=3 172 B10R0.60 CCC(=O)OCC[N+](C)(C)C MCULE-7044709441 [0,1,0,0,0,0|2,0,0]=3 173 B10R0.60 CCC(=O)SCC[N+](C)(C)C MCULE-2683955467 [0,1,0,0,0,0|2,0,0]=3 174 B10R0.60 CCC(=O)SCC[N+](C)(C)C MCULE-6669741142 [0,1,0,0,0,0|2,0,0]=3 175 B10R0.60 CNC(=O)CCNC(C)(C)C MCULE-4169746192 [0,1,0,0,0,0|3,0,0]=4 176 B10R0.60 COC(=O)CC#C[Si](C)(C)C MCULE-7414534267 [0,1,0,0,0,0|1,0,2]=4 177 B10R0.60 COC(=O)CCCS(=O)(=O)C MCULE-4049393420 [0,1,0,0,0,0|3,0,0]=4 178 B10R0.60 COC(=O)CCC[N+](C)(C)C MCULE-1742884419 [0,1,0,0,0,0|0,0,0]=1 179 B10R0.60 COC(=O)CCC[N+](C)(C)C MCULE-7352462914 [0,1,0,0,0,0|0,0,0]=1 180 B10R0.60 COC(=O)CCNC(C)(C)C MCULE-7402004140 [0,1,0,0,0,0|2,0,0]=3 181 B10R0.60 COC(=O)CCNC(C)(C)C MCULE-9744254368 [0,1,0,0,0,0|2,0,0]=3 182 B10R0.60 COC(=O)CCN[N+](C)(C)C MCULE-1995785484 [0,1,0,0,0,0|1,0,0]=2 183 B10R0.60 COC(=O)CCN[N+](C)(C)C MCULE-2669664445 [0,1,0,0,0,0|1,0,0]=2 184 B10R0.60 COC(=O)CCN[N+](C)(C)C MCULE-6776208805 [0,1,0,0,0,0|1,0,0]=2 185 B10R0.60 C[N+](C)(C)CCOC(=O)CBr MCULE-5291465183 [0,1,0,0,0,0|2,0,0]=3 186 B10R0.60 C[N+](C)(C)CCOC(=O)CBr MCULE-6766438834 [0,1,0,0,0,0|2,0,0]=3 187 B10R0.60 C[Si](C)(C)CCOC(=O)NN MCULE-3361707261 [0,1,0,0,0,0|3,0,0]=4 188 B10R0.65 CCC(C)(C)CCCC(=O)O MCULE-9915000352 [0,1,0,0,0,0|1,0,0]=2 189 B10R0.65 CC[N+](C)(C)CCSC(=O)C MCULE-7031890998 [0,1,0,0,0,0|2,0,0]=3 190 B10R0.65 CC[N+](C)(C)CCSC(=O)C MCULE-7170620279 [0,1,0,0,0,0|2,0,0]=3 191 B10R0.65 CNS(=O)(=O)CCCC(=O)O MCULE-3412957806 [0,1,0,0,0,0|3,0,0]=4 192 B10R0.65 COC(C)(C)CCOC(=O)C MCULE-7497422142 [0,1,0,0,0,0|3,0,0]=4 193 B10R0.65 COC(C)(C)CNCC(=O)N MCULE-4702914438 [0,1,0,0,0,0|3,0,0]=4 194 B10R0.65 COC(C)(C)CNCC(=O)O MCULE-5956151819 [0,1,0,0,0,0|2,0,0]=3 195 B10R0.92 CC(=O)C(C)CNC(C)(C)C MCULE-1776116537 [0,1,0,0,0,0|3,0,0]=4 196 B10R0.92 CC(=O)C(C)CNC(C)(C)C MCULE-8238218694 [0,1,0,0,0,0|3,0,0]=4 197 B10R0.92 CC(C)(C)CCC(=O)C(=O)O MCULE-9335475635 [0,1,0,0,0,0|1,0,1]=3 198 B10R0.92 CC(C)(C)CCC(N)C(=O)N MCULE-1396813261 [0,1,0,0,0,0|2,0,0]=3 199 B10R0.92 CC(C)(C)CCC(N)C(=O)N MCULE-2019136789 [0,1,0,0,0,0|2,0,0]=3 200 B10R0.92 CC(C)(C)CCC(N)C(=O)O MCULE-5001409958 [0,1,0,0,0,0|1,0,0]=2 201 B10R0.92 CC(C)(C)CCC(N)C(=O)O MCULE-7547332237 [0,1,0,0,0,0|1,0,0]=2 202 B10R0.92 CC(C)(C)CC[C@@H](N)C(=O)O MCULE-3569540908 [0,1,0,0,0,0|1,0,0]=2 203 B10R0.92 CC(C)(C)CC[C@@H](N)C(=O)O MCULE-9483102958 [0,1,0,0,0,0|1,0,0]=2 204 B10R0.92 CC(C)(C)CC[C@H](N)C(=O)O MCULE-5183011899 [0,1,0,0,0,0|1,0,0]=2 205 B10R0.92 CC(C)(C)CC[C@H](N)C(=O)O MCULE-8076963991 [0,1,0,0,0,0|1,0,0]=2 206 B10R0.92 CC(C)(C)OCC(N)C(=O)N MCULE-9645045737 [0,1,0,0,0,0|3,0,0]=4 207 B10R0.92 CC(C)(C)OCC(N)C(=O)O MCULE-6462898252 [0,1,0,0,0,0|2,0,0]=3 208 B10R0.92 CC(C)(C)OCC(N)C(=O)O MCULE-9631494633 [0,1,0,0,0,0|2,0,0]=3 209 B10R0.92 CC(C)(C)OCC(O)C(=O)O MCULE-6418183642 [0,1,0,0,0,0|2,0,0]=3 210 B10R0.92 CC(C)(C)OCC(O)C(=O)O MCULE-9686572497 [0,1,0,0,0,0|2,0,0]=3 211 B10R0.92 CC(C)(C)OC[C@@H](Br)C(=O)O MCULE-2298892819 [0,1,0,0,0,0|2,0,0]=3 212 B10R0.92 CC(C)(C)OC[C@@H](N)C(=O)O MCULE-7410607527 [0,1,0,0,0,0|2,0,0]=3 213 B10R0.92 CC(C)(C)OC[C@@H](O)C(=O)O MCULE-4301712117 [0,1,0,0,0,0|2,0,0]=3 214 B10R0.92 CC(C)(C)OC[C@H](N)C(=O)N MCULE-2757362095 [0,1,0,0,0,0|3,0,0]=4 215 B10R0.92 CC(C)(C)OC[C@H](N)C(=O)N MCULE-7385946163 [0,1,0,0,0,0|3,0,0]=4 216 B10R0.92 CC(C)(C)OC[C@H](N)C(=O)O MCULE-2266340915 [0,1,0,0,0,0|2,0,0]=3 217 B10R0.92 CC(C)(C)OC[C@H](O)C(=O)O MCULE-2235537052 [0,1,0,0,0,0|2,0,0]=3 218 B10R0.92 CC(C)(C)OC[C@H](O)C(=O)O MCULE-5717525131 [0,1,0,0,0,0|2,0,0]=3 219 B10R0.92 CC(C)(C)SCC(N)C(=O)O MCULE-1079539613 [0,1,0,0,0,0|2,0,0]=3 220 B10R0.92 CC(C)(C)SCC(N)C(=O)O MCULE-1875135296 [0,1,0,0,0,0|2,0,0]=3 221 B10R0.92 CC(C)(C)SCC(N)C(=O)O MCULE-4865346205 [0,1,0,0,0,0|2,0,0]=3 222 B10R0.92 CC(C)(C)SCC(N)C(=O)O MCULE-6481407686 [0,1,0,0,0,0|2,0,0]=3 223 B10R0.92 CC(C)(C)SC[C@@H](N)C(=O)O MCULE-3014422223 [0,1,0,0,0,0|2,0,0]=3 224 B10R0.92 CC(C)(C)SC[C@@H](N)C(=O)O MCULE-5459211848 [0,1,0,0,0,0|2,0,0]=3 225 B10R0.92 CC(C)(C)SC[C@@H](N)C(=O)O MCULE-6410708740 [0,1,0,0,0,0|2,0,0]=3 226 B10R0.92 CC(C)(C)SC[C@@H](N)C(=O)O MCULE-7812994900 [0,1,0,0,0,0|2,0,0]=3 227 B10R0.92 CC(C)(C)SC[C@H](N)C(=O)O MCULE-1228858016 [0,1,0,0,0,0|2,0,0]=3 228 B10R0.92 CC(C)(C)SC[C@H](N)C(=O)O MCULE-6674296625 [0,1,0,0,0,0|2,0,0]=3 229 B10R0.92 CC(C)(C)SC[C@H](N)C(=O)O MCULE-8460687095 [0,1,0,0,0,0|2,0,0]=3 230 B10R0.92 CC(CCC(C)(C)C)C(=O)O MCULE-1597063738 [0,1,0,0,0,0|1,0,0]=2 231 B10R0.92 CP(=O)(O)CCC(N)C(=O)O MCULE-1038057082 [0,1,0,0,0,0|2,1,0]=4 232 B10R0.92 CP(=O)(O)CCC(N)C(=O)O MCULE-7761179555 [0,1,0,0,0,0|2,1,0]=4 233 B10R0.92 CS(=N)(=O)CCC(N)C(=O)O MCULE-2268954465 [0,1,0,0,0,0|3,0,0]=4 234 B10R0.92 CS(=N)(=O)CCC(N)C(=O)O MCULE-2804558075 [0,1,0,0,0,0|3,0,0]=4 235 B10R0.92 CS(=N)(=O)CCC(N)C(=O)O MCULE-7485004955 [0,1,0,0,0,0|3,0,0]=4 236 B10R0.92 CS(=N)(=O)CC[C@@H](N)C(=O)O MCULE-3997574746 [0,1,0,0,0,0|3,0,0]=4 237 B10R0.92 CS(=N)(=O)CC[C@H](N)C(=O)O MCULE-1068341907 [0,1,0,0,0,0|3,0,0]=4 238 B10R0.92 CS(=N)(=O)CC[C@H](N)C(=O)O MCULE-3093123817 [0,1,0,0,0,0|3,0,0]=4 239 B10R0.92 CS(=O)(=O)CCC(N)C(=O)O MCULE-8107053430 [0,1,0,0,0,0|3,0,0]=4 240 B10R0.92 CS(=O)(=O)CC[C@@H](N)C(=O)O MCULE-1126326759 [0,1,0,0,0,0|3,0,0]=4 241 B10R0.92 CS(=O)(=O)CC[C@@H](N)C(=O)O MCULE-3558725435 [0,1,0,0,0,0|3,0,0]=4 242 B10R0.92 CS(=O)(=O)CC[C@H](N)C(=O)O MCULE-2269540933 [0,1,0,0,0,0|3,0,0]=4 243 B10R0.92 CS(=O)(=O)CC[C@H](N)C(=O)O MCULE-4203364916 [0,1,0,0,0,0|3,0,0]=4 244 B10R0.92 [C@@H](N)(COC(C)(C)C)C(=O)O MCULE-5796384472 [0,1,0,0,0,0|2,0,0]=3 245 B10R0.92 [C@H](N)(COC(C)(C)C)C(=O)O MCULE-4480261753 [0,1,0,0,0,0|2,0,0]=3 246 B10R0.92 [C@H](N)(CSC(C)(C)C)C(=O)O MCULE-7444858381 [0,1,0,0,0,0|2,0,0]=3 247 B10R0.113 CC(C)(C)CCCS(=O)(=O)Cl MCULE-5672805621 [0,1,0,0,0,0|2,0,1]=4 248 B10R0.113 C[N+](C)(C)CCOP(=O)(O)O MCULE-4948470790 [0,1,0,0,0,0|2,0,0]=3 249 B10R0.113 C[N+](C)(C)CCOP(=O)([O-])O MCULE-7929311134 [0,1,0,0,0,0|2,0,0]=3 250 B10R0.113 C[N+](C)(C)CCOP(=O)([O-])[O-] MCULE-2631729554 [0,1,0,0,0,0|2,0,1]=4 251 B10R0.113 C[N+](C)(C)CCOP(=O)([O-])[O-] MCULE-4619388168 [0,1,0,0,0,0|2,0,1]=4 252 B10R0.113 C[N+](C)(C)CCOS(=O)(=O)[O-] MCULE-4448648798 [0,1,0,0,0,0|2,0,1]=4 253 B10R0.113 C[Si](C)(C)CCCS(=O)(=O)Cl MCULE-5926555250 [0,1,0,0,0,0|2,0,1]=4 254 B10R0.113 C[Si](C)(C)CCCS(=O)(=O)O MCULE-3103801898 [0,1,0,0,0,0|2,0,0]=3 255 B10R0.113 C[Si](C)(C)CCCS(=O)(=O)[O-] MCULE-5960892048 [0,1,0,0,0,0|2,0,1]=4 256 B10R1.55 CC(C)(C)C1CC(=O)CS1 MCULE-6635271543 [0,0,0,1,0,0|3,0,0]=4 257 B10R1.55 CC(C)(C)C1CCC(=O)C1 MCULE-7501158360 [0,0,0,1,0,0|2,0,0]=3 258 B10R1.55 CC(C)(C)C1CNC(=O)C1 MCULE-7283554407 [0,0,0,1,0,0|3,0,0]=4 259 B10R1.55 CC(C)(C)C1COC(=O)N1 MCULE-3263168022 [0,0,0,1,0,0|3,0,0]=4 260 B10R1.55 CC(C)(C)N1CCC(=O)C1 MCULE-7572742998 [0,0,0,1,0,0|3,0,0]=4 261 B10R1.55 CC(C)(C)N1CCC(=O)C1 MCULE-9893689905 [0,0,0,1,0,0|3,0,0]=4 262 B10R1.55 CC(C)(C)[C@@H]1CCC(=O)C1 MCULE-1622093899 [0,0,0,1,0,0|2,0,0]=3 263 B10R1.55 CC(C)(C)[C@@H]1COC(=O)N1 MCULE-3280533205 [0,0,0,1,0,0|3,0,0]=4 264 B10R1.55 CC(C)(C)[C@@H]1COC(=O)N1 MCULE-7533322020 [0,0,0,1,0,0|3,0,0]=4 265 B10R1.55 CC(C)(C)[C@H]1CCC(=O)C1 MCULE-9469597762 [0,0,0,1,0,0|2,0,0]=3 266 B10R1.55 CC(C)(C)[C@H]1COC(=O)N1 MCULE-3742807975 [0,0,0,1,0,0|3,0,0]=4 267 B10R1.55 CC(C)(C)[C@H]1COC(=O)N1 MCULE-8124730338 [0,0,0,1,0,0|3,0,0]=4 268 B10R1.112 CC(C)(C)OC1CC(=O)C1 MCULE-1533568902 [0,0,0,1,0,0|3,0,0]=4 269 B10R1.210 C[N+](C)(C)CCCC1CC1 MCULE-5173099091 [0,0,0,1,0,0|2,0,1]=4 270 B10R1.210 C[N+](C)(C)CCCC1CC1 MCULE-7102481173 [0,0,0,1,0,0|2,0,1]=4 271 B10R1.302 CC1(CCCC(=O)CC1)C MCULE-5213760827 [0,0,0,1,0,0|2,0,0]=3 272 B10R1.302 CC1(CCNC(=O)CC1)C MCULE-9357411612 [0,0,0,1,0,0|3,0,0]=4 273 B10R1.302 CC1(CCOC(=O)CC1)C MCULE-9905478886 [0,0,0,1,0,0|3,0,0]=4 274 B10R1.347 CC(C)(C)[C@@H]1C[C@H]1B(O)O MCULE-1985317168 [0,0,0,1,0,0|2,0,1]=4 275 B10R1.350 CC1(CC1)CCCC(=O)O MCULE-2954866291 [0,0,0,1,0,0|1,0,0]=2 276 B10R1.350 CC1(N=N1)CCCC(=O)O MCULE-2970288895 [0,0,0,1,0,0|3,0,0]=4 277 B10R1.352 CC1(CC1CCC(=O)O)C MCULE-6164876776 [0,0,0,1,0,0|1,0,0]=2 278 B10R1.352 O=C(O)CCC1CC1(Cl)Cl MCULE-9473215932 [0,0,0,1,0,0|3,0,0]=4 279 B10R1.352 O=C(O)CCC1CC1(F)F MCULE-8332200330 [0,0,0,1,0,0|3,0,0]=4 280 B10R1.359 CC1(CC(CO1)C(=O)O)C MCULE-2939144976 [0,0,0,1,0,0|2,0,0]=3 281 B10R1.359 CC1(CCC(C1)C(=O)O)C MCULE-9978136872 [0,0,0,1,0,0|1,0,0]=2 282 B10R1.359 CC1(CCC(N1)C(=O)O)C MCULE-5310172848 [0,0,0,1,0,0|2,0,0]=3 283 B10R1.359 CC1(CCC(N1)C(=O)O)C MCULE-5921965282 [0,0,0,1,0,0|2,0,0]=3 284 B10R1.359 CC1(CCC(O1)C(=O)O)C MCULE-6347581531 [0,0,0,1,0,0|2,0,0]=3 285 B10R1.359 CC1(CNC(C1)C(=O)O)C MCULE-3559457457 [0,0,0,1,0,0|2,0,0]=3 286 B10R1.359 CC1(CNC(C1)C(=O)O)C MCULE-4286050645 [0,0,0,1,0,0|2,0,0]=3 287 B10R1.359 CC1(CN[C@@H](C1)C(=O)O)C MCULE-2704032687 [0,0,0,1,0,0|2,0,0]=3 288 B10R1.359 CC1(CN[C@@H](C1)C(=O)O)C MCULE-3701263335 [0,0,0,1,0,0|2,0,0]=3 289 B10R1.359 CC1(CN[C@@H](C1)C(=O)O)C MCULE-5777695775 [0,0,0,1,0,0|2,0,0]=3 290 B10R1.359 CC1(CN[C@@H](C1)C(=O)O)C MCULE-7930268339 [0,0,0,1,0,0|2,0,0]=3 291 B10R1.359 CC1(CN[C@H](C1)C(=O)O)C MCULE-5601172836 [0,0,0,1,0,0|2,0,0]=3 292 B10R1.359 CC1(CN[C@H](C1)C(=O)O)C MCULE-5795533452 [0,0,0,1,0,0|2,0,0]=3 293 B10R1.359 CC1(CN[C@H](C1)C(=O)O)C MCULE-6871769907 [0,0,0,1,0,0|2,0,0]=3 294 B10R1.359 CC1(COC(C1)C(=O)O)C MCULE-3465757314 [0,0,0,1,0,0|2,0,0]=3 295 B10R1.359 CC1(NC(CS1)C(=O)O)C MCULE-3628976485 [0,0,0,1,0,0|3,0,0]=4 296 B10R1.359 CC1(NC(CS1)C(=O)O)C MCULE-9763318604 [0,0,0,1,0,0|3,0,0]=4 297 B10R1.359 CC1(N[C@@H](CS1)C(=O)O)C MCULE-5428000366 [0,0,0,1,0,0|3,0,0]=4 298 B10R1.359 CC1(N[C@@H](CS1)C(=O)O)C MCULE-6914291473 [0,0,0,1,0,0|3,0,0]=4 299 B10R1.359 CC1(N[C@@H](CS1)C(=O)O)C MCULE-8499487712 [0,0,0,1,0,0|3,0,0]=4 300 B10R1.359 CC1(N[C@@H](CS1)C(=O)O)C MCULE-9591174443 [0,0,0,1,0,0|3,0,0]=4 301 B10R1.359 CC1(N[C@H](CS1)C(=O)O)C MCULE-1864127233 [0,0,0,1,0,0|3,0,0]=4 302 B10R1.359 CC1(OCC(O1)C(=O)O)C MCULE-8459041221 [0,0,0,1,0,0|3,0,0]=4 303 B10R1.359 CC1(OC[C@@H](O1)C(=O)O)C MCULE-4620241254 [0,0,0,1,0,0|3,0,0]=4 304 B10R1.359 CC1(OC[C@@H](O1)C(=O)O)C MCULE-7602075849 [0,0,0,1,0,0|3,0,0]=4 305 B10R1.359 CC1(OC[C@H](O1)C(=O)O)C MCULE-6422447541 [0,0,0,1,0,0|3,0,0]=4 306 B10R1.359 CC1(OC[C@H](O1)C(=O)O)C MCULE-7066406161 [0,0,0,1,0,0|3,0,0]=4 307 B10R1.359 O=C(O)C1CCC(C1)(F)F MCULE-3866141496 [0,0,0,1,0,0|3,0,0]=4 308 B10R1.359 O=C(O)C1CCC(C1)(F)F MCULE-9447411120 [0,0,0,1,0,0|3,0,0]=4 309 B10R1.359 O=C(O)C1CCS(=O)(=O)C1 MCULE-3551776261 [0,0,0,1,0,0|3,0,0]=4 310 B10R1.359 O=C(O)[C@@H]1CCC(C1)(F)F MCULE-1982062527 [0,0,0,1,0,0|3,0,0]=4 311 B10R1.359 O=C(O)[C@@H]1CCC(C1)(F)F MCULE-8436417104 [0,0,0,1,0,0|3,0,0]=4 312 B10R1.359 O=C(O)[C@H]1CCC(C1)(F)F MCULE-1884661502 [0,0,0,1,0,0|3,0,0]=4 313 B10R1.359 O=C(O)[C@H]1CCC(C1)(F)F MCULE-4373169739 [0,0,0,1,0,0|3,0,0]=4 314 B10R1.371 CC1(CC(=CC(=O)O)C1)C MCULE-9641190837 [0,0,0,1,0,0|1,0,2]=4 315 B10R1.371 CC1(CN(C1)CC(=O)O)C MCULE-2129138471 [0,0,0,1,0,0|2,0,0]=3 316 B10R1.371 CC1(CN(C1)CC(=O)O)C MCULE-5282312273 [0,0,0,1,0,0|2,0,0]=3 317 B10R1.371 O=C(O)CC1CC(C1)(F)F MCULE-1067818772 [0,0,0,1,0,0|3,0,0]=4 318 B10R1.371 O=C(O)CC1CS(=O)(=O)C1 MCULE-1664877962 [0,0,0,1,0,0|3,0,0]=4 319 B8R0.29 CC(=O)CCC(C)(C)C MCULE-2192082949 [0,0,0,0,1,0|2,0,0]=3 320 B8R0.29 CC(=O)CCC(C)(C)O MCULE-8412947781 [0,0,0,0,1,0|3,0,0]=4 321 B8R0.29 CC(=O)CNC(C)(C)C MCULE-4059953007 [0,0,0,0,1,0|3,0,0]=4 322 B8R0.29 CC(=O)CNC(C)(C)C MCULE-9982398249 [0,0,0,0,1,0|3,0,0]=4 323 B8R0.29 CC(=O)COC(C)(C)C MCULE-1842651618 [0,0,0,0,1,0|3,0,0]=4 324 B8R0.29 CC(=O)CSC(C)(C)C MCULE-8055514434 [0,0,0,0,1,0|3,0,0]=4 325 B8R0.29 CC(=O)OC[Si](C)(C)C MCULE-2980282217 [0,0,0,0,1,0|3,0,0]=4 326 B8R0.29 CC(C)(C)/C=C/C(=O)O MCULE-8309589516 [0,0,0,0,1,0|1,0,2]=4 327 B8R0.29 CC(C)(C)C#CC(=O)O MCULE-1871829267 [0,0,0,0,1,0|1,0,2]=4 328 B8R0.29 CC(C)(C)C=CC(=O)O MCULE-1811374550 [0,0,0,0,1,0|1,0,2]=4 329 B8R0.29 CC(C)(C)CCC(=O)O MCULE-8929874481 [0,0,0,0,1,0|1,0,0]=2 330 B8R0.29 CC(C)(C)CCN(=O)=O MCULE-3755410630 [0,0,0,0,1,0|2,0,1]=4 331 B8R0.29 CC(C)(C)CNC(=O)N MCULE-1062244536 [0,0,0,0,1,0|3,0,0]=4 332 B8R0.29 CC(C)(C)COC(=O)Cl MCULE-8215596189 [0,0,0,0,1,0|3,0,0]=4 333 B8R0.29 CC(C)(C)NCC(=O)Cl MCULE-4182814399 [0,0,0,0,1,0|3,0,0]=4 334 B8R0.29 CC(C)(C)NCC(=O)Cl MCULE-5526530619 [0,0,0,0,1,0|3,0,0]=4 335 B8R0.29 CC(C)(C)NCC(=O)N MCULE-8082980934 [0,0,0,0,1,0|3,0,0]=4 336 B8R0.29 CC(C)(C)NCC(=O)O MCULE-1149308055 [0,0,0,0,1,0|2,0,0]=3 337 B8R0.29 CC(C)(C)NCC(=O)O MCULE-9781967875 [0,0,0,0,1,0|2,0,0]=3 338 B8R0.29 CC(C)(C)NCC(=O)[O-] MCULE-2801469302 [0,0,0,0,1,0|2,0,1]=4 339 B8R0.29 CC(C)(C)OCC(=O)N MCULE-8627839273 [0,0,0,0,1,0|3,0,0]=4 340 B8R0.29 CC(C)(C)OCC(=O)O MCULE-9634856231 [0,0,0,0,1,0|2,0,0]=3 341 B8R0.29 CC(C)(C)SCC(=O)O MCULE-3761706328 [0,0,0,0,1,0|2,0,0]=3 342 B8R0.29 CC(C)(N)CCC(=O)O MCULE-1195501366 [0,0,0,0,1,0|2,0,0]=3 343 B8R0.29 CC(C)(N)CCC(=O)O MCULE-3901764815 [0,0,0,0,1,0|2,0,0]=3 344 B8R0.29 CC(C)(O)CCC(=O)[O-] MCULE-1599861039 [0,0,0,0,1,0|2,0,1]=4 345 B8R0.29 CC(C)(O)CCC(=O)[O-] MCULE-4576125997 [0,0,0,0,1,0|2,0,1]=4 346 B8R0.29 CC(C)(O)CCC(=O)[O-] MCULE-9770985354 [0,0,0,0,1,0|2,0,1]=4 347 B8R0.29 CC(C)(S)CCC(=O)O MCULE-7771494478 [0,0,0,0,1,0|2,0,0]=3 348 B8R0.29 CC(F)(F)CCC(=O)O MCULE-6694097155 [0,0,0,0,1,0|3,0,0]=4 349 B8R0.29 CP(=O)(C)CCC(=O)O MCULE-4161237740 [0,0,0,0,1,0|1,1,0]=3 350 B8R0.29 CP(=O)(O)CCC(=O)O MCULE-7722406670 [0,0,0,0,1,0|2,1,0]=4 351 B8R0.29 CP(=S)(C)CCC(=O)O MCULE-5422068119 [0,0,0,0,1,0|1,1,0]=3 352 B8R0.29 CS(=O)(=NCC(=O)O)C MCULE-1962520069 [0,0,0,0,1,0|3,0,0]=4 353 B8R0.29 CS(=O)(=O)CCC(=O)O MCULE-6100062469 [0,0,0,0,1,0|3,0,0]=4 354 B8R0.29 C[Si](C)(C)C#CC(=O)O MCULE-2165767664 [0,0,0,0,1,0|1,0,2]=4 355 B8R0.29 C[Si](C)(C)CCC(=O)O MCULE-7609579135 [0,0,0,0,1,0|1,0,0]=2 356 B8R0.29 C[Si](C)(C)CCC(=O)[O-] MCULE-2888786921 [0,0,0,0,1,0|1,0,1]=3 357 B10R0.15 CC(C)(C)CCCCC(=O)O MCULE-8286567269 [0,0,0,0,0,1|1,0,0]=2 358 B10R0.15 CC(C)(C)OCCCC(=O)O MCULE-2716548684 [0,0,0,0,0,1|1,0,0]=2 359 B10R0.15 CC(C)(C)SCCCC(=O)O MCULE-5087513039 [0,0,0,0,0,1|1,0,0]=2 360 B10R0.15 CS(=O)(=O)NCCCC(=O)O MCULE-9615507449 [0,0,0,0,0,1|3,0,0]=4 361 B10R0.15 CS(=O)(=S)OCCCC(=O)O MCULE-1884275676 [0,0,0,0,0,1|3,0,0]=4 362 B10R0.15 C[N+](C)(C)CCCCC(=O)[O-] MCULE-4329658120 [0,0,0,0,0,1|0,0,1]=2 363 B10R0.15 C[N+](C)(C)CCCCC(=O)[O-] MCULE-9469838787 [0,0,0,0,0,1|0,0,1]=2 364 B10R0.15 C[Si](C)(C)CCCCC(=O)O MCULE-8618985909 [0,0,0,0,0,1|1,0,0]=2 365 B10R0.15 C[Si](C)(C)CCSCC(=O)O MCULE-4226489820 [0,0,0,0,0,1|1,0,0]=2 366 B7R0.4 C#CCCCC(=O)O MCULE-7464892335 [2,0,0,0,0,0|1,0,1]=4 367 B7R0.4 C=CCCCC(=O)O MCULE-6043142578 [2,0,0,0,0,0|1,0,1]=4 368 B7R0.4 C=CCCCC(C)C MCULE-7578384030 [2,0,0,0,0,0|2,0,0]=4 369 B7R0.4 CC#CCCC(=O)O MCULE-1415388780 [2,0,0,0,0,0|1,0,1]=4 370 B7R0.4 CC(=CCCC=O)C MCULE-3815388926 [2,0,0,0,0,0|1,0,1]=4 371 B7R0.4 CC(C)CCCC=O MCULE-2846844109 [2,0,0,0,0,0|1,0,0]=3 372 B7R0.4 CC(C)CCCCO MCULE-9053698607 [2,0,0,0,0,0|1,0,1]=4 373 B7R0.4 CC(C)CCOC=O MCULE-3671444552 [2,0,0,0,0,0|2,0,0]=4 374 B7R0.4 CC=CCCC(=O)O MCULE-4275247668 [2,0,0,0,0,0|1,0,1]=4 375 B7R0.4 CCCCCC(=O)C MCULE-6017828463 [2,0,0,0,0,0|2,0,0]=4 376 B7R0.4 CCCCCC(=O)Cl MCULE-5446850478 [2,0,0,0,0,0|2,0,0]=4 377 B7R0.4 CCCCCC(=O)N MCULE-3215992514 [2,0,0,0,0,0|2,0,0]=4 378 B7R0.4 CCCCCC(=O)O MCULE-1671810139 [2,0,0,0,0,0|1,0,0]=3 379 B7R0.4 CCCCCC(=O)[O-] MCULE-5310584661 [2,0,0,0,0,0|1,0,1]=4 380 B7R0.4 CCCCCC(=O)[O-] MCULE-9495078126 [2,0,0,0,0,0|1,0,1]=4 381 B7R0.4 CCCNCC(=O)O MCULE-4384128915 [2,0,0,0,0,0|2,0,0]=4 382 B7R0.4 CCCNCC(=O)O MCULE-7537317046 [2,0,0,0,0,0|2,0,0]=4 383 B7R0.4 CCCOCC(=O)O MCULE-6841640058 [2,0,0,0,0,0|2,0,0]=4 384 B7R0.4 CCCSCC(=O)O MCULE-7463688573 [2,0,0,0,0,0|2,0,0]=4 385 B7R0.4 CCNCCC(=O)O MCULE-4226597657 [2,0,0,0,0,0|2,0,0]=4 386 B7R0.4 CCNCCC(=O)O MCULE-9183951914 [2,0,0,0,0,0|2,0,0]=4 387 B7R0.4 CCOCCC(=O)O MCULE-3962084059 [2,0,0,0,0,0|2,0,0]=4 388 B7R0.4 CCSCCC(=O)O MCULE-9385724904 [2,0,0,0,0,0|2,0,0]=4 389 B7R0.4 CN(C)CCCC=O MCULE-1296611805 [2,0,0,0,0,0|0,0,1]=3 390 B7R0.4 CN(C)CCCCO MCULE-6973654872 [2,0,0,0,0,0|0,0,2]=4 391 B7R0.4 CN(C)CCNC=O MCULE-6221074161 [2,0,0,0,0,0|1,0,1]=4 392 B7R0.4 CNCCCC(=O)N MCULE-8337447772 [2,0,0,0,0,0|1,0,1]=4 393 B7R0.4 CNCCCC(=O)N MCULE-9037809827 [2,0,0,0,0,0|1,0,1]=4 394 B7R0.4 CNCCCC(=O)O MCULE-7598762485 [2,0,0,0,0,0|0,0,1]=3 395 B7R0.4 CNCCCC(=O)O MCULE-7877286915 [2,0,0,0,0,0|0,0,1]=3 396 B7R0.4 COCCCC(=O)C MCULE-3606369396 [2,0,0,0,0,0|2,0,0]=4 397 B7R0.4 COCCCC(=O)O MCULE-3165881573 [2,0,0,0,0,0|1,0,0]=3 398 B7R0.4 CSCCCC(=O)O MCULE-2126637794 [2,0,0,0,0,0|1,0,0]=3 399 B7R0.4 CSSCCC(=O)O MCULE-6571821309 [2,0,0,0,0,0|2,0,0]=4 400 B7R0.4 N#CCCCC(=O)O MCULE-9921837071 [2,0,0,0,0,0|2,0,0]=4 401 B7R0.4 NCCCCC(=O)O MCULE-1155829905 [2,0,0,0,0,0|2,0,0]=4 402 B7R0.4 NCCCCC(=O)O MCULE-3920398524 [2,0,0,0,0,0|2,0,0]=4 403 B7R0.4 NCCCCC(=O)O MCULE-4404796498 [2,0,0,0,0,0|2,0,0]=4 404 B7R0.4 NCCCCC(=O)O MCULE-4971679857 [2,0,0,0,0,0|2,0,0]=4 405 B7R0.4 NOCCCC(=O)O MCULE-4102473285 [2,0,0,0,0,0|2,0,0]=4 406 B7R0.4 NOCCCC(=O)O MCULE-7068985203 [2,0,0,0,0,0|2,0,0]=4 407 B7R0.4 O=C(O)CCCCBr MCULE-2655919094 [2,0,0,0,0,0|2,0,0]=4 408 B7R0.4 O=C(O)CCCCCl MCULE-4094641005 [2,0,0,0,0,0|2,0,0]=4 409 B7R0.4 O=C(O)CCCCO MCULE-8816195933 [2,0,0,0,0,0|2,0,0]=4 410 B7R0.4 O=C(O)CCCCS MCULE-2427465795 [2,0,0,0,0,0|2,0,0]=4 411 B7R0.4 O=CCCCC(=O)O MCULE-8389457571 [2,0,0,0,0,0|2,0,0]=4 412 B7R0.8 C=CCCC(C)(C)C MCULE-8786196383 [2,0,0,0,0,0|1,0,1]=4 413 B7R0.8 C=CCC[Si](C)(C)C MCULE-9475403054 [2,0,0,0,0,0|1,0,1]=4 414 B7R0.8 CC(C)(C)CCC=O MCULE-1451861515 [2,0,0,0,0,0|1,0,0]=3 415 B7R0.8 CC(C)(C)CCCBr MCULE-4957327319 [2,0,0,0,0,0|2,0,0]=4 416 B7R0.8 CC(C)(C)CCCCl MCULE-2639997289 [2,0,0,0,0,0|2,0,0]=4 417 B7R0.8 CC(C)(C)CCCN MCULE-4819398612 [2,0,0,0,0,0|2,0,0]=4 418 B7R0.8 CC(C)(C)CCCN MCULE-8532835162 [2,0,0,0,0,0|2,0,0]=4 419 B7R0.8 CC(C)(C)CCCO MCULE-6612017649 [2,0,0,0,0,0|1,0,0]=3 420 B7R0.8 CC(C)(C)NCCO MCULE-4847202538 [2,0,0,0,0,0|2,0,0]=4 421 B7R0.8 CC(C)(C)OCCO MCULE-7079168773 [2,0,0,0,0,0|2,0,0]=4 422 B7R0.8 CC(C)(C)SCCO MCULE-5098402639 [2,0,0,0,0,0|2,0,0]=4 423 B7R0.8 CC(C)(N)CCCO MCULE-7933621714 [2,0,0,0,0,0|2,0,0]=4 424 B7R0.8 CC(C)(O)CCCO MCULE-1879136086 [2,0,0,0,0,0|2,0,0]=4 425 B7R0.8 CCCCC(C)(C)C MCULE-4446772090 [2,0,0,0,0,0|1,0,1]=4 426 B7R0.8 CCCC[N+](C)(C)C MCULE-6094336787 [2,0,0,0,0,0|0,0,1]=3 427 B7R0.8 CCCC[N+](C)(C)C MCULE-6922813961 [2,0,0,0,0,0|0,0,1]=3 428 B7R0.8 CCCC[N+](C)(C)C MCULE-7733910392 [2,0,0,0,0,0|0,0,1]=3 429 B7R0.8 C[N+](C)(C)C=CCO MCULE-2439698184 [2,0,0,0,0,0|0,0,2]=4 430 B7R0.8 C[N+](C)(C)C=CCO MCULE-5907002625 [2,0,0,0,0,0|0,0,2]=4 431 B7R0.8 C[N+](C)(C)CC=NO MCULE-3839560405 [2,0,0,0,0,0|1,0,1]=4 432 B7R0.8 C[N+](C)(C)CC=NO MCULE-9028292056 [2,0,0,0,0,0|1,0,1]=4 433 B7R0.8 C[N+](C)(C)CCC#N MCULE-5285847568 [2,0,0,0,0,0|1,0,1]=4 434 B7R0.8 C[N+](C)(C)CCC#N MCULE-5551427127 [2,0,0,0,0,0|1,0,1]=4 435 B7R0.8 C[N+](C)(C)CCCBr MCULE-9370807249 [2,0,0,0,0,0|1,0,0]=3 436 B7R0.8 C[N+](C)(C)CCCBr MCULE-9821604481 [2,0,0,0,0,0|1,0,0]=3 437 B7R0.8 C[N+](C)(C)CCCCl MCULE-4715617666 [2,0,0,0,0,0|1,0,0]=3 438 B7R0.8 C[N+](C)(C)CCCCl MCULE-5409968394 [2,0,0,0,0,0|1,0,0]=3 439 B7R0.8 C[N+](C)(C)CCCN MCULE-3114559837 [2,0,0,0,0,0|1,0,0]=3 440 B7R0.8 C[N+](C)(C)CCCN MCULE-6507636881 [2,0,0,0,0,0|1,0,0]=3 441 B7R0.8 C[Si](C)(C)CC=CO MCULE-2644578187 [2,0,0,0,0,0|1,0,1]=4 442 B7R0.8 C[Si](C)(C)CCCCl MCULE-9359942482 [2,0,0,0,0,0|2,0,0]=4 443 B7R0.8 C[Si](C)(C)CCCN MCULE-1428084723 [2,0,0,0,0,0|2,0,0]=4 444 B7R0.8 C[Si](C)(C)CCCN MCULE-5865817003 [2,0,0,0,0,0|2,0,0]=4 445 B7R0.8 C[Si](C)(C)CCCO MCULE-4140493646 [2,0,0,0,0,0|1,0,0]=3 446 B7R0.8 C[Si](C)(C)CCCS MCULE-7382619897 [2,0,0,0,0,0|1,1,0]=4 447 B7R0.8 C[Si](C)(C)OCCO MCULE-3523451816 [2,0,0,0,0,0|2,0,0]=4 448 B9R0.21 CC(C)(C)CCC(N)CO MCULE-1507788372 [1,1,0,0,0,0|1,0,1]=4 449 B9R0.21 CC(C)(C)CCC(N)CO MCULE-9142703528 [1,1,0,0,0,0|1,0,1]=4 450 B9R0.38 C=CCOCC[N+](C)(C)C MCULE-7850465970 [1,1,0,0,0,0|1,0,0]=3 451 B9R0.38 C=CCOCC[N+](C)(C)C MCULE-9212664775 [1,1,0,0,0,0|1,0,0]=3 452 B9R0.38 CC(C)(C)CCCCC=O MCULE-8002631916 [1,1,0,0,0,0|1,0,0]=3 453 B9R0.38 CC(C)(C)CNCCCO MCULE-4223692439 [1,1,0,0,0,0|1,0,1]=4 454 B9R0.38 CC(C)(C)COCCCO MCULE-7191600144 [1,1,0,0,0,0|1,0,1]=4 455 B9R0.38 CCCCCC[N+](C)(C)C MCULE-1452936831 [1,1,0,0,0,0|1,0,1]=4 456 B9R0.38 CCCCCC[N+](C)(C)C MCULE-9999169380 [1,1,0,0,0,0|1,0,1]=4 457 B9R0.38 C[N+](C)(C)CCCCCBr MCULE-8199326199 [1,1,0,0,0,0|1,0,1]=4 458 B9R0.38 C[N+](C)(C)CCCCCBr MCULE-9180512799 [1,1,0,0,0,0|1,0,1]=4 459 B9R0.44 CC(C)(C)CC(N)CCO MCULE-6045777873 [1,1,0,0,0,0|1,0,1]=4 460 B9R0.44 CC(CC=O)CC(C)(C)C MCULE-6622339070 [1,1,0,0,0,0|1,0,0]=3 461 B9R0.44 CC(CCO)CC(C)(C)C MCULE-5987575303 [1,1,0,0,0,0|1,0,1]=4 462 B9R0.44 C[N+](C)(C)CC(O)CC#N MCULE-2294121826 [1,1,0,0,0,0|1,0,1]=4 463 B9R0.44 C[N+](C)(C)CC(O)CC#N MCULE-9559853966 [1,1,0,0,0,0|1,0,1]=4 464 B9R0.44 C[N+](C)(C)C[C@H](O)CC#N MCULE-3704336621 [1,1,0,0,0,0|1,0,1]=4 465 B9R0.44 C[N+](C)(C)C[C@H](O)CC#N MCULE-9827535818 [1,1,0,0,0,0|1,0,1]=4 466 B9R0.1 C=C(C)CCCC(=O)OC MCULE-9632804158 [1,1,0,0,0,0|1,0,1]=4 467 B9R0.1 CCC(=CCCC(=O)O)C MCULE-6674917264 [1,1,0,0,0,0|1,0,1]=4 468 B9R0.1 CCC(=O)CCCC(=O)O MCULE-9954859815 [1,1,0,0,0,0|2,0,0]=4 469 B9R0.1 CCC(C)CCCC(=O)O MCULE-5124776736 [1,1,0,0,0,0|1,0,0]=3 470 B9R0.1 CN(CCCC(=O)O)N=O MCULE-9429394767 [1,1,0,0,0,0|1,0,1]=4 471 B9R0.1 CNC(=O)CCCC(=O)O MCULE-1504372631 [1,1,0,0,0,0|2,0,0]=4 472 B9R0.1 COC(=O)CCCC(=O)C MCULE-7598370905 [1,1,0,0,0,0|2,0,0]=4 473 B9R0.1 COC(=O)CCCC(=O)O MCULE-9458960872 [1,1,0,0,0,0|2,0,0]=4 474 B9R0.1 COC(=O)CCNC(C)C MCULE-3115197137 [1,1,0,0,0,0|2,0,0]=4 475 B9R0.1 COC(=O)CCOC(C)C MCULE-7375114794 [1,1,0,0,0,0|2,0,0]=4 476 B9R0.1 COC(=O)CNCC(C)C MCULE-6522627999 [1,1,0,0,0,0|2,0,0]=4 477 B9R0.1 NCC(=O)CCCC(=O)O MCULE-2734634895 [1,1,0,0,0,0|2,0,0]=4 478 B9R0.1 NCC(=O)CCCC(=O)O MCULE-7779987234 [1,1,0,0,0,0|2,0,0]=4 479 B9R0.1 O=C(O)CCCC(O)CO MCULE-8338266320 [1,1,0,0,0,0|2,0,0]=4 480 B9R0.7 C=C(CCN(C)C)C(=O)O MCULE-3833333239 [1,1,0,0,0,0|0,0,2]=4 481 B9R0.7 C=C(CCN(C)C)C(=O)O MCULE-5949669555 [1,1,0,0,0,0|0,0,2]=4 482 B9R0.7 CC(=CCC(N)C(=O)O)C MCULE-9020150203 [1,1,0,0,0,0|1,0,1]=4 483 B9R0.7 CC(=CC[C@@H](N)C(=O)O)C MCULE-7822845293 [1,1,0,0,0,0|1,0,1]=4 484 B9R0.7 CC(=CC[C@H](N)C(=O)O)C MCULE-6208618845 [1,1,0,0,0,0|1,0,1]=4 485 B9R0.7 CC(=O)C(C)CCC(=O)O MCULE-9124111940 [1,1,0,0,0,0|2,0,0]=4 486 B9R0.7 CC(C)C(=O)CCC(=O)O MCULE-9072643820 [1,1,0,0,0,0|1,0,1]=4 487 B9R0.7 CC(C)CCC(C)C(=O)O MCULE-8295273403 [1,1,0,0,0,0|1,0,0]=3 488 B9R0.7 CC(C)CCC(F)C(=O)O MCULE-1179378327 [1,1,0,0,0,0|1,0,0]=3 489 B9R0.7 CC(C)CCC(N)C(=O)O MCULE-1719574078 [1,1,0,0,0,0|1,0,0]=3 490 B9R0.7 CC(C)CCC(N)C(=O)O MCULE-7494642848 [1,1,0,0,0,0|1,0,0]=3 491 B9R0.7 CC(C)CCC(N)C(=O)O MCULE-7934601656 [1,1,0,0,0,0|1,0,0]=3 492 B9R0.7 CC(C)CC[C@@H](N)C(=O)O MCULE-3738071496 [1,1,0,0,0,0|1,0,0]=3 493 B9R0.7 CC(C)CC[C@@H](N)C(=O)O MCULE-6646418122 [1,1,0,0,0,0|1,0,0]=3 494 B9R0.7 CC(C)CC[C@H](N)C(=O)O MCULE-1152840736 [1,1,0,0,0,0|1,0,0]=3 495 B9R0.7 CC(C)CC[C@H](N)C(=O)O MCULE-2931632246 [1,1,0,0,0,0|1,0,0]=3 496 B9R0.7 CC(C)CC[C@H](N)C(=O)O MCULE-6463365282 [1,1,0,0,0,0|1,0,0]=3 497 B9R0.7 CC(C)CC[C@H](N)C(=O)O MCULE-7649870164 [1,1,0,0,0,0|1,0,0]=3 498 B9R0.7 CC(C)COC(C)C(=O)O MCULE-1125012565 [1,1,0,0,0,0|2,0,0]=4 499 B9R0.7 CC(C)N(C)CCC(=O)O MCULE-1211739557 [1,1,0,0,0,0|2,0,0]=4 500 B9R0.7 CC(C)N(C)CCC(=O)O MCULE-7992959591 [1,1,0,0,0,0|2,0,0]=4 501 B9R0.7 CC(C)OC[C@H](N)C(=O)O MCULE-1578143302 [1,1,0,0,0,0|2,0,0]=4 502 B9R0.7 CC(C)SCC(N)C(=O)O MCULE-2486867814 [1,1,0,0,0,0|2,0,0]=4 503 B9R0.7 CC(CCC(=O)O)N(C)C MCULE-5148332124 [1,1,0,0,0,0|0,0,1]=3 504 B9R0.7 CC(CCC(=O)O)N(C)C MCULE-6459126538 [1,1,0,0,0,0|0,0,1]=3 505 B9R0.7 CC(CCN(C)C)C(=O)O MCULE-1367979399 [1,1,0,0,0,0|0,0,1]=3 506 B9R0.7 CC(CCN(C)C)C(=O)O MCULE-7599864369 [1,1,0,0,0,0|0,0,1]=3 507 B9R0.7 CN(C)C(=O)CCC(=O)O MCULE-7236596707 [1,1,0,0,0,0|0,0,2]=4 508 B9R0.7 CN(C)CCC(N)C(=O)O MCULE-8874115334 [1,1,0,0,0,0|0,0,1]=3 509 B9R0.7 CN(C)CCC(O)C(=O)O MCULE-7034022816 [1,1,0,0,0,0|0,0,1]=3 510 B9R0.7 CN(C)CC[C@H](N)C(=O)O MCULE-7859718042 [1,1,0,0,0,0|0,0,1]=3 511 B9R0.7 CN(C)CC[C@H](N)C(=O)O MCULE-7883746105 [1,1,0,0,0,0|0,0,1]=3 512 B9R0.7 CS(=O)CCC(N)C(=O)O MCULE-2810141962 [1,1,0,0,0,0|2,0,0]=4 513 B9R0.7 CS(=O)CC[C@@H](N)C(=O)O MCULE-3901672243 [1,1,0,0,0,0|2,0,0]=4 514 B9R0.7 CS(=O)CC[C@@H](N)C(=O)O MCULE-3967415982 [1,1,0,0,0,0|2,0,0]=4 515 B9R0.7 CS(=O)CC[C@@H](N)C(=O)O MCULE-6481206030 [1,1,0,0,0,0|2,0,0]=4 516 B9R0.7 CS(=O)CC[C@@H](N)C(=O)O MCULE-6787807393 [1,1,0,0,0,0|2,0,0]=4 517 B9R0.7 CS(=O)CC[C@H](N)C(=O)O MCULE-1832499155 [1,1,0,0,0,0|2,0,0]=4 518 B9R0.7 C[S+](C)CCC(N)C(=O)O MCULE-1226059178 [1,1,0,0,0,0|1,0,0]=3 519 B9R0.7 C[S+](C)CCC(N)C(=O)O MCULE-2190014040 [1,1,0,0,0,0|1,0,0]=3 520 B9R0.7 C[S+](C)CCC(N)C(=O)O MCULE-5712047901 [1,1,0,0,0,0|1,0,0]=3 521 B9R0.7 C[S+](C)CCC(N)C(=O)O MCULE-6819299220 [1,1,0,0,0,0|1,0,0]=3 522 B9R0.7 C[S+](C)CCC(N)C(=O)O MCULE-9030836699 [1,1,0,0,0,0|1,0,0]=3 523 B9R0.7 C[S+](C)CCC(N)C(=O)[O-] MCULE-6795236117 [1,1,0,0,0,0|1,0,1]=4 524 B9R0.7 C[S+](C)CC[C@@H](N)C(=O)O MCULE-4590755313 [1,1,0,0,0,0|1,0,0]=3 525 B9R0.7 C[S+](C)CC[C@@H](N)C(=O)O MCULE-5450461647 [1,1,0,0,0,0|1,0,0]=3 526 B9R0.7 C[S+](C)CC[C@@H](N)C(=O)O MCULE-6366850762 [1,1,0,0,0,0|1,0,0]=3 527 B9R0.7 C[S+](C)CC[C@H](N)C(=O)O MCULE-1022001641 [1,1,0,0,0,0|1,0,0]=3 528 B9R0.7 C[S+](C)CC[C@H](N)C(=O)O MCULE-2164538601 [1,1,0,0,0,0|1,0,0]=3 529 B9R0.7 C[S+](C)CC[C@H](N)C(=O)O MCULE-4494909498 [1,1,0,0,0,0|1,0,0]=3 530 B9R0.7 C[S+](C)CC[C@H](N)C(=O)O MCULE-6858051266 [1,1,0,0,0,0|1,0,0]=3 531 B9R0.7 C[S+](C)CC[C@H](N)C(=O)O MCULE-7758450855 [1,1,0,0,0,0|1,0,0]=3 532 B9R0.7 C[S+](C)CC[C@H](N)C(=O)O MCULE-8877605547 [1,1,0,0,0,0|1,0,0]=3 533 B9R0.7 [C@H](N)(CCS(=O)C)C(=O)O MCULE-2995684872 [1,1,0,0,0,0|2,0,0]=4 534 B9R0.53 CC(=O)CC(C)CC(C)C MCULE-3290069482 [1,1,0,0,0,0|2,0,0]=4 535 B9R0.53 CC(C)CC(C)CC(=O)O MCULE-6189870651 [1,1,0,0,0,0|1,0,0]=3 536 B9R0.53 CC(C)CC(N)CC(=O)O MCULE-3491123553 [1,1,0,0,0,0|1,0,0]=3 537 B9R0.53 CC(C)CC(N)CC(=O)O MCULE-4917004131 [1,1,0,0,0,0|1,0,0]=3 538 B9R0.53 CC(C)CC(N)CC(=O)O MCULE-9751191377 [1,1,0,0,0,0|1,0,0]=3 539 B9R0.53 CC(C)CC(O)CC(=O)O MCULE-2536433460 [1,1,0,0,0,0|1,0,0]=3 540 B9R0.53 CC(C)C[C@@H](N)CC(=O)O MCULE-1906257031 [1,1,0,0,0,0|1,0,0]=3 541 B9R0.53 CC(C)C[C@@H](N)CC(=O)O MCULE-5676550364 [1,1,0,0,0,0|1,0,0]=3 542 B9R0.53 CC(C)C[C@@H](N)CC(=O)O MCULE-8752852377 [1,1,0,0,0,0|1,0,0]=3 543 B9R0.53 CC(C)C[C@@H](N)CC(=O)O MCULE-9926372034 [1,1,0,0,0,0|1,0,0]=3 544 B9R0.53 CC(C)C[C@H](N)CC(=O)O MCULE-5502640895 [1,1,0,0,0,0|1,0,0]=3 545 B9R0.53 CC(C)C[C@H](N)CC(=O)O MCULE-5602246196 [1,1,0,0,0,0|1,0,0]=3 546 B9R0.53 CC(C)C[C@H](N)CC(=O)O MCULE-6522397846 [1,1,0,0,0,0|1,0,0]=3 547 B9R0.53 CC(C)C[C@H](N)CC(=O)O MCULE-8594791252 [1,1,0,0,0,0|1,0,0]=3 548 B9R0.53 CN(C)CC(O)CC(=O)O MCULE-7052117725 [1,1,0,0,0,0|0,0,1]=3 549 B9R0.10 CC(C)(C)C(N)CC(=O)O MCULE-6654125396 [0,1,0,0,1,0|1,0,0]=3 550 B9R0.10 CC(C)(C)C(N)CC(=O)O MCULE-6842051841 [0,1,0,0,1,0|1,0,0]=3 551 B9R0.10 CC(C)(C)[C@@H](N)CC(=O)O MCULE-5408253054 [0,1,0,0,1,0|1,0,0]=3 552 B9R0.10 CC(C)(C)[C@@H](N)CC(=O)O MCULE-6704022659 [0,1,0,0,1,0|1,0,0]=3 553 B9R0.10 CC(C)(C)[C@H](N)CC(=O)O MCULE-4579899518 [0,1,0,0,1,0|1,0,0]=3 554 B9R0.10 CC(C)(C)[C@H](N)CC(=O)O MCULE-4645205176 [0,1,0,0,1,0|1,0,0]=3 555 B9R0.10 CC(CC(=O)O)C(C)(C)C MCULE-4114895909 [0,1,0,0,1,0|1,0,0]=3 556 B9R0.10 CC(CC(=O)O)C(C)(C)N MCULE-4308904314 [0,1,0,0,1,0|2,0,0]=4 557 B9R0.10 CC(CC(=O)O)C(C)(C)N MCULE-6683372980 [0,1,0,0,1,0|2,0,0]=4 558 B9R0.10 CC(CC(=O)O)C(C)(C)O MCULE-5216715591 [0,1,0,0,1,0|2,0,0]=4 559 B9R0.10 [C@@H](N)(CC(=O)O)C(C)(C)C MCULE-5327849230 [0,1,0,0,1,0|1,0,0]=3 560 B9R0.57 CC(C)(C)CC(=O)C(=O)O MCULE-5877446185 [0,1,0,0,1,0|1,0,1]=4 561 B9R0.57 CC(C)(C)CC(N)C(=O)O MCULE-1846409149 [0,1,0,0,1,0|1,0,0]=3 562 B9R0.57 CC(C)(C)CC(N)C(=O)O MCULE-6496394437 [0,1,0,0,1,0|1,0,0]=3 563 B9R0.57 CC(C)(C)CC(N)C(=O)O MCULE-6507277407 [0,1,0,0,1,0|1,0,0]=3 564 B9R0.57 CC(C)(C)CC(O)C(=O)O MCULE-2158861127 [0,1,0,0,1,0|1,0,0]=3 565 B9R0.57 CC(C)(C)C[C@@H](N)C(=O)O MCULE-6215032420 [0,1,0,0,1,0|1,0,0]=3 566 B9R0.57 CC(C)(C)C[C@@H](N)C(=O)O MCULE-8005575699 [0,1,0,0,1,0|1,0,0]=3 567 B9R0.57 CC(C)(C)C[C@H](N)C(=O)O MCULE-1515081556 [0,1,0,0,1,0|1,0,0]=3 568 B9R0.57 CC(C)(C)C[C@H](N)C(=O)O MCULE-3358775275 [0,1,0,0,1,0|1,0,0]=3 569 B9R0.57 CC(C)(F)CC(N)C(=O)O MCULE-2499553394 [0,1,0,0,1,0|2,0,0]=4 570 B9R0.57 CC(C)(F)C[C@H](N)C(=O)O MCULE-2670827731 [0,1,0,0,1,0|2,0,0]=4 571 B9R0.57 CC(C)(F)C[C@H](N)C(=O)O MCULE-7946625431 [0,1,0,0,1,0|2,0,0]=4 572 B9R0.57 CC(CC(C)(C)C)C(=O)O MCULE-1654401215 [0,1,0,0,1,0|1,0,0]=3 573 B9R0.57 CC(CC(C)(C)N)C(=O)O MCULE-2497907613 [0,1,0,0,1,0|2,0,0]=4 574 B9R0.57 CC(CC(C)(C)N)C(=O)O MCULE-7900482158 [0,1,0,0,1,0|2,0,0]=4 575 B9R0.57 CC(NC(C)(C)C)C(=O)O MCULE-8104914924 [0,1,0,0,1,0|2,0,0]=4 576 B9R0.57 CC(NC(C)(C)C)C(=O)O MCULE-8686537841 [0,1,0,0,1,0|2,0,0]=4 577 B9R0.57 CC(OC(C)(C)C)C(=O)O MCULE-8310959538 [0,1,0,0,1,0|2,0,0]=4 578 B9R0.57 C[Si](C)(C)C[C@H](N)C(=O)O MCULE-5057039244 [0,1,0,0,1,0|1,0,0]=3 579 B9R0.64 CC(C)(C#N)CCC(=O)O MCULE-9778482265 [0,1,0,0,1,0|1,0,1]=4 580 B9R0.64 CCC(C)(C)OCC(=O)O MCULE-6870018986 [0,1,0,0,1,0|2,0,0]=4 581 B11R0.34 CC(=O)CCC(C)CC(C)(C)C MCULE-4931350737 [0,1,0,0,0,1|2,0,0]=4 582 B11R0.34 CC(C)(C)CC(=O)NCC(=O)O MCULE-7894138691 [0,1,0,0,0,1|1,0,1]=4 583 B11R0.34 CC(C)(C)NC(=O)CCC(=O)O MCULE-8660308616 [0,1,0,0,0,1|1,0,1]=4 584 B11R0.34 CC(C)(C)OC(=O)CCC(=O)O MCULE-2379665381 [0,1,0,0,0,1|1,0,1]=4 585 B11R0.34 CC(CCC(=O)O)CC(C)(C)C MCULE-7307915460 [0,1,0,0,0,1|1,0,0]=3 586 B11R0.34 C[N+](C)(C)CC(Br)COC(=N)N MCULE-1262663240 [0,1,0,0,0,1|2,0,0]=4 587 B11R0.34 C[N+](C)(C)CC(Br)COC(=N)N MCULE-1915168118 [0,1,0,0,0,1|2,0,0]=4 588 B11R0.34 C[N+](C)(C)CC(Br)COC(=N)N MCULE-2634384158 [0,1,0,0,0,1|2,0,0]=4 589 B11R0.84 CC(C)(C)C(=O)CCCC(=O)O MCULE-5264826892 [0,1,0,0,0,1|1,0,0]=3 590 B11R0.84 CC(C)(C)C(=O)NCCC(=O)O MCULE-4042122234 [0,1,0,0,0,1|1,0,1]=4 591 B11R0.114 C=C/C(=N/CCC[N+](C)(C)C)/[O-] MCULE-1036426485 [0,1,0,0,0,1|1,0,1]=4 592 B11R0.114 C=CC(=O)NCCC[N+](C)(C)C MCULE-7084861582 [0,1,0,0,0,1|1,0,0]=3 593 B11R0.318 CC(C)(C)SSCC(N)C(=O)O MCULE-4633063877 [0,1,0,0,0,1|2,0,0]=4 594 B11R0.318 CC(C)(C)SSC[C@H](N)C(=O)O MCULE-6167372284 [0,1,0,0,0,1|2,0,0]=4 595 B11R0.318 CC(C)(C)SSC[C@H](N)C(=O)O MCULE-7804905353 [0,1,0,0,0,1|2,0,0]=4 596 B11R0.337 CC(C)(C)OCC(N)CC(=O)O MCULE-1846078234 [0,1,0,0,0,1|1,0,0]=3 597 B11R0.337 CC(C)(C)OCC(N)CC(=O)O MCULE-6978358828 [0,1,0,0,0,1|1,0,0]=3 598 B11R0.337 CC(C)(C)OC[C@H](N)CC(=O)O MCULE-2444600666 [0,1,0,0,0,1|1,0,0]=3 599 B11R0.337 CC(C)(C)OC[C@H](N)CC(=O)O MCULE-8633924988 [0,1,0,0,0,1|1,0,0]=3 600 B11R0.129 C[N+](C)(C#N)C(Cl)CCC(=O)[O-] MCULE-7262436840 [0,2,0,0,0,0|0,0,2]=4 601 B11R0.168 CC(C)(C)C(=O)CC(N)C(=O)O MCULE-1544769018 [0,2,0,0,0,0|1,0,1]=4 602 B11R0.168 CC(C)(C)C(=O)CC(N)C(=O)O MCULE-1594432517 [0,2,0,0,0,0|1,0,1]=4 603 B11R0.119 COC(=O)CC(C)CC(C)(C)C MCULE-7712946673 [0,2,0,0,0,0|1,0,0]=3 604 B11R0.208 C[C@@](O)(CC(=O)[O-])C[N+](C)(C)C MCULE-3111429450 [0,2,0,0,0,0|0,0,1]=3 605 B11R0.208 C[N+](C)(CC(=O)O)C[Si](C)(C)C MCULE-5470343880 [0,2,0,0,0,0|2,0,0]=4 606 B11R0.208 C[N+](C)(CC(=O)O)C[Si](C)(C)C MCULE-9202346118 [0,2,0,0,0,0|2,0,0]=4 607 B11R0.308 CC(C)(C)CC(O)C(N)C(=O)O MCULE-9438680092 [0,2,0,0,0,0|1,0,0]=3 608 B11R0.308 CC(C)(C)CC(O)C(N)C(=O)O MCULE-9836262781 [0,2,0,0,0,0|1,0,0]=3 609 B11R0.308 CC(OC(C)(C)C)C(N)C(=O)O MCULE-3922683465 [0,2,0,0,0,0|2,0,0]=4 610 B11R0.308 C[C@@H](OC(C)(C)C)[C@@H](N)C(=O)O MCULE-2267884538 [0,2,0,0,0,0|2,0,0]=4 611 B11R0.308 C[C@@H](OC(C)(C)C)[C@@H](N)C(=O)O MCULE-3695550507 [0,2,0,0,0,0|2,0,0]=4 612 B11R0.308 C[C@@H](OC(C)(C)C)[C@@H](N)C(=O)O MCULE-7973251553 [0,2,0,0,0,0|2,0,0]=4 613 B11R0.308 C[C@@H](OC(C)(C)C)[C@H](N)C(=O)O MCULE-5621161739 [0,2,0,0,0,0|2,0,0]=4 614 B11R0.308 C[C@@H](OC(C)(C)C)[C@H](N)C(=O)O MCULE-5919194624 [0,2,0,0,0,0|2,0,0]=4 615 B11R0.308 C[C@@H](OC(C)(C)C)[C@H](O)C(=O)O MCULE-6305867000 [0,2,0,0,0,0|2,0,0]=4 616 B11R0.308 C[C@H](OC(C)(C)C)[C@@H](N)C(=O)O MCULE-2873733004 [0,2,0,0,0,0|2,0,0]=4 617 B11R0.308 C[C@H](OC(C)(C)C)[C@@H](N)C(=O)O MCULE-3795809158 [0,2,0,0,0,0|2,0,0]=4 618 B11R0.308 C[C@H](OC(C)(C)C)[C@H](N)C(=O)O MCULE-2208968304 [0,2,0,0,0,0|2,0,0]=4 619 B11R0.308 C[C@H](OC(C)(C)C)[C@H](N)C(=O)O MCULE-6129486493 [0,2,0,0,0,0|2,0,0]=4 620 B11R0.308 C[N+](C)(C)CC(O)C(N)C(=O)[O-] MCULE-8319720230 [0,2,0,0,0,0|0,0,1]=3 621 B11R0.308 [C@@H](N)(C(=O)O)[C@@H](C)OC(C)(C)C MCULE-7895603771 [0,2,0,0,0,0|2,0,0]=4 622 B11R0.131 CC[N+](C)(C)CCCS(=O)(=O)[O-] MCULE-5319450752 [0,2,0,0,0,0|1,0,1]=4 623 B11R0.180 CCCC(=O)OCC[N+](C)(C)C MCULE-1565037874 [0,2,0,0,0,0|2,0,0]=4 624 B11R0.180 CCCC(=O)OCC[N+](C)(C)C MCULE-3026858183 [0,2,0,0,0,0|2,0,0]=4 625 B11R0.180 CCCC(=O)OCC[N+](C)(C)C MCULE-6187104512 [0,2,0,0,0,0|2,0,0]=4 626 B11R0.180 CCCC(=O)OCC[N+](C)(C)C MCULE-6382209134 [0,2,0,0,0,0|2,0,0]=4 627 B11R0.180 CCCC(=O)SCC[N+](C)(C)C MCULE-1579485338 [0,2,0,0,0,0|2,0,0]=4 628 B11R0.180 CCCC(=O)SCC[N+](C)(C)C MCULE-2436087085 [0,2,0,0,0,0|2,0,0]=4 629 B11R0.180 CCCC(=O)SCC[N+](C)(C)C MCULE-7424906268 [0,2,0,0,0,0|2,0,0]=4 630 B11R0.180 CCOC(=O)CCCC(C)(C)C MCULE-1861999091 [0,2,0,0,0,0|1,0,0]=3 631 B11R0.180 CCOC(=O)CCNC(C)(C)C MCULE-3589466050 [0,2,0,0,0,0|2,0,0]=4 632 B11R0.180 C[N+](C)(C)CCNC(=O)/C=N/O MCULE-1849893825 [0,2,0,0,0,0|1,0,0]=3 633 B11R0.180 C[N+](C)(C)CCNC(=O)/C=N/O MCULE-8801026060 [0,2,0,0,0,0|1,0,0]=3 634 B11R0.290 COC(=O)C(C)CNC(C)(C)C MCULE-3215254348 [0,2,0,0,0,0|2,0,0]=4 635 B11R0.290 COC(=O)C(N)CCC(C)(C)C MCULE-4172409146 [0,2,0,0,0,0|1,0,0]=3 636 B11R0.290 COC(=O)C(N)COC(C)(C)C MCULE-2394267481 [0,2,0,0,0,0|2,0,0]=4 637 B11R0.290 COC(=O)C(N)COC(C)(C)C MCULE-6370640366 [0,2,0,0,0,0|2,0,0]=4 638 B11R0.290 COC(=O)C(N)COC(C)(C)C MCULE-8451263315 [0,2,0,0,0,0|2,0,0]=4 639 B11R0.290 COC(=O)C(N)COC(C)(C)C MCULE-9304602510 [0,2,0,0,0,0|2,0,0]=4 640 B11R0.290 COC(=O)C(O)CCC(C)(C)C MCULE-2152512360 [0,2,0,0,0,0|1,0,0]=3 641 B11R0.290 COC(=O)C(O)COC(C)(C)C MCULE-1250397797 [0,2,0,0,0,0|2,0,0]=4 642 B11R0.290 COC(=O)[C@@H](N)COC(C)(C)C MCULE-1427212377 [0,2,0,0,0,0|2,0,0]=4 643 B11R0.290 COC(=O)[C@@H](N)COC(C)(C)C MCULE-1932706382 [0,2,0,0,0,0|2,0,0]=4 644 B11R0.290 COC(=O)[C@@H](N)COC(C)(C)C MCULE-3151585281 [0,2,0,0,0,0|2,0,0]=4 645 B11R0.290 COC(=O)[C@@H](N)COC(C)(C)C MCULE-6094888943 [0,2,0,0,0,0|2,0,0]=4 646 B11R0.290 COC(=O)[C@H](N)COC(C)(C)C MCULE-2516022083 [0,2,0,0,0,0|2,0,0]=4 647 B11R0.290 COC(=O)[C@H](N)COC(C)(C)C MCULE-7946707918 [0,2,0,0,0,0|2,0,0]=4 648 B11R0.290 COC(=O)[C@H](O)COC(C)(C)C MCULE-4567785258 [0,2,0,0,0,0|2,0,0]=4 649 B11R0.290 [C@@H](N)(COC(C)(C)C)C(=O)OC MCULE-5728606724 [0,2,0,0,0,0|2,0,0]=4 650 B11R0.290 [C@@H](N)(COC(C)(C)C)C(=O)OC MCULE-9565009763 [0,2,0,0,0,0|2,0,0]=4 651 B11R0.320 COC(=O)CCC[Si](C)(C)OC MCULE-7070527189 [0,2,0,0,0,0|1,0,0]=3 652 B11R0.202 CC(=O)SCC[N+](C)(C)C(C)C MCULE-5486606134 [0,2,0,0,0,0|2,0,0]=4 653 B11R0.202 CC(=O)SCC[N+](C)(C)C(C)C MCULE-6919072849 [0,2,0,0,0,0|2,0,0]=4 654 B11R0.302 CCC(C)(C)SC[C@H](N)C(=O)O MCULE-7227985035 [0,2,0,0,0,0|2,0,0]=4 655 B11R0.302 CCC(C)(C)SC[C@H](N)C(=O)O MCULE-9705479622 [0,2,0,0,0,0|2,0,0]=4 656 B11R0.313 CCC(CCC(C)(C)C)C(=O)O MCULE-7654630416 [0,2,0,0,0,0|1,0,0]=3 657 B11R0.313 CNC(COC(C)(C)C)C(=O)O MCULE-7175399241 [0,2,0,0,0,0|2,0,0]=4 658 B11R0.313 CN[C@@H](COC(C)(C)C)C(=O)O MCULE-6574409760 [0,2,0,0,0,0|2,0,0]=4 659 B11R0.313 CN[C@@H](COC(C)(C)C)C(=O)O MCULE-7506082519 [0,2,0,0,0,0|2,0,0]=4 660 B11R0.429 CC(C)(C)CCC(C)(N)C(=O)O MCULE-2231399273 [0,2,0,0,0,0|1,0,0]=3 661 B11R0.429 CC(C)(C)CCC(C)(N)C(=O)O MCULE-6447356592 [0,2,0,0,0,0|1,0,0]=3 662 B11R0.429 CC(C)(C)OCC(C)(N)C(=O)O MCULE-3446807639 [0,2,0,0,0,0|2,0,0]=4 663 B11R0.429 CC(C)(C)OC[C@](C)(N)C(=O)O MCULE-6946226799 [0,2,0,0,0,0|2,0,0]=4 664 B9R1.66 CC1(CC(=O)CCN1)C MCULE-7066435466 [1,0,0,1,0,0|2,0,0]=4 665 B9R1.66 CC1(CC(=O)CCN1)C MCULE-7610772996 [1,0,0,1,0,0|2,0,0]=4 666 B9R1.66 CC1(CC(=O)CCO1)C MCULE-8996731620 [1,0,0,1,0,0|2,0,0]=4 667 B9R1.66 CC1(CCCC(=O)C1)C MCULE-5947496314 [1,0,0,1,0,0|1,0,0]=3 668 B9R1.66 CC1(CCCC(=O)N1)C MCULE-9506005736 [1,0,0,1,0,0|2,0,0]=4 669 B9R1.66 CC1(CCCC(C1)O)C MCULE-3782371278 [1,0,0,1,0,0|1,0,1]=4 670 B9R1.66 CC1(CCNC(=O)C1)C MCULE-5703517542 [1,0,0,1,0,0|2,0,0]=4 671 B9R1.66 CC1(CCOC(=O)C1)C MCULE-4727187858 [1,0,0,1,0,0|2,0,0]=4 672 B9R1.66 CC1(COCC(=O)C1)C MCULE-9899246450 [1,0,0,1,0,0|2,0,0]=4 673 B9R1.66 CC1(CSCC(=O)C1)C MCULE-2479165636 [1,0,0,1,0,0|2,0,0]=4 674 B9R1.68 CC(C)(C)C1CCC1=O MCULE-2561758479 [1,0,0,1,0,0|1,0,0]=3 675 B9R1.77 CC1(CC1CCCO)C MCULE-7584967346 [1,0,0,1,0,0|1,0,1]=4 676 B9R1.87 CC(C)(C)C1CC1CO MCULE-8025013719 [1,0,0,1,0,0|1,0,1]=4 677 B9R1.114 C[N+](C)(C)CC1CCC1 MCULE-1932125611 [1,0,0,1,0,0|1,0,1]=4 678 B9R1.114 C[N+](C)(C)CC1CCC1 MCULE-3640701864 [1,0,0,1,0,0|1,0,1]=4 679 B9R1.133 CC1(CC(CO1)C=O)C MCULE-5892294850 [1,0,0,1,0,0|2,0,0]=4 680 B9R1.148 C[N+]1(CCCCCC1)C MCULE-1829260472 [1,0,0,1,0,0|1,0,1]=4 681 B9R1.148 C[N+]1(CCCCCC1)C MCULE-7950987433 [1,0,0,1,0,0|1,0,1]=4 682 B9R1.35 C1(CCC(=O)C1)C(=O)O MCULE-7485965564 [1,0,0,1,0,0|2,0,0]=4 683 B9R1.35 C1(CCN(C1)C)C(=O)O MCULE-6561840637 [1,0,0,1,0,0|0,0,1]=3 684 B9R1.35 C1(CCN(C1)C)C(=O)O MCULE-7766846765 [1,0,0,1,0,0|0,0,1]=3 685 B9R1.35 C=C1CCC(C1)C(=O)O MCULE-7982355069 [1,0,0,1,0,0|1,0,1]=4 686 B9R1.35 CC(=O)C1CCC(=O)O1 MCULE-5049805875 [1,0,0,1,0,0|2,0,0]=4 687 B9R1.35 CC(=O)C1CCN(C1)C MCULE-4293303594 [1,0,0,1,0,0|1,0,1]=4 688 B9R1.35 CC(C)C1CCC(=O)C1 MCULE-7380487072 [1,0,0,1,0,0|2,0,0]=4 689 B9R1.35 CC(C)C1CCC(=O)N1 MCULE-4396910868 [1,0,0,1,0,0|2,0,0]=4 690 B9R1.35 CC(C)C1CNC(=O)O1 MCULE-1501293157 [1,0,0,1,0,0|2,0,0]=4 691 B9R1.35 CC(C)[C@@H]1CCC(=O)N1 MCULE-8463254156 [1,0,0,1,0,0|2,0,0]=4 692 B9R1.35 CC(C)[C@@H]1CCC(=O)N1 MCULE-9798698843 [1,0,0,1,0,0|2,0,0]=4 693 B9R1.35 CC(C)[C@H]1CCC(=O)N1 MCULE-1275403270 [1,0,0,1,0,0|2,0,0]=4 694 B9R1.35 CC1=NC(CC1)C(=O)O MCULE-1278773172 [1,0,0,1,0,0|2,0,0]=4 695 B9R1.35 CC1=NC(CC1)C(=O)O MCULE-5768248357 [1,0,0,1,0,0|2,0,0]=4 696 B9R1.35 CC1CC(CO1)C(=O)O MCULE-6422706201 [1,0,0,1,0,0|2,0,0]=4 697 B9R1.35 CC1CCC(C1)C(=O)O MCULE-5009837194 [1,0,0,1,0,0|1,0,0]=3 698 B9R1.35 CC1CCC(N1)C(=O)O MCULE-7716142893 [1,0,0,1,0,0|2,0,0]=4 699 B9R1.35 CC1CCC(N1)C(=O)O MCULE-7805688291 [1,0,0,1,0,0|2,0,0]=4 700 B9R1.35 CC1CCC(O1)C(=O)O MCULE-7354058760 [1,0,0,1,0,0|2,0,0]=4 701 B9R1.35 CC1CNC(C1)C(=O)O MCULE-5999128275 [1,0,0,1,0,0|2,0,0]=4 702 B9R1.35 CC1CNC(C1)C(=O)O MCULE-9035040660 [1,0,0,1,0,0|2,0,0]=4 703 B9R1.35 CC1COC(C1)C(=O)O MCULE-4317519603 [1,0,0,1,0,0|2,0,0]=4 704 B9R1.35 CN1CCC(C1)C(=O)O MCULE-5724245212 [1,0,0,1,0,0|0,0,1]=3 705 B9R1.35 CN1CCC(C1)C(=O)O MCULE-6263233064 [1,0,0,1,0,0|0,0,1]=3 706 B9R1.35 CN1CC[C@@H](C1)C(=O)O MCULE-1382244459 [1,0,0,1,0,0|0,0,1]=3 707 B9R1.35 CN1CC[C@@H](C1)C(=O)O MCULE-1492032594 [1,0,0,1,0,0|0,0,1]=3 708 B9R1.35 CN1CC[C@H](C1)C(=O)O MCULE-1080921095 [1,0,0,1,0,0|0,0,1]=3 709 B9R1.35 CN1CC[C@H](C1)C(=O)O MCULE-5145674459 [1,0,0,1,0,0|0,0,1]=3 710 B9R1.35 CN1CC[C@H](C1)C(=O)O MCULE-5820812779 [1,0,0,1,0,0|0,0,1]=3 711 B9R1.35 CN1CC[C@H](C1)C(=O)O MCULE-7587726735 [1,0,0,1,0,0|0,0,1]=3 712 B9R1.35 C[C@@H]1CC[C@@H](N1)C(=O)O MCULE-1712610304 [1,0,0,1,0,0|2,0,0]=4 713 B9R1.35 C[C@@H]1CC[C@@H](N1)C(=O)O MCULE-3564743814 [1,0,0,1,0,0|2,0,0]=4 714 B9R1.35 C[C@@H]1CC[C@@H](O1)C(=O)O MCULE-2451266259 [1,0,0,1,0,0|2,0,0]=4 715 B9R1.35 C[C@@H]1CC[C@@H](O1)C(=O)O MCULE-9559412763 [1,0,0,1,0,0|2,0,0]=4 716 B9R1.35 C[C@@H]1CC[C@H](N1)C(=O)O MCULE-1486502980 [1,0,0,1,0,0|2,0,0]=4 717 B9R1.35 C[C@@H]1CC[C@H](N1)C(=O)O MCULE-2728269167 [1,0,0,1,0,0|2,0,0]=4 718 B9R1.35 C[C@@H]1CC[C@H](N1)C(=O)O MCULE-4518040079 [1,0,0,1,0,0|2,0,0]=4 719 B9R1.35 C[C@@H]1CC[C@H](N1)C(=O)O MCULE-5687588737 [1,0,0,1,0,0|2,0,0]=4 720 B9R1.35 C[C@@H]1CC[C@H](N1)C(=O)O MCULE-5969663507 [1,0,0,1,0,0|2,0,0]=4 721 B9R1.35 C[C@@H]1CC[C@H](N1)C(=O)O MCULE-7325534692 [1,0,0,1,0,0|2,0,0]=4 722 B9R1.35 C[C@@H]1CN[C@@H](C1)C(=O)O MCULE-1541572989 [1,0,0,1,0,0|2,0,0]=4 723 B9R1.35 C[C@@H]1CN[C@@H](C1)C(=O)O MCULE-1821254522 [1,0,0,1,0,0|2,0,0]=4 724 B9R1.35 C[C@@H]1CN[C@@H](C1)C(=O)O MCULE-7426280517 [1,0,0,1,0,0|2,0,0]=4 725 B9R1.35 C[C@@H]1CN[C@@H](C1)C(=O)O MCULE-8599307960 [1,0,0,1,0,0|2,0,0]=4 726 B9R1.35 C[C@H]1CC[C@@H](N1)C(=O)O MCULE-3116688346 [1,0,0,1,0,0|2,0,0]=4 727 B9R1.35 C[C@H]1CC[C@@H](N1)C(=O)O MCULE-3630959366 [1,0,0,1,0,0|2,0,0]=4 728 B9R1.35 C[C@H]1CC[C@@H](N1)C(=O)O MCULE-9043504063 [1,0,0,1,0,0|2,0,0]=4 729 B9R1.35 C[C@H]1CC[C@@H](N1)C(=O)O MCULE-9322368857 [1,0,0,1,0,0|2,0,0]=4 730 B9R1.35 C[C@H]1CN[C@@H](C1)C(=O)O MCULE-2036600768 [1,0,0,1,0,0|2,0,0]=4 731 B9R1.35 C[C@H]1CN[C@@H](C1)C(=O)O MCULE-4646350445 [1,0,0,1,0,0|2,0,0]=4 732 B9R1.35 C[C@H]1CN[C@H](C1)C(=O)O MCULE-2974063836 [1,0,0,1,0,0|2,0,0]=4 733 B9R1.35 C[C@H]1CN[C@H](C1)C(=O)O MCULE-7564386283 [1,0,0,1,0,0|2,0,0]=4 734 B9R1.35 NC1CCC(C1)C(=O)O MCULE-1740452568 [1,0,0,1,0,0|2,0,0]=4 735 B9R1.35 NC1CCC(C1)C(=O)O MCULE-4067702279 [1,0,0,1,0,0|2,0,0]=4 736 B9R1.35 N[C@@H]1CC[C@@H](C1)C(=O)O MCULE-1729778339 [1,0,0,1,0,0|2,0,0]=4 737 B9R1.35 N[C@@H]1CC[C@@H](C1)C(=O)O MCULE-2964730214 [1,0,0,1,0,0|2,0,0]=4 738 B9R1.35 N[C@@H]1CC[C@@H](C1)C(=O)O MCULE-6758665117 [1,0,0,1,0,0|2,0,0]=4 739 B9R1.35 N[C@@H]1CC[C@@H](C1)C(=O)O MCULE-8002401712 [1,0,0,1,0,0|2,0,0]=4 740 B9R1.35 N[C@@H]1CC[C@H](C1)C(=O)O MCULE-1941635524 [1,0,0,1,0,0|2,0,0]=4 741 B9R1.35 N[C@@H]1CC[C@H](C1)C(=O)O MCULE-3306995596 [1,0,0,1,0,0|2,0,0]=4 742 B9R1.35 N[C@@H]1CC[C@H](C1)C(=O)O MCULE-5728201062 [1,0,0,1,0,0|2,0,0]=4 743 B9R1.35 N[C@@H]1CC[C@H](C1)C(=O)O MCULE-8515718052 [1,0,0,1,0,0|2,0,0]=4 744 B9R1.35 N[C@H]1CC[C@@H](C1)C(=O)O MCULE-3382663689 [1,0,0,1,0,0|2,0,0]=4 745 B9R1.35 N[C@H]1CC[C@@H](C1)C(=O)O MCULE-7889100863 [1,0,0,1,0,0|2,0,0]=4 746 B9R1.35 N[C@H]1CC[C@@H](C1)C(=O)O MCULE-9213747671 [1,0,0,1,0,0|2,0,0]=4 747 B9R1.35 N[C@H]1CC[C@@H](C1)C(=O)O MCULE-9781594017 [1,0,0,1,0,0|2,0,0]=4 748 B9R1.35 N[C@H]1CC[C@H](C1)C(=O)O MCULE-1569946940 [1,0,0,1,0,0|2,0,0]=4 749 B9R1.35 N[C@H]1CC[C@H](C1)C(=O)O MCULE-1675680486 [1,0,0,1,0,0|2,0,0]=4 750 B9R1.35 N[C@H]1CC[C@H](C1)C(=O)O MCULE-1903292573 [1,0,0,1,0,0|2,0,0]=4 751 B9R1.35 N[C@H]1CC[C@H](C1)C(=O)O MCULE-6695566760 [1,0,0,1,0,0|2,0,0]=4 752 B9R1.35 N[C@H]1CC[C@H](C1)C(=O)O MCULE-6999679319 [1,0,0,1,0,0|2,0,0]=4 753 B9R1.35 N[C@H]1CC[C@H](C1)C(=O)O MCULE-8009804408 [1,0,0,1,0,0|2,0,0]=4 754 B9R1.35 O=C(O)C1CCC(C1)Br MCULE-3893521468 [1,0,0,1,0,0|2,0,0]=4 755 B9R1.35 O=C(O)C1CCC(C1)F MCULE-5981771251 [1,0,0,1,0,0|2,0,0]=4 756 B9R1.35 O=C(O)C1CCC(C1)O MCULE-3301759971 [1,0,0,1,0,0|2,0,0]=4 757 B9R1.35 O=C(O)[C@@H]1CC[C@@H](C1)O MCULE-2017780821 [1,0,0,1,0,0|2,0,0]=4 758 B9R1.35 O=C(O)[C@@H]1CC[C@@H](C1)O MCULE-8789755356 [1,0,0,1,0,0|2,0,0]=4 759 B9R1.35 O=C(O)[C@@H]1CC[C@H](C1)O MCULE-6133795580 [1,0,0,1,0,0|2,0,0]=4 760 B9R1.35 O=C(O)[C@H]1CC[C@@H](C1)O MCULE-3061487094 [1,0,0,1,0,0|2,0,0]=4 761 B9R1.35 O=C(O)[C@H]1CC[C@@H](C1)O MCULE-8079944181 [1,0,0,1,0,0|2,0,0]=4 762 B9R1.35 O=C(O)[C@H]1CC[C@H](C1)O MCULE-2713143734 [1,0,0,1,0,0|2,0,0]=4 763 B9R1.35 O=C1CCC(C1)C(=O)O MCULE-8715651663 [1,0,0,1,0,0|2,0,0]=4 764 B9R1.35 O=C1CC[C@@H](C1)C(=O)O MCULE-1554776363 [1,0,0,1,0,0|2,0,0]=4 765 B9R1.35 O=C1CC[C@@H](C1)C(=O)O MCULE-4649943680 [1,0,0,1,0,0|2,0,0]=4 766 B9R1.35 O=C1CC[C@H](C1)C(=O)O MCULE-6597072682 [1,0,0,1,0,0|2,0,0]=4 767 B9R1.35 O=C1CC[C@H](C1)C(=O)O MCULE-7880064966 [1,0,0,1,0,0|2,0,0]=4 768 B9R1.35 [C@H]1(CC[C@H](C1)C(=O)O)N MCULE-1734860042 [1,0,0,1,0,0|2,0,0]=4 769 B9R1.35 [C@H]1(CC[C@H](C1)C(=O)O)N MCULE-3698574567 [1,0,0,1,0,0|2,0,0]=4 770 B9R1.49 CC1CCCC(=O)CC1 MCULE-8026581790 [1,0,0,1,0,0|2,0,0]=4 771 B9R1.49 CN1CCCC(=O)CC1 MCULE-1607887623 [1,0,0,1,0,0|1,0,1]=4 772 B9R1.49 CN1CCCC(=O)CC1 MCULE-9380092932 [1,0,0,1,0,0|1,0,1]=4 773 B9R1.53 CC(C)CC1CC(=O)N1 MCULE-7772282181 [1,0,0,1,0,0|2,0,0]=4 774 B9R1.53 CC1CC(C1)CC(=O)O MCULE-1823232756 [1,0,0,1,0,0|1,0,0]=3 775 B9R1.53 CN1CC(C1)CC(=O)O MCULE-6114587935 [1,0,0,1,0,0|0,0,1]=3 776 B9R1.53 CN1CC(C1)CC(=O)O MCULE-6524445855 [1,0,0,1,0,0|0,0,1]=3 777 B9R1.53 NC1CC(C1)CC(=O)O MCULE-1535901081 [1,0,0,1,0,0|2,0,0]=4 778 B9R1.53 NC1CC(C1)CC(=O)O MCULE-4536482207 [1,0,0,1,0,0|2,0,0]=4 779 B9R1.53 N[C@H]1C[C@@H](C1)CC(=O)O MCULE-2333675175 [1,0,0,1,0,0|2,0,0]=4 780 B9R1.53 N[C@H]1C[C@@H](C1)CC(=O)O MCULE-3710409300 [1,0,0,1,0,0|2,0,0]=4 781 B9R1.53 N[C@H]1C[C@H](C1)CC(=O)O MCULE-1039324799 [1,0,0,1,0,0|2,0,0]=4 782 B9R1.53 N[C@H]1C[C@H](C1)CC(=O)O MCULE-3309485111 [1,0,0,1,0,0|2,0,0]=4 783 B9R1.53 O=C(O)CC1CC(=O)C1 MCULE-5236898540 [1,0,0,1,0,0|2,0,0]=4 784 B9R1.53 O=C(O)CC1CC(C1)F MCULE-2736771844 [1,0,0,1,0,0|2,0,0]=4 785 B9R1.85 O=C(O)CCCC1CC1 MCULE-4019156455 [1,0,0,1,0,0|1,0,0]=3 786 B9R1.85 O=C(O)CCNC1CC1 MCULE-2302148090 [1,0,0,1,0,0|2,0,0]=4 787 B9R1.85 O=C(O)CCNC1CC1 MCULE-5027011962 [1,0,0,1,0,0|2,0,0]=4 788 B9R1.85 O=C(O)CCOC1CC1 MCULE-6940104376 [1,0,0,1,0,0|2,0,0]=4 789 B9R1.85 O=C(O)CCSC1CC1 MCULE-5319803876 [1,0,0,1,0,0|2,0,0]=4 790 B9R1.85 O=C(O)CNCC1CC1 MCULE-2914571109 [1,0,0,1,0,0|2,0,0]=4 791 B9R1.85 O=C(O)CNCC1CC1 MCULE-8479764724 [1,0,0,1,0,0|2,0,0]=4 792 B9R1.85 O=C(O)COCC1CC1 MCULE-1838251623 [1,0,0,1,0,0|2,0,0]=4 793 B9R1.85 O=C(O)CSCC1CC1 MCULE-7765855577 [1,0,0,1,0,0|2,0,0]=4 794 B9R1.161 CC(C)C1CC1C(=O)O MCULE-4298027549 [1,0,0,1,0,0|1,0,0]=3 795 B9R1.166 C1(NCC1(C)C)C(=O)O MCULE-8091738282 [1,0,0,1,0,0|2,0,0]=4 796 B9R1.166 CC1(CCC1C(=O)O)C MCULE-4099946993 [1,0,0,1,0,0|1,0,0]=3 797 B9R1.166 CC1(CNC1C(=O)O)C MCULE-8386082188 [1,0,0,1,0,0|2,0,0]=4 798 B9R1.166 CC1(CNC1C(=O)O)C MCULE-9067770862 [1,0,0,1,0,0|2,0,0]=4 799 B9R1.166 CC1(CN[C@@H]1C(=O)O)C MCULE-3707363843 [1,0,0,1,0,0|2,0,0]=4 800 B9R1.166 CC1(CN[C@@H]1C(=O)O)C MCULE-5671349948 [1,0,0,1,0,0|2,0,0]=4 801 B9R1.166 CC1(CN[C@H]1C(=O)O)C MCULE-3480839319 [1,0,0,1,0,0|2,0,0]=4 802 B9R1.170 CC1(CC1CC(=O)O)C MCULE-4662857705 [1,0,0,1,0,0|1,0,0]=3 803 B9R1.10 CC1(CCC(=O)CC1)C MCULE-3284069816 [0,0,0,1,1,0|2,0,0]=4 804 B9R1.10 CC1(CCC(=O)NC1)C MCULE-9831115400 [0,0,0,1,1,0|2,0,0]=4 805 B9R1.10 CC1(COC(=O)OC1)C MCULE-7387597557 [0,0,0,1,1,0|2,0,0]=4 806 B9R1.10 C[N+]1(CCC(=O)CC1)C MCULE-4233939262 [0,0,0,1,1,0|1,0,0]=3 807 B9R1.10 C[N+]1(CCC(=O)CC1)C MCULE-6424774965 [0,0,0,1,1,0|1,0,0]=3 808 B9R1.10 C[Si]1(CCC(=O)CC1)C MCULE-5205216597 [0,0,0,1,1,0|2,0,0]=4 809 B9R1.51 CC(C)(C)C1CC(=O)C1 MCULE-2438920016 [0,0,0,1,1,0|2,0,0]=4 810 B9R1.51 CC(C)(C)C1CC(=O)N1 MCULE-5500433197 [0,0,0,1,1,0|2,0,0]=4 811 B9R1.147 CC1(CC1)CCC(=O)O MCULE-7141144115 [0,0,0,1,1,0|1,0,0]=3 812 B9R1.147 O=C(O)CCC1(CC1)O MCULE-2890628610 [0,0,0,1,1,0|2,0,0]=4 813 B9R1.164 CC1(CC(C1)C(=O)Cl)C MCULE-8399715648 [0,0,0,1,1,0|2,0,0]=4 814 B9R1.164 CC1(CC(C1)C(=O)N)C MCULE-1074701777 [0,0,0,1,1,0|2,0,0]=4 815 B9R1.164 CC1(CC(C1)C(=O)O)C MCULE-2113829273 [0,0,0,1,1,0|1,0,0]=3 816 B9R1.164 CC1(CC(C1)C(=O)O)F MCULE-6709976888 [0,0,0,1,1,0|2,0,0]=4 817 B9R1.164 CC1(CC(C1)C(=O)O)O MCULE-2222519984 [0,0,0,1,1,0|2,0,0]=4 818 B9R1.164 C[C@@]1(C[C@@H](C1)C(=O)O)F MCULE-5383135274 [0,0,0,1,1,0|2,0,0]=4 819 B9R1.164 C[C@@]1(C[C@@H](C1)C(=O)O)O MCULE-4467958139 [0,0,0,1,1,0|2,0,0]=4 820 B9R1.164 C[C@@]1(C[C@H](C1)C(=O)O)F MCULE-3132782538 [0,0,0,1,1,0|2,0,0]=4 821 B9R1.164 C[C@@]1(C[C@H](C1)C(=O)O)O MCULE-3757447768 [0,0,0,1,1,0|2,0,0]=4 822 B11R1.76 CC(C)(C)CC1CNC(=O)C1 MCULE-8437730355 [0,0,0,1,0,1|2,0,0]=4 823 B11R1.76 CC(C)(C)CC1CNC(=O)O1 MCULE-4760632735 [0,0,0,1,0,1|1,0,0]=3 824 B11R1.155 CC(C)(C)C1CC(=O)CCN1 MCULE-5192089684 [0,0,0,1,0,1|2,0,0]=4 825 B11R1.155 CC(C)(C)C1CC(=O)CCN1 MCULE-7000594000 [0,0,0,1,0,1|2,0,0]=4 826 B11R1.155 CC(C)(C)C1CC(=O)CCO1 MCULE-5826329986 [0,0,0,1,0,1|2,0,0]=4 827 B11R1.155 CC(C)(C)C1CCCC(=O)C1 MCULE-8313965756 [0,0,0,1,0,1|2,0,0]=4 828 B11R1.155 CC(C)(C)N1CCCC(=O)C1 MCULE-1047835029 [0,0,0,1,0,1|2,0,0]=4 829 B11R1.155 CC(C)(C)N1CCCC(=O)C1 MCULE-2437591995 [0,0,0,1,0,1|2,0,0]=4 830 B11R1.155 CC(C)(C)[C@@H]1CCCC(=O)C1 MCULE-7211183919 [0,0,0,1,0,1|2,0,0]=4 831 B11R1.155 CC(C)(C)[C@H]1CCCC(=O)C1 MCULE-1680632415 [0,0,0,1,0,1|2,0,0]=4 832 B11R1.705 CC(C)(C)O[C@@H]1C[C@H]1C(=O)O MCULE-8224652100 [0,0,0,1,0,1|1,0,0]=3 833 B11R1.710 CC1(CC(CO1)CC(=O)O)C MCULE-7603770062 [0,0,0,1,0,1|1,0,0]=3 834 B11R1.710 CC1(CCN(C1)CC(=O)O)C MCULE-1947303701 [0,0,0,1,0,1|1,0,0]=3 835 B11R1.710 CC1(CCN(C1)CC(=O)O)C MCULE-3478403943 [0,0,0,1,0,1|1,0,0]=3 836 B11R1.710 CC1(COC(C1)CC(=O)O)C MCULE-9149987188 [0,0,0,1,0,1|1,0,0]=3 837 B11R1.730 CC(=O)C1CCOC(C1)(C)C MCULE-6929681629 [0,0,0,1,0,1|2,0,0]=4 838 B11R1.730 CC1(CC(CCN1)C(=O)O)C MCULE-8159392480 [0,0,0,1,0,1|1,0,0]=3 839 B11R1.730 CC1(CC(CCO1)C(=O)Cl)C MCULE-1487251101 [0,0,0,1,0,1|2,0,0]=4 840 B11R1.730 CC1(CC(CCO1)C(=O)O)C MCULE-5978480117 [0,0,0,1,0,1|1,0,0]=3 841 B11R1.730 CC1(CCC=C(C1)C(=O)O)C MCULE-7732020212 [0,0,0,1,0,1|1,0,1]=4 842 B11R1.730 CC1(CCCC(C1)C(=O)O)C MCULE-1597122526 [0,0,0,1,0,1|1,0,0]=3 843 B11R1.730 CC1(CCCC(O1)C(=O)O)C MCULE-6134883479 [0,0,0,1,0,1|2,0,0]=4 844 B11R1.730 CC1(CCCN(C1)C(=O)Cl)C MCULE-7087297832 [0,0,0,1,0,1|2,0,0]=4 845 B11R1.730 CC1(CCNC(C1)C(=O)O)C MCULE-1186852121 [0,0,0,1,0,1|1,0,0]=3 846 B11R1.730 CC1(CCNC(C1)C(=O)O)C MCULE-5031883785 [0,0,0,1,0,1|1,0,0]=3 847 B11R1.730 CC1(CNCC(O1)C(=O)O)C MCULE-3850941228 [0,0,0,1,0,1|2,0,0]=4 848 B11R1.730 CC1(CNCC(O1)C(=O)O)C MCULE-4368873526 [0,0,0,1,0,1|2,0,0]=4 849 B11R1.730 CC1(COCC(N1)C(=O)O)C MCULE-9878578908 [0,0,0,1,0,1|2,0,0]=4 850 B11R1.730 CC1(COCC(O1)C(=O)O)C MCULE-8209803482 [0,0,0,1,0,1|2,0,0]=4 851 B11R1.731 CC(C)(C)N1CCC1C(=O)O MCULE-9554064761 [0,0,0,1,0,1|1,0,0]=3 852 B11R1.19 CC(C)(C)C1CCC(=O)CC1 MCULE-7473209514 [0,1,0,1,0,0|2,0,0]=4 853 B11R1.19 C[Si](C)(C)C1CCC(=O)CC1 MCULE-5643539080 [0,1,0,1,0,0|2,0,0]=4 854 B11R1.571 C[N+](C)(C)C1CCS(=O)(=O)C1 MCULE-7029956312 [0,1,0,1,0,0|1,0,1]=4 855 B11R1.571 C[N+](C)(C)C1CCS(=O)(=O)C1 MCULE-8719379133 [0,1,0,1,0,0|1,0,1]=4 856 B11R1.571 C[N+](C)(C)C1CCS(=O)(=O)C1 MCULE-8744093163 [0,1,0,1,0,0|1,0,1]=4 857 B11R1.571 C[N+](C)(C)C1CCS(=O)(=O)C1 MCULE-9220561581 [0,1,0,1,0,0|1,0,1]=4 858 B11R1.707 CC(C)(C)C1CC(C1)C(=O)O MCULE-1068157248 [0,1,0,1,0,0|1,0,0]=3 859 B11R1.707 CC(C)(C)C1CC(C1)C(=O)O MCULE-7233708696 [0,1,0,1,0,0|1,0,0]=3 860 B11R1.707 CC(C)(C)N1CC(C1)C(=O)O MCULE-7015312301 [0,1,0,1,0,0|2,0,0]=4 861 B11R1.707 CC(C)(O)[C@H]1C[C@@H](C1)C(=O)O MCULE-8520903082 [0,1,0,1,0,0|2,0,0]=4 862 B11R1.707 CC(C)(O)[C@H]1C[C@H](C1)C(=O)O MCULE-4405576767 [0,1,0,1,0,0|2,0,0]=4 863 B11R1.488 C1(CC(CN1C)(C)C)C(=O)O MCULE-6724058618 [0,1,0,1,0,0|2,0,0]=4 864 B11R1.488 CN1CC(CC1C(=O)O)(C)C MCULE-4454904930 [0,1,0,1,0,0|2,0,0]=4 865 B11R1.488 CN1CC(C[C@H]1C(=O)O)(C)C MCULE-1093985166 [0,1,0,1,0,0|2,0,0]=4 866 B11R1.488 CN1CC(C[C@H]1C(=O)O)(C)C MCULE-9299428008 [0,1,0,1,0,0|2,0,0]=4 867 B11R1.488 C[N+]1(C[C@@H]([C@H](C1)O)C(=O)[O-])C MCULE-3640448441 [0,1,0,1,0,0|0,0,1]=3 868 B11R1.866 COC(=O)C1CNC(C1)(C)C MCULE-4704333642 [0,1,0,1,0,0|2,0,0]=4 869 B11R1.866 COC(=O)C1CNC(C1)(C)C MCULE-8552388473 [0,1,0,1,0,0|2,0,0]=4 870 B11R1.866 COC(=O)[C@@H]1CC(CN1)(C)C MCULE-8589256605 [0,1,0,1,0,0|2,0,0]=4 871 B11R1.866 COC(=O)[C@@H]1CC(CN1)(C)C MCULE-9327719540 [0,1,0,1,0,0|2,0,0]=4 872 B11R1.413 COC1(CN(C1)CC(=O)O)C MCULE-2786578100 [0,1,0,1,0,0|2,0,0]=4 873 B11R1.413 COC1(CN(C1)CC(=O)O)C MCULE-5497690918 [0,1,0,1,0,0|2,0,0]=4 874 B11R1.727 CC(=O)N1CC[N+](CC1)(C)C MCULE-2540493698 [0,1,0,1,0,0|2,0,0]=4 875 B11R1.727 CC(=O)N1CC[N+](CC1)(C)C MCULE-6101583698 [0,1,0,1,0,0|2,0,0]=4 876 B11R1.727 CC1(CC=C(CC1)C(=O)O)C MCULE-8393208590 [0,1,0,1,0,0|1,0,1]=4 877 B11R1.727 CC1(CCC(CC1)C(=O)O)C MCULE-4077940511 [0,1,0,1,0,0|1,0,0]=3 878 B11R1.727 CC1(CCC(CC1)C(=O)O)O MCULE-4857156703 [0,1,0,1,0,0|2,0,0]=4 879 B11R1.727 CC1(CCC(CO1)C(=O)O)C MCULE-6004318139 [0,1,0,1,0,0|1,0,0]=3 880 B11R1.727 CC1(CCC(OC1)C(=O)O)C MCULE-4564560513 [0,1,0,1,0,0|1,0,0]=3 881 B11R1.727 CC1(CNC(CO1)C(=O)O)C MCULE-4256075993 [0,1,0,1,0,0|2,0,0]=4 882 B11R1.727 CC1(CNC(CO1)C(=O)O)C MCULE-7885479811 [0,1,0,1,0,0|2,0,0]=4 883 B11R1.727 CC1(CN[C@@H](CO1)C(=O)O)C MCULE-4507731051 [0,1,0,1,0,0|2,0,0]=4 884 B11R1.727 CC1(CN[C@@H](CO1)C(=O)O)C MCULE-6942026456 [0,1,0,1,0,0|2,0,0]=4 885 B11R1.727 CC1(CN[C@@H](CO1)C(=O)O)C MCULE-8456032294 [0,1,0,1,0,0|2,0,0]=4 886 B11R1.727 CC1(CN[C@@H](CO1)C(=O)O)C MCULE-9879183937 [0,1,0,1,0,0|2,0,0]=4 887 B11R1.727 CC1(CN[C@H](CO1)C(=O)O)C MCULE-1777900508 [0,1,0,1,0,0|2,0,0]=4 888 B11R1.727 CC1(CN[C@H](CO1)C(=O)O)C MCULE-3103501136 [0,1,0,1,0,0|2,0,0]=4 889 B11R1.727 CC1(CN[C@H](CO1)C(=O)O)C MCULE-3507812849 [0,1,0,1,0,0|2,0,0]=4 890 B11R1.727 CC1(CN[C@H](CO1)C(=O)O)C MCULE-7408744740 [0,1,0,1,0,0|2,0,0]=4 891 B11R1.727 CC1(COC(CN1)C(=O)O)C MCULE-4924802724 [0,1,0,1,0,0|2,0,0]=4 892 B11R1.727 CC1(COC(CN1)C(=O)O)C MCULE-8615912536 [0,1,0,1,0,0|2,0,0]=4 893 B11R1.727 CC1(COC(CO1)C(=O)O)C MCULE-2956860789 [0,1,0,1,0,0|2,0,0]=4 894 B11R1.727 CC1(OCC(CO1)C(=O)O)C MCULE-4017939892 [0,1,0,1,0,0|2,0,0]=4 895 B11R1.738 CC1(CCC(C1)(N)C(=O)O)C MCULE-1239891143 [0,1,0,1,0,0|1,0,0]=3 896 B11R1.738 CC1(CCC(C1)(N)C(=O)O)C MCULE-8274719221 [0,1,0,1,0,0|1,0,0]=3 897 B11R2.1077 CC1(CCC(=O)C2C1C2)C MCULE-4074172312 [0,0,0,2,0,0|2,0,0]=4 898 B11R2.1868 O=C(O)C1CC2(CC2)CN1 MCULE-4778549821 [0,0,0,2,0,0|2,0,0]=4 899 B11R2.1868 O=C(O)C1CC2(CC2)CN1 MCULE-7694970169 [0,0,0,2,0,0|2,0,0]=4 900 B11R2.1868 O=C(O)C1CC2(CC2)CN1 MCULE-9027822231 [0,0,0,2,0,0|2,0,0]=4 901 B11R2.1868 O=C(O)C1CC2(CC2)CN1 MCULE-9855562233 [0,0,0,2,0,0|2,0,0]=4 902 B11R2.1868 O=C(O)C1CC2(CC2)CO1 MCULE-6940085644 [0,0,0,2,0,0|2,0,0]=4 903 B11R2.1868 O=C(O)C1CCC2(C1)CC2 MCULE-1181145196 [0,0,0,2,0,0|1,0,0]=3 904 B11R2.1868 O=C(O)[C@@H]1CC2(CC2)CN1 MCULE-2871735191 [0,0,0,2,0,0|2,0,0]=4 905 B11R2.1868 O=C(O)[C@@H]1CC2(CC2)CN1 MCULE-6367003123 [0,0,0,2,0,0|2,0,0]=4 906 B11R2.1868 O=C(O)[C@@H]1CC2(CC2)CN1 MCULE-7465606427 [0,0,0,2,0,0|2,0,0]=4 907 B11R2.1868 O=C(O)[C@@H]1CC2(CC2)CN1 MCULE-9934623327 [0,0,0,2,0,0|2,0,0]=4 908 B11R2.1868 O=C(O)[C@H]1CC2(CC2)CN1 MCULE-1483590010 [0,0,0,2,0,0|2,0,0]=4 909 B11R2.1868 O=C(O)[C@H]1CC2(CC2)CN1 MCULE-5865619653 [0,0,0,2,0,0|2,0,0]=4 910 B11R2.2454 CC12CC(C1)(CO2)C(=O)O MCULE-9388225975 [0,0,0,2,0,0|2,0,0]=4 911 B11R2.2454 CC12CNC(C1)(C2)C(=O)O MCULE-4173417458 [0,0,0,2,0,0|2,0,0]=4 912 B11R2.2454 CC12CNC(C1)(C2)C(=O)O MCULE-6288913019 [0,0,0,2,0,0|2,0,0]=4 913 B11R2.2454 CC12COC(C1)(C2)C(=O)O MCULE-1758963057 [0,0,0,2,0,0|2,0,0]=4 914 B11R2.2454 CC12COC(C1)(C2)C(=O)O MCULE-5169487794 [0,0,0,2,0,0|2,0,0]=4 915 B11R2.2454 NC12CCC(C1)(C2)C(=O)O MCULE-4415557284 [0,0,0,2,0,0|2,0,0]=4 916 B11R2.2454 O=C(O)C12CCC(C1)(C2)F MCULE-8953867117 [0,0,0,2,0,0|2,0,0]=4 917 B11R2.1884 CC12CC(C1)(C2)CC(=O)O MCULE-1257610917 [0,0,0,2,0,0|1,0,0]=3 918 B11R2.1884 O=C(O)CC12CC(C1)(C2)F MCULE-9131099123 [0,0,0,2,0,0|2,0,0]=4 919 B7R0.6 C=C(C)CCC(=O)O MCULE-8738532812 [1,0,0,0,1,0|1,0,1]=4 920 B7R0.6 CC(=CCC(=O)O)C MCULE-2552993418 [1,0,0,0,1,0|1,0,1]=4 921 B7R0.6 CC(=O)CCC(=O)O MCULE-1392778065 [1,0,0,0,1,0|2,0,0]=4 922 B7R0.6 CC(=O)CCC(C)C MCULE-8518693213 [1,0,0,0,1,0|2,0,0]=4 923 B7R0.6 CC(=O)CCN(C)C MCULE-1601022082 [1,0,0,0,1,0|1,0,1]=4 924 B7R0.6 CC(=O)CCN(C)C MCULE-2933383790 [1,0,0,0,1,0|1,0,1]=4 925 B7R0.6 CC(C)CCC(=O)Cl MCULE-6874903195 [1,0,0,0,1,0|2,0,0]=4 926 B7R0.6 CC(C)CCC(=O)N MCULE-3571818514 [1,0,0,0,1,0|2,0,0]=4 927 B7R0.6 CC(C)CCC(=O)O MCULE-7691755837 [1,0,0,0,1,0|1,0,0]=3 928 B7R0.6 CC(C)NCC(=O)O MCULE-4344882030 [1,0,0,0,1,0|2,0,0]=4 929 B7R0.6 CC(C)NCC(=O)O MCULE-7052227156 [1,0,0,0,1,0|2,0,0]=4 930 B7R0.6 CC(C)OCC(=O)O MCULE-8295905061 [1,0,0,0,1,0|2,0,0]=4 931 B7R0.6 CC(C)SCC(=O)O MCULE-3990750464 [1,0,0,0,1,0|2,0,0]=4 932 B7R0.6 CC(N)CCC(=O)O MCULE-3711689460 [1,0,0,0,1,0|2,0,0]=4 933 B7R0.6 CC(N)CCC(=O)O MCULE-5008572656 [1,0,0,0,1,0|2,0,0]=4 934 B7R0.6 CC(O)CCC(=O)O MCULE-6352217997 [1,0,0,0,1,0|2,0,0]=4 935 B7R0.6 CC(S)CCC(=O)O MCULE-9612173883 [1,0,0,0,1,0|2,0,0]=4 936 B7R0.6 CN(C)CCC(=O)O MCULE-5553815845 [1,0,0,0,1,0|0,0,1]=3 937 B7R0.6 CN(C)CCC(=O)O MCULE-7454823322 [1,0,0,0,1,0|0,0,1]=3 938 B7R0.6 CS(=O)CCC(=O)O MCULE-8243349779 [1,0,0,0,1,0|2,0,0]=4 939 B7R0.6 C[C@@H](N)CCC(=O)O MCULE-3295260637 [1,0,0,0,1,0|2,0,0]=4 940 B7R0.6 C[C@@H](N)CCC(=O)O MCULE-5409083898 [1,0,0,0,1,0|2,0,0]=4 941 B7R0.6 C[C@@H](N)CCC(=O)O MCULE-6530230723 [1,0,0,0,1,0|2,0,0]=4 942 B7R0.6 C[C@@H](N)CCC(=O)O MCULE-7530095699 [1,0,0,0,1,0|2,0,0]=4 943 B7R0.6 C[C@H](N)CCC(=O)O MCULE-3621527632 [1,0,0,0,1,0|2,0,0]=4 944 B7R0.6 C[C@H](N)CCC(=O)O MCULE-7670557122 [1,0,0,0,1,0|2,0,0]=4 945 B7R0.6 C[S+](C)CCC(=O)O MCULE-8115187503 [1,0,0,0,1,0|1,0,0]=3 946 B7R0.6 C[S+](C)CCC(=O)O MCULE-9668037011 [1,0,0,0,1,0|1,0,0]=3 947 B7R0.6 C[S+](C)CCC(=O)[O-] MCULE-4039981521 [1,0,0,0,1,0|1,0,1]=4 948 B7R0.9 CC(=O)CC(C)(C)C MCULE-5477546626 [0,0,0,0,2,0|2,0,0]=4 949 B7R0.9 CC(C)(Br)CC(=O)O MCULE-2452885576 [0,0,0,0,2,0|2,0,0]=4 950 B7R0.9 CC(C)(C)CC(=O)Cl MCULE-6018997465 [0,0,0,0,2,0|2,0,0]=4 951 B7R0.9 CC(C)(C)CC(=O)N MCULE-5884141657 [0,0,0,0,2,0|2,0,0]=4 952 B7R0.9 CC(C)(C)CC(=O)O MCULE-8746589287 [0,0,0,0,2,0|1,0,0]=3 953 B7R0.9 CC(C)(N)CC(=O)O MCULE-1798345695 [0,0,0,0,2,0|2,0,0]=4 954 B7R0.9 CC(C)(N)CC(=O)O MCULE-4385513857 [0,0,0,0,2,0|2,0,0]=4 955 B7R0.9 CC(C)(N)CC(=O)O MCULE-7160776320 [0,0,0,0,2,0|2,0,0]=4 956 B7R0.9 CC(C)(O)CC(=O)O MCULE-3649642958 [0,0,0,0,2,0|2,0,0]=4 957 B7R0.9 CC(C)(S)CC(=O)O MCULE-6501202267 [0,0,0,0,2,0|2,0,0]=4 958 B7R0.9 CC(O)C[N+](C)(C)C MCULE-1986992067 [0,0,0,0,2,0|1,0,1]=4 959 B7R0.9 CC(O)C[N+](C)(C)C MCULE-5969734680 [0,0,0,0,2,0|1,0,1]=4 960 B7R0.9 CC(O)C[N+](C)(C)C MCULE-8120725010 [0,0,0,0,2,0|1,0,1]=4 961 B7R0.9 C[As+](C)(C)CC(=O)O MCULE-7167642312 [0,0,0,0,2,0|0,1,0]=3 962 B7R0.9 C[As+](C)(C)CC(=O)[O-] MCULE-4852790942 [0,0,0,0,2,0|0,1,1]=4 963 B7R0.9 C[N+](C)(C)CC(=O)Cl MCULE-1674168490 [0,0,0,0,2,0|1,0,0]=3 964 B7R0.9 C[N+](C)(C)CC(=O)Cl MCULE-2186832169 [0,0,0,0,2,0|1,0,0]=3 965 B7R0.9 C[N+](C)(C)CC(=O)N MCULE-3264501433 [0,0,0,0,2,0|1,0,0]=3 966 B7R0.9 C[N+](C)(C)CC(=O)N MCULE-9355968445 [0,0,0,0,2,0|1,0,0]=3 967 B7R0.9 C[N+](C)(C)CC(=O)O MCULE-5937838609 [0,0,0,0,2,0|0,0,0]=2 968 B7R0.9 C[N+](C)(C)CC(=O)[O-] MCULE-8745470661 [0,0,0,0,2,0|0,0,1]=3 969 B7R0.9 C[Si](C)(C)CC(=O)O MCULE-3888042601 [0,0,0,0,2,0|1,0,0]=3 970 B9R0.55 C=C(C)CCCCC(=O)O MCULE-2837812117 [1,0,0,0,0,1|1,0,1]=4 971 B9R0.55 CC(=CCCCC(=O)O)C MCULE-3753028092 [1,0,0,0,0,1|1,0,0]=3 972 B9R0.55 CC(=O)CCCCC(=O)O MCULE-6216368990 [1,0,0,0,0,1|2,0,0]=4 973 B9R0.55 CC(=O)CCCCC(C)C MCULE-8847308651 [1,0,0,0,0,1|2,0,0]=4 974 B9R0.55 CC(=O)CCCCN(C)C MCULE-4549437072 [1,0,0,0,0,1|1,0,1]=4 975 B9R0.55 CC(=O)CCOCC(C)C MCULE-8673860656 [1,0,0,0,0,1|2,0,0]=4 976 B9R0.55 CC(=O)NCCCC(=O)O MCULE-3194803041 [1,0,0,0,0,1|2,0,0]=4 977 B9R0.55 CC(=O)NCCCN(C)C MCULE-9928212719 [1,0,0,0,0,1|1,0,1]=4 978 B9R0.55 CC(=O)OCCCC(=O)O MCULE-3807110432 [1,0,0,0,0,1|2,0,0]=4 979 B9R0.55 CC(=O)SCCCC(=O)O MCULE-2047230148 [1,0,0,0,0,1|2,0,0]=4 980 B9R0.55 CC(C)C=CCCC(=O)O MCULE-4916288990 [1,0,0,0,0,1|1,0,1]=4 981 B9R0.55 CC(C)CCCCC(=O)N MCULE-5796308812 [1,0,0,0,0,1|2,0,0]=4 982 B9R0.55 CC(C)CCCCC(=O)O MCULE-9552597130 [1,0,0,0,0,1|1,0,0]=3 983 B9R0.55 CC(C)CCOCC(=O)O MCULE-8263995178 [1,0,0,0,0,1|1,0,0]=3 984 B9R0.55 CC(C)CCSCC(=O)O MCULE-6718693744 [1,0,0,0,0,1|1,0,0]=3 985 B9R0.55 CC(C)CNCCC(=O)O MCULE-7021054047 [1,0,0,0,0,1|1,0,0]=3 986 B9R0.55 CC(C)CNCCC(=O)O MCULE-7640501484 [1,0,0,0,0,1|1,0,0]=3 987 B9R0.55 CC(C)COCCC(=O)O MCULE-6429199224 [1,0,0,0,0,1|1,0,0]=3 988 B9R0.55 CC(C)CSCCC(=O)O MCULE-9529480904 [1,0,0,0,0,1|1,0,0]=3 989 B9R0.55 CC(C)NCCCC(=O)O MCULE-4053268267 [1,0,0,0,0,1|1,0,0]=3 990 B9R0.55 CC(C)NCCCC(=O)O MCULE-8505810240 [1,0,0,0,0,1|1,0,0]=3 991 B9R0.55 CC(C)OCCCC(=O)O MCULE-8577811101 [1,0,0,0,0,1|1,0,0]=3 992 B9R0.55 CC(C)SCCCC(=O)O MCULE-7082519548 [1,0,0,0,0,1|1,0,0]=3 993 B9R0.55 CC(N)CCCCC(=O)O MCULE-3306602652 [1,0,0,0,0,1|2,0,0]=4 994 B9R0.55 CC(N)CCCCC(=O)O MCULE-3909320120 [1,0,0,0,0,1|2,0,0]=4 995 B9R0.55 CN(C)CCCCC(=O)O MCULE-9080305665 [1,0,0,0,0,1|0,0,1]=3 996 B9R0.55 CN(C)CCCCC(=O)O MCULE-9325797900 [1,0,0,0,0,1|0,0,1]=3 997 B9R0.55 CN(C)CCCNC(=O)N MCULE-7609255843 [1,0,0,0,0,1|1,0,1]=4 998 B9R0.55 CN(C)CCCNC(=O)N MCULE-8074263689 [1,0,0,0,0,1|1,0,1]=4 999 B9R0.55 CN(C)CCNCC(=O)O MCULE-6551648059 [1,0,0,0,0,1|0,0,1]=3 1000 B9R0.55 CN(C)CCNCC(=O)O MCULE-7040720736 [1,0,0,0,0,1|0,0,1]=3 1001 B9R0.55 CN(C)CCOCC(=O)O MCULE-6117066964 [1,0,0,0,0,1|0,0,1]=3 1002 B9R0.55 CN(C)CCSCC(=O)O MCULE-5970767298 [1,0,0,0,0,1|0,0,1]=3 1003 B9R0.55 CN(C)CCSCC(=O)O MCULE-6364036095 [1,0,0,0,0,1|0,0,1]=3 1004 B11R0.31 CC(C)(C)CCCCCC(=O)Cl MCULE-4595321210 [0,0,0,0,0,2|2,0,0]=4 1005 B11R0.31 CC(C)(C)CCCCCC(=O)O MCULE-1306261101 [0,0,0,0,0,2|1,0,0]=3 1006 B11R0.31 C[Si](C)(C)CCCCCC(=O)O MCULE-9270767332 [0,0,0,0,0,2|1,0,0]=3