0 B10R1.329 CC1(CC(=O)CC(=O)C1)C MCULE-7089250511 [0,0,0,0,0,0|1,0,3]=4 1 B10R1.329 CC1(CC(CC(=O)N1)N)C MCULE-5922342661 [0,0,0,0,0,0|2,0,2]=4 2 B10R1.329 CC1(CC(CC(=O)N1)N)C MCULE-7808338375 [0,0,0,0,0,0|2,0,2]=4 3 B10R1.329 CC1(CC(CC(C1)O)N)C MCULE-7541006981 [0,0,0,0,0,0|1,0,0]=1 4 B10R1.329 CC1(C[C@@H](C[C@@H](C1)O)N)C MCULE-1878489576 [0,0,0,0,0,0|1,0,0]=1 5 B10R1.329 CC1=CC(=O)CC(C1)(C)C MCULE-5564101474 [0,0,0,0,0,0|0,0,4]=4 6 B10R1.329 CC1=CC(CC(C1)(C)C)O MCULE-2334510737 [0,0,0,0,0,0|0,0,2]=2 7 B10R1.329 CC1=NC(CC(O1)C)(C)C MCULE-8795092704 [0,0,0,0,0,0|3,0,1]=4 8 B10R1.329 CC1CC(=O)CC(C1)(C)C MCULE-9871375617 [0,0,0,0,0,0|0,0,2]=2 9 B10R1.329 CC1CC(CC(C1)(C)C)C MCULE-6576455597 [0,0,0,0,0,0|1,0,0]=1 10 B10R1.329 CC1CC(CC(C1)(C)C)N MCULE-1537195738 [0,0,0,0,0,0|1,0,0]=1 11 B10R1.329 CC1CC(CC(C1)(C)C)N MCULE-7416780548 [0,0,0,0,0,0|1,0,0]=1 12 B10R1.329 CC1CC(CC(C1)(C)C)O MCULE-2215850210 [0,0,0,0,0,0|0,0,0]=0 13 B10R1.329 CC1CC(CC(N1)(C)C)O MCULE-1005727909 [0,0,0,0,0,0|1,0,0]=1 14 B10R1.329 CC1CC(CC(N1)(C)C)O MCULE-6284651713 [0,0,0,0,0,0|1,0,0]=1 15 B10R1.329 CC1CC(N=C(O1)S)(C)C MCULE-1636063872 [0,0,0,0,0,0|2,1,1]=4 16 B10R1.329 CC1CC(NC(=O)O1)(C)C MCULE-9059038179 [0,0,0,0,0,0|2,0,2]=4 17 B10R1.329 CC1CC(NC(=S)S1)(C)C MCULE-1649287952 [0,0,0,0,0,0|2,1,1]=4 18 B10R1.329 CC1CC(OB(O1)O)(C)C MCULE-1239960028 [0,0,0,0,0,0|3,0,0]=3 19 B10R1.329 CC1CC(OC(O1)C)(C)C MCULE-5881056639 [0,0,0,0,0,0|3,0,0]=3 20 B10R1.329 CN1CC(CC(C1)(F)F)O MCULE-5466033142 [0,0,0,0,0,0|3,0,0]=3 21 B10R1.329 C[C@@H]1C[C@@H](CC(C1)(C)C)O MCULE-1032558152 [0,0,0,0,0,0|0,0,0]=0 22 B10R1.329 C[C@@H]1C[C@@H](CC(C1)(C)C)O MCULE-7025039245 [0,0,0,0,0,0|0,0,0]=0 23 B10R1.329 C[C@@H]1C[C@H](CC(C1)(C)C)O MCULE-1480131928 [0,0,0,0,0,0|0,0,0]=0 24 B10R1.329 C[C@H]1CC(=O)CC(C1)(C)C MCULE-8164278833 [0,0,0,0,0,0|0,0,2]=2 25 B10R1.329 C[C@H]1C[C@H](CC(C1)(C)C)O MCULE-6384145342 [0,0,0,0,0,0|0,0,0]=0 26 B10R1.329 C[C@H]1C[C@H](CC(C1)(C)C)O MCULE-6541264690 [0,0,0,0,0,0|0,0,0]=0 27 B9R1.34 CC1CC(=O)CC(C1)C MCULE-7560602452 [1,0,0,0,0,0|0,0,2]=3 28 B9R1.34 CC1CC(=O)CC(N1)C MCULE-6804146726 [1,0,0,0,0,0|1,0,2]=4 29 B9R1.34 CC1CC(=O)CC(N1)C MCULE-6840092000 [1,0,0,0,0,0|1,0,2]=4 30 B9R1.34 CC1CC(=O)CC(O1)C MCULE-3466195629 [1,0,0,0,0,0|1,0,2]=4 31 B9R1.34 CC1CC(CC(C1)I)C MCULE-7301496486 [1,0,0,0,0,0|1,0,0]=2 32 B9R1.34 CC1CC(CC(C1)N)C MCULE-9414280456 [1,0,0,0,0,0|1,0,0]=2 33 B9R1.34 CC1CC(CC(C1)O)C MCULE-5050137682 [1,0,0,0,0,0|0,0,0]=1 34 B9R1.34 CC1CC(CC(N1)C)N MCULE-6636033754 [1,0,0,0,0,0|2,0,0]=3 35 B9R1.34 CC1CC(CC(N1)C)O MCULE-8501155054 [1,0,0,0,0,0|1,0,0]=2 36 B9R1.34 CC1CC(CC(N1)C)O MCULE-9792793633 [1,0,0,0,0,0|1,0,0]=2 37 B9R1.34 CC1CC(CC(O1)C)N MCULE-1411888636 [1,0,0,0,0,0|2,0,0]=3 38 B9R1.34 CC1CC(CC(O1)C)O MCULE-6800301090 [1,0,0,0,0,0|1,0,0]=2 39 B9R1.34 CC1CC(CN(C1)C)O MCULE-7441770743 [1,0,0,0,0,0|1,0,0]=2 40 B9R1.34 CC1CC(CN(C1)C)O MCULE-9654842419 [1,0,0,0,0,0|1,0,0]=2 41 B9R1.34 CC1CC(NC(C1)C)C MCULE-3818865242 [1,0,0,0,0,0|2,0,0]=3 42 B9R1.34 CC1CC(NC(C1)C)C MCULE-6424784249 [1,0,0,0,0,0|2,0,0]=3 43 B9R1.34 CC1CN(CC(N1)C)C MCULE-6645813843 [1,0,0,0,0,0|3,0,0]=4 44 B9R1.34 CC1C[C@@H](N[C@@H](C1)C)C MCULE-2478664228 [1,0,0,0,0,0|2,0,0]=3 45 B9R1.34 CC1C[C@@H](N[C@@H](C1)C)C MCULE-9781173688 [1,0,0,0,0,0|2,0,0]=3 46 B9R1.34 CN1CC(CC(C1)F)N MCULE-1147985013 [1,0,0,0,0,0|3,0,0]=4 47 B9R1.34 CN1CC(CC(C1)O)O MCULE-9324935479 [1,0,0,0,0,0|2,0,0]=3 48 B9R1.34 C[C@@H]1CC(=O)C[C@H](N1)C MCULE-8209155173 [1,0,0,0,0,0|1,0,2]=4 49 B9R1.34 C[C@@H]1CC(=O)C[C@H](N1)C MCULE-9446746465 [1,0,0,0,0,0|1,0,2]=4 50 B9R1.34 C[C@@H]1CC(=O)C[C@H](O1)C MCULE-7023432709 [1,0,0,0,0,0|1,0,2]=4 51 B9R1.34 C[C@@H]1CC(C[C@H](N1)C)O MCULE-2538025513 [1,0,0,0,0,0|1,0,0]=2 52 B9R1.34 C[C@@H]1CC(C[C@H](N1)C)O MCULE-8633121448 [1,0,0,0,0,0|1,0,0]=2 53 B9R1.34 C[C@@H]1CC(C[C@H](O1)C)N MCULE-9882917405 [1,0,0,0,0,0|2,0,0]=3 54 B9R1.34 C[C@H]1CC(=O)C[C@@H](N1)C MCULE-2788235613 [1,0,0,0,0,0|1,0,2]=4 55 B9R1.34 C[C@H]1CC(=O)C[C@@H](N1)C MCULE-5366721571 [1,0,0,0,0,0|1,0,2]=4 56 B9R1.34 C[C@H]1CC(=O)C[C@H](N1)C MCULE-5181389040 [1,0,0,0,0,0|1,0,2]=4 57 B9R1.34 C[C@H]1CC(=O)C[C@H](N1)C MCULE-6787698072 [1,0,0,0,0,0|1,0,2]=4 58 B9R1.34 C[C@H]1CC(=O)C[C@H](O1)C MCULE-6710108830 [1,0,0,0,0,0|1,0,2]=4 59 B9R1.34 C[C@H]1CC(C[C@@H](O1)C)N MCULE-8190565336 [1,0,0,0,0,0|2,0,0]=3 60 B9R1.34 C[C@H]1C[C@@H](C[C@H](O1)C)N MCULE-6193156642 [1,0,0,0,0,0|2,0,0]=3 61 B9R1.34 C[C@H]1C[C@H](C[C@H](O1)C)N MCULE-8355560111 [1,0,0,0,0,0|2,0,0]=3 62 B9R1.34 C[C@H]1C[C@H](C[C@H](O1)C)O MCULE-3661941188 [1,0,0,0,0,0|1,0,0]=2 63 B9R1.34 N[C@H]1C[C@H](C[C@H](C1)N)N MCULE-1879676520 [1,0,0,0,0,0|3,0,0]=4 64 B9R1.34 N[C@H]1C[C@H](C[C@H](C1)N)N MCULE-6505795687 [1,0,0,0,0,0|3,0,0]=4 65 B9R1.34 O[C@H]1C[C@H](C[C@H](C1)O)O MCULE-2452108451 [1,0,0,0,0,0|2,0,0]=3 66 B9R1.66 CC1(CC(=O)CCN1)C MCULE-7066435466 [1,0,0,0,0,0|1,0,2]=4 67 B9R1.66 CC1(CC(=O)CCN1)C MCULE-7610772996 [1,0,0,0,0,0|1,0,2]=4 68 B9R1.66 CC1(CC(=O)CCO1)C MCULE-8996731620 [1,0,0,0,0,0|1,0,2]=4 69 B9R1.66 CC1(CC(CCN1)O)C MCULE-2419149405 [1,0,0,0,0,0|1,0,0]=2 70 B9R1.66 CC1(CC(CCN1)O)C MCULE-7717195334 [1,0,0,0,0,0|1,0,0]=2 71 B9R1.66 CC1(CC(CCO1)I)C MCULE-3160589515 [1,0,0,0,0,0|2,0,0]=3 72 B9R1.66 CC1(CC(CCO1)N)C MCULE-6983532480 [1,0,0,0,0,0|2,0,0]=3 73 B9R1.66 CC1(CC(CCO1)N)C MCULE-8609487253 [1,0,0,0,0,0|2,0,0]=3 74 B9R1.66 CC1(CC(CCO1)O)C MCULE-2938869680 [1,0,0,0,0,0|1,0,0]=2 75 B9R1.66 CC1(CC(CCO1)S)C MCULE-6622418897 [1,0,0,0,0,0|1,1,0]=3 76 B9R1.66 CC1(CC(CCS1)N)C MCULE-6799799298 [1,0,0,0,0,0|2,0,0]=3 77 B9R1.66 CC1(CC(CCS1)N)C MCULE-8179585347 [1,0,0,0,0,0|2,0,0]=3 78 B9R1.66 CC1(CCCC(=O)C1)C MCULE-5947496314 [1,0,0,0,0,0|0,0,2]=3 79 B9R1.66 CC1(CCCC(=O)N1)C MCULE-9506005736 [1,0,0,0,0,0|1,0,2]=4 80 B9R1.66 CC1(CCCC(C1)N)C MCULE-1882717078 [1,0,0,0,0,0|1,0,0]=2 81 B9R1.66 CC1(CCCC(C1)N)C MCULE-8036702375 [1,0,0,0,0,0|1,0,0]=2 82 B9R1.66 CC1(CCCC(C1)N)O MCULE-1871406142 [1,0,0,0,0,0|2,0,0]=3 83 B9R1.66 CC1(CCCC(C1)N)O MCULE-7398458626 [1,0,0,0,0,0|2,0,0]=3 84 B9R1.66 CC1(CCCC(C1)O)C MCULE-3782371278 [1,0,0,0,0,0|0,0,0]=1 85 B9R1.66 CC1(CCC[C@@H](C1)N)C MCULE-1518307544 [1,0,0,0,0,0|1,0,0]=2 86 B9R1.66 CC1(CCC[C@@H](C1)N)C MCULE-7855800021 [1,0,0,0,0,0|1,0,0]=2 87 B9R1.66 CC1(CCC[C@@H](C1)N)C MCULE-8858670078 [1,0,0,0,0,0|1,0,0]=2 88 B9R1.66 CC1(CCC[C@@H](C1)N)C MCULE-9021437451 [1,0,0,0,0,0|1,0,0]=2 89 B9R1.66 CC1(CCC[C@H](C1)N)C MCULE-1374259179 [1,0,0,0,0,0|1,0,0]=2 90 B9R1.66 CC1(CCC[C@H](C1)N)C MCULE-8829716498 [1,0,0,0,0,0|1,0,0]=2 91 B9R1.66 CC1(CCNC(=O)C1)C MCULE-5703517542 [1,0,0,0,0,0|1,0,2]=4 92 B9R1.66 CC1(CCOC(=O)C1)C MCULE-4727187858 [1,0,0,0,0,0|1,0,2]=4 93 B9R1.66 CC1(COCC(=O)C1)C MCULE-9899246450 [1,0,0,0,0,0|1,0,2]=4 94 B9R1.66 CC1(CS(=O)CCN1)C MCULE-8669500373 [1,0,0,0,0,0|2,0,1]=4 95 B9R1.66 CC1(CSCC(=O)C1)C MCULE-2479165636 [1,0,0,0,0,0|1,0,2]=4 96 B9R1.66 CC1(C[C@@H](CCO1)N)C MCULE-6013250721 [1,0,0,0,0,0|2,0,0]=3 97 B9R1.66 CC1(C[C@H](CCO1)N)C MCULE-2340605449 [1,0,0,0,0,0|2,0,0]=3 98 B9R1.66 CC1CC(CCN1)(C)O MCULE-1481375407 [1,0,0,0,0,0|2,0,0]=3 99 B9R1.66 CC1CC(CCN1)(F)F MCULE-3796481691 [1,0,0,0,0,0|3,0,0]=4 100 B9R1.66 CC1CC(CCN1)(F)F MCULE-5354084453 [1,0,0,0,0,0|3,0,0]=4 101 B9R1.66 CC1CCCC(C1)(C)C MCULE-9663238909 [1,0,0,0,0,0|0,0,0]=1 102 B9R1.66 CC1CCCC(C1)(F)F MCULE-6508793025 [1,0,0,0,0,0|2,0,0]=3 103 B9R1.66 CC1CCCC(N1)(C)C MCULE-3847815456 [1,0,0,0,0,0|1,0,0]=2 104 B9R1.66 CC1CCCC(N1)(C)C MCULE-7831646614 [1,0,0,0,0,0|1,0,0]=2 105 B9R1.66 CC1CNCC(C1)(C)C MCULE-6968910238 [1,0,0,0,0,0|1,0,0]=2 106 B9R1.66 CC1CNCC(O1)(C)C MCULE-6563845081 [1,0,0,0,0,0|2,0,0]=3 107 B9R1.66 CC1COCC(N1)(C)C MCULE-2107651949 [1,0,0,0,0,0|2,0,0]=3 108 B9R1.66 CN1CCCC(C1)(C)N MCULE-8073906438 [1,0,0,0,0,0|2,0,0]=3 109 B9R1.66 CN1CCC[C@](C1)(C)N MCULE-5194415088 [1,0,0,0,0,0|2,0,0]=3 110 B9R1.66 CN1CCNC(C1)(C)C MCULE-2275953590 [1,0,0,0,0,0|2,0,0]=3 111 B9R1.66 CN1CCNC(C1)(C)C MCULE-8597198770 [1,0,0,0,0,0|2,0,0]=3 112 B9R1.66 CN1CCO[Si](C1)(C)C MCULE-2281772300 [1,0,0,0,0,0|2,1,0]=4 113 B9R1.66 C[C@@H]1CC(CCN1)(F)F MCULE-1569103542 [1,0,0,0,0,0|3,0,0]=4 114 B9R1.66 C[C@@H]1CC(CCN1)(F)F MCULE-8062817663 [1,0,0,0,0,0|3,0,0]=4 115 B9R1.66 C[C@@]1(CCC[C@@H](C1)N)O MCULE-8912951909 [1,0,0,0,0,0|2,0,0]=3 116 B9R1.66 C[C@@]1(CCC[C@H](C1)N)O MCULE-4058238566 [1,0,0,0,0,0|2,0,0]=3 117 B9R1.66 C[C@@]1(CCC[C@H](C1)N)O MCULE-7920504474 [1,0,0,0,0,0|2,0,0]=3 118 B9R1.66 C[C@H]1CC(CCN1)(F)F MCULE-4311604524 [1,0,0,0,0,0|3,0,0]=4 119 B9R1.66 C[C@H]1COCC(N1)(C)C MCULE-5246321018 [1,0,0,0,0,0|2,0,0]=3 120 B9R1.66 C[C@]1(CCC[C@@H](C1)N)O MCULE-5451219836 [1,0,0,0,0,0|2,0,0]=3 121 B9R1.66 C[C@]1(CCC[C@@H](C1)N)O MCULE-7548917786 [1,0,0,0,0,0|2,0,0]=3 122 B9R1.66 C[C@]1(CCC[C@H](C1)N)O MCULE-7449457880 [1,0,0,0,0,0|2,0,0]=3 123 B9R1.66 NC1CCCC(C1)(F)F MCULE-5417250726 [1,0,0,0,0,0|3,0,0]=4 124 B9R1.66 NC1CCCC(C1)(F)F MCULE-9806069080 [1,0,0,0,0,0|3,0,0]=4 125 B9R1.66 N[C@@H]1CCCC(C1)(F)F MCULE-2461372706 [1,0,0,0,0,0|3,0,0]=4 126 B9R1.66 N[C@@H]1CCCC(C1)(F)F MCULE-6500756658 [1,0,0,0,0,0|3,0,0]=4 127 B9R1.66 N[C@H]1CCCC(C1)(F)F MCULE-1389597207 [1,0,0,0,0,0|3,0,0]=4 128 B9R1.66 N[C@H]1CCCC(C1)(F)F MCULE-2408658869 [1,0,0,0,0,0|3,0,0]=4 129 B9R1.66 N[C@H]1CCCC(C1)(F)F MCULE-3516105877 [1,0,0,0,0,0|3,0,0]=4 130 B9R1.66 N[C@H]1CCCC(C1)(F)F MCULE-9385610015 [1,0,0,0,0,0|3,0,0]=4 131 B9R1.66 O=S1(=O)CCCC(C1)O MCULE-4819801653 [1,0,0,0,0,0|3,0,0]=4 132 B9R1.66 OC1CCCC(C1)(F)F MCULE-9564327716 [1,0,0,0,0,0|2,0,0]=3 133 B9R1.66 OC1CNCC(C1)(F)F MCULE-1058766805 [1,0,0,0,0,0|3,0,0]=4 134 B9R1.66 OC1CNCC(C1)(F)F MCULE-5307036403 [1,0,0,0,0,0|3,0,0]=4 135 B9R1.66 O[C@@H]1CNCC(C1)(F)F MCULE-3457409350 [1,0,0,0,0,0|3,0,0]=4 136 B9R1.66 O[C@@H]1CNCC(C1)(F)F MCULE-8352958312 [1,0,0,0,0,0|3,0,0]=4 137 B9R1.66 O[C@H]1CNCC(C1)(F)F MCULE-1470423265 [1,0,0,0,0,0|3,0,0]=4 138 B9R1.66 O[C@H]1CNCC(C1)(F)F MCULE-1565578906 [1,0,0,0,0,0|3,0,0]=4 139 B11R1.10 CC1CC(CC(C1)(C)C)C#N MCULE-6993649237 [0,1,0,0,0,0|1,0,0]=2 140 B11R1.10 CN1CC(OC(C1)(C)C)CO MCULE-1257575410 [0,1,0,0,0,0|2,0,0]=3 141 B11R1.325 CC1CC(=O)CC(C1=O)(C)C MCULE-1145217211 [0,1,0,0,0,0|0,0,3]=4 142 B11R1.325 CC1CC(=O)CC(C1O)(C)C MCULE-5516878609 [0,1,0,0,0,0|0,0,2]=3 143 B11R1.325 CC1CC(CC(C1=O)(C)C)O MCULE-6456634015 [0,1,0,0,0,0|0,0,1]=2 144 B11R1.1180 CC[N+]1(CC(CC(C1)C)C)C MCULE-4150135342 [0,1,0,0,0,0|2,0,0]=3 145 B11R1.1180 CC[N+]1(CC(CC(C1)C)C)C MCULE-4694319006 [0,1,0,0,0,0|2,0,0]=3 146 B11R1.1361 CC1CC(CC(=O)C1=O)(C)C MCULE-7989186985 [0,1,0,0,0,0|0,0,3]=4 147 B11R1.1362 CC1(CC(=O)CC(C1)(C)C)C MCULE-4933320408 [0,1,0,0,0,0|0,0,2]=3 148 B11R1.1362 CC1(CC(=O)CC(N1)(C)C)C MCULE-5238680569 [0,1,0,0,0,0|1,0,2]=4 149 B11R1.1362 CC1(CC(=O)CC(N1)(C)C)C MCULE-5326647915 [0,1,0,0,0,0|1,0,2]=4 150 B11R1.1362 CC1(CC(=O)CC(N1)(C)C)C MCULE-8174271955 [0,1,0,0,0,0|1,0,2]=4 151 B11R1.1362 CC1(CC(=O)CC(O1)(C)C)C MCULE-3152038454 [0,1,0,0,0,0|1,0,2]=4 152 B11R1.1362 CC1(CC(CC(C1)(C)C)N)C MCULE-4431879878 [0,1,0,0,0,0|1,0,0]=2 153 B11R1.1362 CC1(CC(CC(C1)(C)C)N)C MCULE-9134674926 [0,1,0,0,0,0|1,0,0]=2 154 B11R1.1362 CC1(CC(CC(C1)(C)C)O)C MCULE-2959145859 [0,1,0,0,0,0|0,0,0]=1 155 B11R1.1362 CC1(CC(CC(N1)(C)C)Cl)C MCULE-4729453027 [0,1,0,0,0,0|2,0,0]=3 156 B11R1.1362 CC1(CC(CC(N1)(C)C)Cl)C MCULE-4871042583 [0,1,0,0,0,0|2,0,0]=3 157 B11R1.1362 CC1(CC(CC(N1)(C)C)N)C MCULE-6091519117 [0,1,0,0,0,0|2,0,0]=3 158 B11R1.1362 CC1(CC(CC(N1)(C)C)N)C MCULE-9941529753 [0,1,0,0,0,0|2,0,0]=3 159 B11R1.1362 CC1(CC(CC(N1)(C)C)O)C MCULE-2350871151 [0,1,0,0,0,0|1,0,0]=2 160 B11R1.1362 CC1(CC(CC(O1)(C)C)Br)C MCULE-8816857465 [0,1,0,0,0,0|2,0,0]=3 161 B11R1.1362 CC1(CC(CC(O1)(C)C)I)C MCULE-4621550655 [0,1,0,0,0,0|2,0,0]=3 162 B11R1.1362 CC1(CC(CC(O1)(C)C)N)C MCULE-3679830444 [0,1,0,0,0,0|2,0,0]=3 163 B11R1.1362 CC1(CC(CC(O1)(C)C)O)C MCULE-3661551152 [0,1,0,0,0,0|1,0,0]=2 164 B11R1.1362 C[C@@H]1CC(C[C@@](C1)(C)N)(C)C MCULE-4776116669 [0,1,0,0,0,0|1,0,0]=2 165 B11R1.1362 C[C@@H]1CC(C[C@](C1)(C)N)(C)C MCULE-4545889476 [0,1,0,0,0,0|1,0,0]=2 166 B9R0.44 CC(C)(C)CC(N)CCO MCULE-6045777873 [0,0,1,0,0,0|1,0,0]=2 167 B9R0.44 CC(C)(C)OC(=O)CCO MCULE-7836894654 [0,0,1,0,0,0|2,0,1]=4 168 B9R0.44 CC(CC=O)CC(C)(C)C MCULE-6622339070 [0,0,1,0,0,0|0,0,2]=3 169 B9R0.44 CC(CCN)CC(C)(C)C MCULE-1576850932 [0,0,1,0,0,0|1,0,0]=2 170 B9R0.44 CC(CCN)CC(C)(C)C MCULE-2051141838 [0,0,1,0,0,0|1,0,0]=2 171 B9R0.44 CC(CCO)CC(C)(C)C MCULE-5987575303 [0,0,1,0,0,0|0,0,0]=1 172 B9R0.44 CCCC(=O)OC(C)(C)C MCULE-8182416948 [0,0,1,0,0,0|1,0,2]=4 173 B9R0.44 CCCC(C)CC(C)(C)C MCULE-9059950279 [0,0,1,0,0,0|1,0,0]=2 174 B9R0.44 CCCN(C)CC(C)(C)N MCULE-5427870791 [0,0,1,0,0,0|3,0,0]=4 175 B9R0.44 CCOC(=O)CC(C)(C)C MCULE-8926986105 [0,0,1,0,0,0|1,0,2]=4 176 B9R0.44 COCC(=O)CC(C)(C)C MCULE-6887395316 [0,0,1,0,0,0|1,0,2]=4 177 B9R0.44 COCC(N)CC(C)(C)C MCULE-1846452120 [0,0,1,0,0,0|2,0,0]=3 178 B9R0.44 C[N+](C)(C)CC(O)CC#N MCULE-2294121826 [0,0,1,0,0,0|2,0,1]=4 179 B9R0.44 C[N+](C)(C)CC(O)CC#N MCULE-9559853966 [0,0,1,0,0,0|2,0,1]=4 180 B9R0.44 C[N+](C)(C)C[C@H](O)CC#N MCULE-3704336621 [0,0,1,0,0,0|2,0,1]=4 181 B9R0.44 C[N+](C)(C)C[C@H](O)CC#N MCULE-9827535818 [0,0,1,0,0,0|2,0,1]=4 182 B9R0.53 C=C(C)CC(C)CC(C)C MCULE-4505551323 [0,0,1,0,0,0|1,0,1]=3 183 B9R0.53 CC(=O)CC(C)CC(C)C MCULE-3290069482 [0,0,1,0,0,0|0,0,2]=3 184 B9R0.53 CC(=O)OC(C)CC(C)C MCULE-4956954975 [0,0,1,0,0,0|1,0,2]=4 185 B9R0.53 CC(C)CC(=O)CC(C)C MCULE-1429853094 [0,0,1,0,0,0|0,0,2]=3 186 B9R0.53 CC(C)CC(=O)NC(C)C MCULE-8177213606 [0,0,1,0,0,0|1,0,2]=4 187 B9R0.53 CC(C)CC(C)CC(=O)O MCULE-6189870651 [0,0,1,0,0,0|1,0,1]=3 188 B9R0.53 CC(C)CC(C)CC(C)O MCULE-3603844824 [0,0,1,0,0,0|0,0,0]=1 189 B9R0.53 CC(C)CC(N)CC(=O)O MCULE-3491123553 [0,0,1,0,0,0|2,0,1]=4 190 B9R0.53 CC(C)CC(N)CC(=O)O MCULE-4917004131 [0,0,1,0,0,0|2,0,1]=4 191 B9R0.53 CC(C)CC(N)CC(=O)O MCULE-9751191377 [0,0,1,0,0,0|2,0,1]=4 192 B9R0.53 CC(C)CC(N)CC(C)C MCULE-1554135812 [0,0,1,0,0,0|1,0,0]=2 193 B9R0.53 CC(C)CC(N)CC(C)C MCULE-7379412957 [0,0,1,0,0,0|1,0,0]=2 194 B9R0.53 CC(C)CC(N)CN(C)C MCULE-2167092761 [0,0,1,0,0,0|2,0,0]=3 195 B9R0.53 CC(C)CC(O)CC(=O)O MCULE-2536433460 [0,0,1,0,0,0|2,0,1]=4 196 B9R0.53 CC(C)CC(O)CC(C)C MCULE-5726175629 [0,0,1,0,0,0|0,0,0]=1 197 B9R0.53 CC(C)C[C@@H](N)CC(=O)O MCULE-1906257031 [0,0,1,0,0,0|2,0,1]=4 198 B9R0.53 CC(C)C[C@@H](N)CC(=O)O MCULE-5676550364 [0,0,1,0,0,0|2,0,1]=4 199 B9R0.53 CC(C)C[C@@H](N)CC(=O)O MCULE-8752852377 [0,0,1,0,0,0|2,0,1]=4 200 B9R0.53 CC(C)C[C@@H](N)CC(=O)O MCULE-9926372034 [0,0,1,0,0,0|2,0,1]=4 201 B9R0.53 CC(C)C[C@H](N)CC(=O)O MCULE-5502640895 [0,0,1,0,0,0|2,0,1]=4 202 B9R0.53 CC(C)C[C@H](N)CC(=O)O MCULE-5602246196 [0,0,1,0,0,0|2,0,1]=4 203 B9R0.53 CC(C)C[C@H](N)CC(=O)O MCULE-6522397846 [0,0,1,0,0,0|2,0,1]=4 204 B9R0.53 CC(C)C[C@H](N)CC(=O)O MCULE-8594791252 [0,0,1,0,0,0|2,0,1]=4 205 B9R0.53 CC(C)C[C@H](N)CN(C)C MCULE-2261570861 [0,0,1,0,0,0|2,0,0]=3 206 B9R0.53 CC(C)OC(C)OC(C)C MCULE-7008416555 [0,0,1,0,0,0|3,0,0]=4 207 B9R0.53 CC(C)OP(O)OC(C)C MCULE-2709392804 [0,0,1,0,0,0|3,0,0]=4 208 B9R0.53 CC(O)CN(C)CC(C)O MCULE-9058207509 [0,0,1,0,0,0|2,0,0]=3 209 B9R0.53 CC(O)CN(O)CC(C)O MCULE-1746966957 [0,0,1,0,0,0|3,0,0]=4 210 B9R0.53 CN(C)CC(O)CN(C)C MCULE-7089557459 [0,0,1,0,0,0|2,0,0]=3 211 B9R0.58 C=C(C)CC(C)(C)CCC MCULE-6567193721 [0,0,1,0,0,0|1,0,1]=3 212 B9R0.58 CC(C)CS(=O)(=O)CCO MCULE-1195478049 [0,0,1,0,0,0|3,0,0]=4 213 B9R0.58 CCCC(C)(C)CC(=O)O MCULE-3472003458 [0,0,1,0,0,0|1,0,1]=3 214 B9R0.58 CCCC(C)(O)CC(=O)O MCULE-7082436494 [0,0,1,0,0,0|2,0,1]=4 215 B9R0.58 CNCC(C)(C)CC(=O)O MCULE-9673126610 [0,0,1,0,0,0|2,0,1]=4 216 B9R0.58 CNCC(C)(C)CN(C)C MCULE-3210232750 [0,0,1,0,0,0|3,0,0]=4 217 B9R0.58 COCC(C)(C)CC(=O)O MCULE-3020905492 [0,0,1,0,0,0|2,0,1]=4 218 B11R2.526 CC1(CC2CCC(C1)N2)O MCULE-5585894733 [0,0,0,1,0,0|3,0,0]=4 219 B11R2.526 CC1(CC2CCC(C1)N2)O MCULE-7076403925 [0,0,0,1,0,0|3,0,0]=4 220 B11R2.526 C[C@]1(C[C@@H]2CC[C@H](C1)N2)O MCULE-9621057075 [0,0,0,1,0,0|3,0,0]=4 221 B11R2.526 [C@@H]12CC[C@@H](N1)C[C@](C2)(C)O MCULE-2653971418 [0,0,0,1,0,0|3,0,0]=4 222 B11R2.1632 CC1(CC(=O)C2OC2C1)C MCULE-7177289219 [0,0,0,1,0,0|1,0,1]=3 223 B9R1.36 CC1(CC(C(=O)N1)O)C MCULE-6193972218 [0,0,0,0,1,0|2,0,1]=4 224 B9R1.36 CC1CC(CC1=O)(C)C MCULE-2251251242 [0,0,0,0,1,0|0,0,2]=3 225 B9R1.36 CC1CC(NC1=O)(C)C MCULE-3640588755 [0,0,0,0,1,0|1,0,2]=4 226 B9R1.38 CC1(NC(=O)CC1O)C MCULE-8306254701 [0,0,0,0,1,0|2,0,1]=4 227 B9R1.38 CC1CC(=O)C(C1)(C)C MCULE-1944517389 [0,0,0,0,1,0|0,0,2]=3 228 B9R1.38 CC1CC(=O)C(O1)(C)C MCULE-9055876569 [0,0,0,0,1,0|1,0,2]=4 229 B9R1.38 CC1CC(=O)NC1(C)C MCULE-4801665077 [0,0,0,0,1,0|1,0,2]=4 230 B9R1.38 CC1CC(=O)OC1(C)C MCULE-6169528498 [0,0,0,0,1,0|1,0,2]=4 231 B9R1.38 CC1CN([Si](C1)(C)C)C MCULE-4964711404 [0,0,0,0,1,0|2,1,0]=4 232 B9R1.38 CC1OC(=O)CC1(C)C MCULE-2629079906 [0,0,0,0,1,0|1,0,2]=4 233 B8R0.5 C=C(C)CC(C)CCC MCULE-7442491404 [1,0,1,0,0,0|0,0,2]=4 234 B8R0.5 C=CCC(C)CC(C)C MCULE-8816279401 [1,0,1,0,0,0|0,0,2]=4 235 B8R0.5 CC(C)CC(C)CCO MCULE-4252029005 [1,0,1,0,0,0|0,0,0]=2 236 B8R0.5 CC(C)CC(N)CCO MCULE-3556995407 [1,0,1,0,0,0|1,0,0]=3 237 B8R0.5 CC(C)C[C@H](N)CCO MCULE-8336727873 [1,0,1,0,0,0|1,0,0]=3 238 B8R0.5 CC(O)CC(O)CCO MCULE-4888514297 [1,0,1,0,0,0|2,0,0]=4 239 B8R0.5 CC(O)CN(C)CCO MCULE-4977568845 [1,0,1,0,0,0|2,0,0]=4 240 B8R0.5 CCCC(=O)CC(C)C MCULE-1475988710 [1,0,1,0,0,0|0,0,2]=4 241 B8R0.5 CCCC(C)CC(=O)C MCULE-7925360299 [1,0,1,0,0,0|0,0,2]=4 242 B8R0.5 CCCC(C)CC(=O)O MCULE-6002154473 [1,0,1,0,0,0|1,0,1]=4 243 B8R0.5 CCCC(C)CC(C)C MCULE-4080546731 [1,0,1,0,0,0|0,0,0]=2 244 B8R0.5 CCCC(C)CC(C)O MCULE-3968478752 [1,0,1,0,0,0|0,0,0]=2 245 B8R0.5 CCNC(C)CN(C)C MCULE-3855150991 [1,0,1,0,0,0|2,0,0]=4 246 B8R0.5 CN(C)CC(N)CCO MCULE-6705437586 [1,0,1,0,0,0|2,0,0]=4 247 B8R0.5 CNCC(N)CC(C)C MCULE-2079953825 [1,0,1,0,0,0|2,0,0]=4 248 B8R0.5 COCC(O)CC(C)C MCULE-8774838486 [1,0,1,0,0,0|1,0,0]=3 249 B8R0.5 COC[C@H](N)CC(C)C MCULE-2740362594 [1,0,1,0,0,0|2,0,0]=4 250 B8R0.21 C(=CC(C)(C)C)CCC MCULE-6629961438 [1,0,1,0,0,0|0,0,2]=4 251 B8R0.21 C=CCCCC(C)(C)C MCULE-8091417826 [1,0,1,0,0,0|0,0,2]=4 252 B8R0.21 CC(C)(C)CCCCBr MCULE-3306918988 [1,0,1,0,0,0|1,0,0]=3 253 B8R0.21 CC(C)(C)CCCCN MCULE-4696814283 [1,0,1,0,0,0|1,0,0]=3 254 B8R0.21 CC(C)(C)CCCCO MCULE-6188842430 [1,0,1,0,0,0|0,0,0]=2 255 B8R0.21 CC(C)(C)CCOCCl MCULE-4523307391 [1,0,1,0,0,0|2,0,0]=4 256 B8R0.21 CC(C)(C)CNCCO MCULE-3218044438 [1,0,1,0,0,0|1,0,0]=3 257 B8R0.21 CC(C)(C)COCCN MCULE-1882090258 [1,0,1,0,0,0|2,0,0]=4 258 B8R0.21 CC(C)(C)COCCN MCULE-2843825873 [1,0,1,0,0,0|2,0,0]=4 259 B8R0.21 CC(C)(C)NCCCN MCULE-7337046707 [1,0,1,0,0,0|2,0,0]=4 260 B8R0.21 CC(C)(C)NCCCN MCULE-8601669693 [1,0,1,0,0,0|2,0,0]=4 261 B8R0.21 CC(C)(C)NCCCO MCULE-5350891631 [1,0,1,0,0,0|1,0,0]=3 262 B8R0.21 CC(C)(C)NCCCO MCULE-6255503510 [1,0,1,0,0,0|1,0,0]=3 263 B8R0.21 CC(C)(C)OCCCBr MCULE-8201130964 [1,0,1,0,0,0|2,0,0]=4 264 B8R0.21 CC(C)(C)OCCCN MCULE-1556496850 [1,0,1,0,0,0|2,0,0]=4 265 B8R0.21 CC(C)(C)OCCCN MCULE-8410807707 [1,0,1,0,0,0|2,0,0]=4 266 B8R0.21 CC(C)(C)OCCCO MCULE-9923433921 [1,0,1,0,0,0|1,0,0]=3 267 B8R0.21 CC(C)(C)SCCCBr MCULE-3477160081 [1,0,1,0,0,0|2,0,0]=4 268 B8R0.21 CC(C)(C)SCCCO MCULE-2353391810 [1,0,1,0,0,0|1,0,0]=3 269 B8R0.21 CC(C)(C)SSCCO MCULE-7967907383 [1,0,1,0,0,0|2,0,0]=4 270 B8R0.21 CC(C)(O)CCCCO MCULE-2749019232 [1,0,1,0,0,0|1,0,0]=3 271 B8R0.21 CC(C)(O)CNCCO MCULE-7597695473 [1,0,1,0,0,0|2,0,0]=4 272 B8R0.21 CCCCCC(C)(C)C MCULE-4223197735 [1,0,1,0,0,0|0,0,0]=2 273 B8R0.21 CCCCCC(C)(C)O MCULE-8173858480 [1,0,1,0,0,0|1,0,0]=3 274 B8R0.21 CCCCOC(C)(C)C MCULE-7244985912 [1,0,1,0,0,0|1,0,0]=3 275 B8R0.21 CCCNCC(C)(C)O MCULE-1675746605 [1,0,1,0,0,0|2,0,0]=4 276 B8R0.21 CNCCCC(C)(C)C MCULE-5292331415 [1,0,1,0,0,0|1,0,0]=3 277 B8R0.21 CNCCCC(C)(C)C MCULE-7104440465 [1,0,1,0,0,0|1,0,0]=3 278 B8R0.21 CNCCNC(C)(C)C MCULE-2043791699 [1,0,1,0,0,0|2,0,0]=4 279 B8R0.21 CNCCOC(C)(C)C MCULE-6703104052 [1,0,1,0,0,0|2,0,0]=4 280 B8R0.21 COCCNC(C)(C)C MCULE-8811090125 [1,0,1,0,0,0|2,0,0]=4 281 B8R0.21 C[N+](C)(C)CCCCN MCULE-2482234407 [1,0,1,0,0,0|2,0,0]=4 282 B8R0.21 C[N+](C)(C)CCCCN MCULE-7843905367 [1,0,1,0,0,0|2,0,0]=4 283 B8R0.21 C[Si](C)(C)CCCCO MCULE-3464039288 [1,0,1,0,0,0|0,1,0]=3 284 B8R0.24 C=CC(C)CC(C)(C)C MCULE-7756364310 [1,0,1,0,0,0|0,0,2]=4 285 B8R0.24 CC(C)(C)CC(N)CN MCULE-6881989419 [1,0,1,0,0,0|2,0,0]=4 286 B8R0.24 CC(C)(C)CC(N)CN MCULE-7272505216 [1,0,1,0,0,0|2,0,0]=4 287 B8R0.24 CC(C)(C)CC(N)CO MCULE-6218529160 [1,0,1,0,0,0|1,0,0]=3 288 B8R0.24 CC(C)(C)CC(N)CO MCULE-9260689415 [1,0,1,0,0,0|1,0,0]=3 289 B8R0.24 CC(C)(C)CC(O)CN MCULE-2797135905 [1,0,1,0,0,0|1,0,0]=3 290 B8R0.24 CC(C)(C)C[C@@H](N)CO MCULE-2344272194 [1,0,1,0,0,0|1,0,0]=3 291 B8R0.24 CC(C)(C)C[C@@H](N)CO MCULE-3422824651 [1,0,1,0,0,0|1,0,0]=3 292 B8R0.24 CC(C)(C)C[C@H](N)CO MCULE-1162425709 [1,0,1,0,0,0|1,0,0]=3 293 B8R0.24 CC(C)(C)C[C@H](N)CO MCULE-6072062398 [1,0,1,0,0,0|1,0,0]=3 294 B8R0.24 CC(C)(C)C[C@H](N)CO MCULE-6096680571 [1,0,1,0,0,0|1,0,0]=3 295 B8R0.24 CC(C)(C)C[C@H](N)CO MCULE-9054616581 [1,0,1,0,0,0|1,0,0]=3 296 B8R0.24 CC(C)(F)C[C@H](N)CO MCULE-7714026743 [1,0,1,0,0,0|2,0,0]=4 297 B8R0.24 CC(C=O)CC(C)(C)C MCULE-7924761915 [1,0,1,0,0,0|0,0,2]=4 298 B8R0.24 CC(CBr)CC(C)(C)C MCULE-3832360005 [1,0,1,0,0,0|1,0,0]=3 299 B8R0.24 CC(CCl)CC(C)(C)C MCULE-7737528111 [1,0,1,0,0,0|1,0,0]=3 300 B8R0.24 CC(CO)CC(C)(C)C MCULE-7679389860 [1,0,1,0,0,0|0,0,0]=2 301 B8R0.24 CC(CO)CC(C)(C)N MCULE-9841047592 [1,0,1,0,0,0|1,0,0]=3 302 B8R0.24 CC(CS)CC(C)(C)C MCULE-3281193781 [1,0,1,0,0,0|0,1,0]=3 303 B8R0.24 CCC(C)CC(C)(C)C MCULE-5219349103 [1,0,1,0,0,0|0,0,0]=2 304 B8R0.24 CCC(C)OC(C)(C)C MCULE-8483349931 [1,0,1,0,0,0|1,0,0]=3 305 B8R0.24 C[N+](C)(C)CC(O)CCl MCULE-1348177735 [1,0,1,0,0,0|2,0,0]=4 306 B8R0.24 C[N+](C)(C)CC(O)CCl MCULE-2654755798 [1,0,1,0,0,0|2,0,0]=4 307 B8R0.24 C[N+](C)(C)CC(O)CCl MCULE-5503192715 [1,0,1,0,0,0|2,0,0]=4 308 B8R0.24 C[N+](C)(C)CC(O)CCl MCULE-9159362089 [1,0,1,0,0,0|2,0,0]=4 309 B8R0.24 C[N+](C)(C)CC(O)CO MCULE-3972132849 [1,0,1,0,0,0|2,0,0]=4 310 B8R0.24 C[N+](C)(C)CC(O)CO MCULE-5654897353 [1,0,1,0,0,0|2,0,0]=4 311 B8R0.24 C[N+](C)(C)C[C@@H](O)CCl MCULE-3907636193 [1,0,1,0,0,0|2,0,0]=4 312 B8R0.24 C[N+](C)(C)C[C@@H](O)CCl MCULE-4173805623 [1,0,1,0,0,0|2,0,0]=4 313 B8R0.24 C[N+](C)(C)C[C@@H](O)CCl MCULE-4827268087 [1,0,1,0,0,0|2,0,0]=4 314 B8R0.24 C[N+](C)(C)C[C@@H](O)CCl MCULE-8028308508 [1,0,1,0,0,0|2,0,0]=4 315 B8R0.24 C[N+](C)(C)C[C@H](O)CCl MCULE-6420096205 [1,0,1,0,0,0|2,0,0]=4 316 B8R0.24 C[N+](C)(C)C[C@H](O)CCl MCULE-6447861070 [1,0,1,0,0,0|2,0,0]=4 317 B8R0.24 C[N+](C)(C)C[C@H](O)CCl MCULE-7568810296 [1,0,1,0,0,0|2,0,0]=4 318 B8R0.24 C[N+](C)(C)C[C@H](O)CCl MCULE-9800798617 [1,0,1,0,0,0|2,0,0]=4 319 B8R0.28 C=C(C)CCCC(C)C MCULE-5830488183 [1,0,1,0,0,0|0,0,2]=4 320 B8R0.28 CC(=CCCC(C)O)C MCULE-6046871097 [1,0,1,0,0,0|0,0,2]=4 321 B8R0.28 CC(=CCC[C@@H](C)O)C MCULE-5913564496 [1,0,1,0,0,0|0,0,2]=4 322 B8R0.28 CC(=CCC[C@@H](C)O)C MCULE-8239445037 [1,0,1,0,0,0|0,0,2]=4 323 B8R0.28 CC(=CCC[C@H](C)O)C MCULE-3685132186 [1,0,1,0,0,0|0,0,2]=4 324 B8R0.28 CC(=CCC[C@H](C)O)C MCULE-7339160655 [1,0,1,0,0,0|0,0,2]=4 325 B8R0.28 CC(=O)CCCC(C)C MCULE-7256575819 [1,0,1,0,0,0|0,0,2]=4 326 B8R0.28 CC(C)C=CCC(C)C MCULE-4843505730 [1,0,1,0,0,0|0,0,2]=4 327 B8R0.28 CC(C)CCCC(=O)O MCULE-3645348479 [1,0,1,0,0,0|1,0,1]=4 328 B8R0.28 CC(C)CCCC(C)N MCULE-6797729647 [1,0,1,0,0,0|1,0,0]=3 329 B8R0.28 CC(C)CCCC(C)O MCULE-6655675430 [1,0,1,0,0,0|0,0,0]=2 330 B8R0.28 CC(C)CCCC(C)[NH3+] MCULE-1949973327 [1,0,1,0,0,0|1,0,0]=3 331 B8R0.28 CC(C)CNCC(C)C MCULE-4641218286 [1,0,1,0,0,0|1,0,0]=3 332 B8R0.28 CC(C)CNCC(C)C MCULE-7558581759 [1,0,1,0,0,0|1,0,0]=3 333 B8R0.28 CC(C)CNCC(C)O MCULE-5110606510 [1,0,1,0,0,0|1,0,0]=3 334 B8R0.28 CC(C)COCC(C)C MCULE-5674609142 [1,0,1,0,0,0|1,0,0]=3 335 B8R0.28 CC(C)COCC(C)O MCULE-2243697829 [1,0,1,0,0,0|1,0,0]=3 336 B8R0.28 CC(C)CSCC(C)C MCULE-4278920085 [1,0,1,0,0,0|1,0,0]=3 337 B8R0.28 CC(C)NCCN(C)C MCULE-3539535796 [1,0,1,0,0,0|2,0,0]=4 338 B8R0.28 CC(C)NCCN(C)C MCULE-8256872219 [1,0,1,0,0,0|2,0,0]=4 339 B8R0.28 CC(C)OCOC(C)C MCULE-4287954144 [1,0,1,0,0,0|2,0,0]=4 340 B8R0.28 CC(O)CNCC(C)O MCULE-2715190259 [1,0,1,0,0,0|2,0,0]=4 341 B8R0.28 CC(O)COCC(C)O MCULE-9464290948 [1,0,1,0,0,0|2,0,0]=4 342 B8R0.28 CN(C)CCCN(C)C MCULE-1767831375 [1,0,1,0,0,0|2,0,0]=4 343 B8R0.30 C=CCC(C)(C)CCC MCULE-8170673795 [1,0,1,0,0,0|0,0,2]=4 344 B8R0.30 CC(C)(CCBr)CCBr MCULE-6269768694 [1,0,1,0,0,0|2,0,0]=4 345 B8R0.30 CC(C)(CCO)CCO MCULE-7035754164 [1,0,1,0,0,0|1,0,0]=3 346 B8R0.30 CCCC(C)(O)CCC MCULE-9859031484 [1,0,1,0,0,0|1,0,0]=3 347 B8R0.30 CCCC(C)(S)CCO MCULE-6991730364 [1,0,1,0,0,0|1,0,0]=3 348 B8R0.30 CCOC(C)(C)OCC MCULE-8847166838 [1,0,1,0,0,0|2,0,0]=4 349 B8R0.30 COCC(C)(C)CCN MCULE-5645150589 [1,0,1,0,0,0|2,0,0]=4 350 B8R0.30 COCC(C)(N)CCO MCULE-5008627623 [1,0,1,0,0,0|2,0,0]=4 351 B8R0.30 C[N+](C)(CCO)CCO MCULE-2028013559 [1,0,1,0,0,0|2,0,0]=4 352 B8R0.30 C[N+](C)(CCO)CCO MCULE-7276455285 [1,0,1,0,0,0|2,0,0]=4 353 B8R0.34 C=C(C)CC(C)(C)CC MCULE-9469757352 [1,0,1,0,0,0|0,0,2]=4 354 B8R0.34 CC(C)(CO)CC(F)F MCULE-9922199511 [1,0,1,0,0,0|2,0,0]=4 355 B8R0.34 CC(C)CC(C)(C)C#N MCULE-5674232497 [1,0,1,0,0,0|1,0,1]=4 356 B8R0.34 CC(C)CC(C)(C)CO MCULE-1911437416 [1,0,1,0,0,0|0,0,0]=2 357 B8R0.34 CC(C)CC(C)(N)CN MCULE-9134360621 [1,0,1,0,0,0|2,0,0]=4 358 B8R0.34 CC(C)CC(C)(N)CO MCULE-1560730026 [1,0,1,0,0,0|1,0,0]=3 359 B8R0.34 CC(C)CC(C)(N)CO MCULE-8993149220 [1,0,1,0,0,0|1,0,0]=3 360 B8R0.34 CC(C)C[C@](C)(N)CO MCULE-2616396238 [1,0,1,0,0,0|1,0,0]=3 361 B8R0.34 CC(C)C[C@](C)(N)CO MCULE-5663284805 [1,0,1,0,0,0|1,0,0]=3 362 B8R0.34 CC(C)C[C@](C)(N)CO MCULE-8415395453 [1,0,1,0,0,0|1,0,0]=3 363 B8R0.34 CC(C)C[C@](C)(N)CO MCULE-9763882430 [1,0,1,0,0,0|1,0,0]=3 364 B8R0.34 CC(C)NC(C)(C)CN MCULE-8867682922 [1,0,1,0,0,0|2,0,0]=4 365 B8R0.34 CC(C)NC(C)(C)CO MCULE-1736424701 [1,0,1,0,0,0|1,0,0]=3 366 B8R0.34 CC(O)CC(C)(C)C#N MCULE-5709903710 [1,0,1,0,0,0|1,0,1]=4 367 B8R0.34 CC(O)CC(C)(C)CN MCULE-3349093711 [1,0,1,0,0,0|1,0,0]=3 368 B8R0.34 CC(O)CC(C)(C)CN MCULE-7091343982 [1,0,1,0,0,0|1,0,0]=3 369 B8R0.34 CCC(C)(C)CC(=O)C MCULE-9050476347 [1,0,1,0,0,0|0,0,2]=4 370 B8R0.34 CCC(C)(C)CC(=O)O MCULE-7231252497 [1,0,1,0,0,0|1,0,1]=4 371 B8R0.34 CCC(C)(O)CC(C)C MCULE-2017778784 [1,0,1,0,0,0|1,0,0]=3 372 B8R0.34 CN(C)CC(C)(C)CBr MCULE-8288105891 [1,0,1,0,0,0|2,0,0]=4 373 B8R0.34 CN(C)CC(C)(C)CCl MCULE-2484945921 [1,0,1,0,0,0|2,0,0]=4 374 B8R0.34 CN(C)CC(C)(C)CN MCULE-9549216556 [1,0,1,0,0,0|2,0,0]=4 375 B8R0.34 CN(C)CC(C)(C)CO MCULE-8031935929 [1,0,1,0,0,0|1,0,0]=3 376 B8R0.34 CNC(C)(C)CN(C)C MCULE-6590998850 [1,0,1,0,0,0|2,0,0]=4 377 B8R0.34 COC(C)(C)CC(C)N MCULE-7937293688 [1,0,1,0,0,0|2,0,0]=4 378 B8R0.34 COC(C)(C)CC(C)O MCULE-8363298229 [1,0,1,0,0,0|1,0,0]=3 379 B8R1.4 C1(CCCN(C1)C)N MCULE-3410822458 [2,0,0,0,0,0|2,0,0]=4 380 B8R1.4 C1(CCCN(C1)C)N MCULE-3826219520 [2,0,0,0,0,0|2,0,0]=4 381 B8R1.4 C1(CCCN(C1)C)N MCULE-4932517330 [2,0,0,0,0,0|2,0,0]=4 382 B8R1.4 C1(CCCN(C1)C)O MCULE-3423318871 [2,0,0,0,0,0|1,0,0]=3 383 B8R1.4 C1(CN(CCN1)C)C MCULE-4105126849 [2,0,0,0,0,0|2,0,0]=4 384 B8R1.4 CC1=CC(CCC1)O MCULE-3389687006 [2,0,0,0,0,0|0,0,2]=4 385 B8R1.4 CC1CC(CCN1)O MCULE-6498081704 [2,0,0,0,0,0|1,0,0]=3 386 B8R1.4 CC1CC(CCN1)O MCULE-7903568675 [2,0,0,0,0,0|1,0,0]=3 387 B8R1.4 CC1CC(CCO1)N MCULE-6804148880 [2,0,0,0,0,0|2,0,0]=4 388 B8R1.4 CC1CC(CCO1)N MCULE-8648516718 [2,0,0,0,0,0|2,0,0]=4 389 B8R1.4 CC1CC(CCO1)O MCULE-4865141445 [2,0,0,0,0,0|1,0,0]=3 390 B8R1.4 CC1CC(CCS1)N MCULE-2033728520 [2,0,0,0,0,0|2,0,0]=4 391 B8R1.4 CC1CCCC(=O)C1 MCULE-6473963111 [2,0,0,0,0,0|0,0,2]=4 392 B8R1.4 CC1CCCC(=O)C1 MCULE-9918051823 [2,0,0,0,0,0|0,0,2]=4 393 B8R1.4 CC1CCCC(C1)Br MCULE-5316207726 [2,0,0,0,0,0|1,0,0]=3 394 B8R1.4 CC1CCCC(C1)C MCULE-4586744389 [2,0,0,0,0,0|0,0,0]=2 395 B8R1.4 CC1CCCC(C1)N MCULE-5556282713 [2,0,0,0,0,0|1,0,0]=3 396 B8R1.4 CC1CCCC(C1)N MCULE-8731144009 [2,0,0,0,0,0|1,0,0]=3 397 B8R1.4 CC1CCCC(C1)O MCULE-5839979596 [2,0,0,0,0,0|0,0,0]=2 398 B8R1.4 CC1CCCC(C1)S MCULE-6656207820 [2,0,0,0,0,0|0,1,0]=3 399 B8R1.4 CC1CCCC(N1)C MCULE-1701252671 [2,0,0,0,0,0|1,0,0]=3 400 B8R1.4 CC1CCCC(N1)C MCULE-3781585788 [2,0,0,0,0,0|1,0,0]=3 401 B8R1.4 CC1CCC[C@@H](N1)C MCULE-6717885612 [2,0,0,0,0,0|1,0,0]=3 402 B8R1.4 CC1CCC[C@@H](N1)C MCULE-8850784160 [2,0,0,0,0,0|1,0,0]=3 403 B8R1.4 CC1CCC[C@H](C1)O MCULE-8817611474 [2,0,0,0,0,0|0,0,0]=2 404 B8R1.4 CC1CCC[C@H](N1)C MCULE-3950492914 [2,0,0,0,0,0|1,0,0]=3 405 B8R1.4 CC1CCC[C@H](N1)C MCULE-6363665850 [2,0,0,0,0,0|1,0,0]=3 406 B8R1.4 CC1CCNC(C1)C MCULE-8040810294 [2,0,0,0,0,0|1,0,0]=3 407 B8R1.4 CC1CCNC(C1)C MCULE-8404028981 [2,0,0,0,0,0|1,0,0]=3 408 B8R1.4 CC1CCOC(O1)C MCULE-1813287934 [2,0,0,0,0,0|2,0,0]=4 409 B8R1.4 CC1CN(CCN1)C MCULE-1055309117 [2,0,0,0,0,0|2,0,0]=4 410 B8R1.4 CC1CN(CCN1)C MCULE-3824647587 [2,0,0,0,0,0|2,0,0]=4 411 B8R1.4 CC1CN(CCN1)C MCULE-6324823217 [2,0,0,0,0,0|2,0,0]=4 412 B8R1.4 CC1CN(CCN1)C MCULE-6503611187 [2,0,0,0,0,0|2,0,0]=4 413 B8R1.4 CC1CN(CCN1)C MCULE-7041006360 [2,0,0,0,0,0|2,0,0]=4 414 B8R1.4 CC1CN(CCN1)C MCULE-7191718712 [2,0,0,0,0,0|2,0,0]=4 415 B8R1.4 CC1CNCC(C1)C MCULE-6398397068 [2,0,0,0,0,0|1,0,0]=3 416 B8R1.4 CC1CNCC(C1)F MCULE-8189756576 [2,0,0,0,0,0|2,0,0]=4 417 B8R1.4 CC1CNCC(C1)N MCULE-3061635524 [2,0,0,0,0,0|2,0,0]=4 418 B8R1.4 CC1CNCC(C1)O MCULE-3984160340 [2,0,0,0,0,0|1,0,0]=3 419 B8R1.4 CC1CNCC(C1)O MCULE-8485435970 [2,0,0,0,0,0|1,0,0]=3 420 B8R1.4 CC1CNCC(N1)C MCULE-3223409733 [2,0,0,0,0,0|2,0,0]=4 421 B8R1.4 CC1CNCC(N1)C MCULE-5745545417 [2,0,0,0,0,0|2,0,0]=4 422 B8R1.4 CC1CNCC(N1)C MCULE-8884559456 [2,0,0,0,0,0|2,0,0]=4 423 B8R1.4 CC1CNCC(O1)C MCULE-1246186846 [2,0,0,0,0,0|2,0,0]=4 424 B8R1.4 CC1CNCC(O1)C MCULE-4536319828 [2,0,0,0,0,0|2,0,0]=4 425 B8R1.4 CC1CNCC(S1)C MCULE-8995906277 [2,0,0,0,0,0|2,0,0]=4 426 B8R1.4 CC1COCC(N1)C MCULE-4328769074 [2,0,0,0,0,0|2,0,0]=4 427 B8R1.4 CC1COCC(N1)C MCULE-5344050444 [2,0,0,0,0,0|2,0,0]=4 428 B8R1.4 CC1CSCC(N1)C MCULE-6013986092 [2,0,0,0,0,0|2,0,0]=4 429 B8R1.4 CN1CCCC(C1)Br MCULE-2651622305 [2,0,0,0,0,0|2,0,0]=4 430 B8R1.4 CN1CCCC(C1)Br MCULE-7531396410 [2,0,0,0,0,0|2,0,0]=4 431 B8R1.4 CN1CCCC(C1)I MCULE-6532551702 [2,0,0,0,0,0|2,0,0]=4 432 B8R1.4 CN1CCCC(C1)N MCULE-6006250747 [2,0,0,0,0,0|2,0,0]=4 433 B8R1.4 CN1CCCC(C1)N MCULE-7505616938 [2,0,0,0,0,0|2,0,0]=4 434 B8R1.4 CN1CCCC(C1)O MCULE-1282411969 [2,0,0,0,0,0|1,0,0]=3 435 B8R1.4 CN1CCCC(C1)O MCULE-5914090374 [2,0,0,0,0,0|1,0,0]=3 436 B8R1.4 CN1CCC[C@@H](C1)Br MCULE-1921611819 [2,0,0,0,0,0|2,0,0]=4 437 B8R1.4 CN1CCC[C@@H](C1)Cl MCULE-3600433530 [2,0,0,0,0,0|2,0,0]=4 438 B8R1.4 CN1CCC[C@@H](C1)I MCULE-2822466049 [2,0,0,0,0,0|2,0,0]=4 439 B8R1.4 CN1CCC[C@@H](C1)N MCULE-1641136932 [2,0,0,0,0,0|2,0,0]=4 440 B8R1.4 CN1CCC[C@@H](C1)N MCULE-3051988205 [2,0,0,0,0,0|2,0,0]=4 441 B8R1.4 CN1CCC[C@@H](C1)N MCULE-5382532780 [2,0,0,0,0,0|2,0,0]=4 442 B8R1.4 CN1CCC[C@@H](C1)N MCULE-6456540641 [2,0,0,0,0,0|2,0,0]=4 443 B8R1.4 CN1CCC[C@@H](C1)N MCULE-9630175341 [2,0,0,0,0,0|2,0,0]=4 444 B8R1.4 CN1CCC[C@@H](C1)O MCULE-7507199450 [2,0,0,0,0,0|1,0,0]=3 445 B8R1.4 CN1CCC[C@@H](C1)O MCULE-7595542900 [2,0,0,0,0,0|1,0,0]=3 446 B8R1.4 CN1CCC[C@H](C1)Br MCULE-4528000337 [2,0,0,0,0,0|2,0,0]=4 447 B8R1.4 CN1CCC[C@H](C1)Cl MCULE-5866202004 [2,0,0,0,0,0|2,0,0]=4 448 B8R1.4 CN1CCC[C@H](C1)I MCULE-2032023429 [2,0,0,0,0,0|2,0,0]=4 449 B8R1.4 CN1CCC[C@H](C1)N MCULE-3791229169 [2,0,0,0,0,0|2,0,0]=4 450 B8R1.4 CN1CCC[C@H](C1)N MCULE-4311816417 [2,0,0,0,0,0|2,0,0]=4 451 B8R1.4 CN1CCC[C@H](C1)N MCULE-4894370636 [2,0,0,0,0,0|2,0,0]=4 452 B8R1.4 CN1CCC[C@H](C1)N MCULE-8680638890 [2,0,0,0,0,0|2,0,0]=4 453 B8R1.4 CN1CCC[C@H](C1)N MCULE-9687896539 [2,0,0,0,0,0|2,0,0]=4 454 B8R1.4 CN1CCC[C@H](C1)O MCULE-1943345564 [2,0,0,0,0,0|1,0,0]=3 455 B8R1.4 CN1CCC[C@H](C1)O MCULE-2523873601 [2,0,0,0,0,0|1,0,0]=3 456 B8R1.4 C[C@@H]1CCCC(=O)C1 MCULE-1868776628 [2,0,0,0,0,0|0,0,2]=4 457 B8R1.4 C[C@@H]1CCCC(=O)C1 MCULE-6973928430 [2,0,0,0,0,0|0,0,2]=4 458 B8R1.4 C[C@@H]1CCC[C@@H](C1)N MCULE-4415985299 [2,0,0,0,0,0|1,0,0]=3 459 B8R1.4 C[C@@H]1CCC[C@@H](C1)N MCULE-8377118927 [2,0,0,0,0,0|1,0,0]=3 460 B8R1.4 C[C@@H]1CCC[C@@H](C1)O MCULE-9818117668 [2,0,0,0,0,0|0,0,0]=2 461 B8R1.4 C[C@@H]1CCC[C@H](C1)C MCULE-3238245504 [2,0,0,0,0,0|0,0,0]=2 462 B8R1.4 C[C@@H]1CCC[C@H](C1)C MCULE-5078558305 [2,0,0,0,0,0|0,0,0]=2 463 B8R1.4 C[C@@H]1CCC[C@H](C1)N MCULE-8122076410 [2,0,0,0,0,0|1,0,0]=3 464 B8R1.4 C[C@@H]1CCC[C@H](C1)N MCULE-8755565938 [2,0,0,0,0,0|1,0,0]=3 465 B8R1.4 C[C@@H]1CCC[C@H](N1)C MCULE-3698881454 [2,0,0,0,0,0|1,0,0]=3 466 B8R1.4 C[C@@H]1CCC[C@H](N1)C MCULE-9551065058 [2,0,0,0,0,0|1,0,0]=3 467 B8R1.4 C[C@@H]1CCN[C@@H](C1)C MCULE-1028257294 [2,0,0,0,0,0|1,0,0]=3 468 B8R1.4 C[C@@H]1CCN[C@@H](C1)C MCULE-6672836947 [2,0,0,0,0,0|1,0,0]=3 469 B8R1.4 C[C@@H]1CN(CCN1)C MCULE-1570359061 [2,0,0,0,0,0|2,0,0]=4 470 B8R1.4 C[C@@H]1CN(CCN1)C MCULE-2310985091 [2,0,0,0,0,0|2,0,0]=4 471 B8R1.4 C[C@@H]1CN(CCN1)C MCULE-2316648491 [2,0,0,0,0,0|2,0,0]=4 472 B8R1.4 C[C@@H]1CN(CCN1)C MCULE-3211045897 [2,0,0,0,0,0|2,0,0]=4 473 B8R1.4 C[C@@H]1CN(CCN1)C MCULE-4792990163 [2,0,0,0,0,0|2,0,0]=4 474 B8R1.4 C[C@@H]1CN(CCN1)C MCULE-7243491288 [2,0,0,0,0,0|2,0,0]=4 475 B8R1.4 C[C@@H]1CN(CCN1)C MCULE-7866165756 [2,0,0,0,0,0|2,0,0]=4 476 B8R1.4 C[C@@H]1CN(CCN1)C MCULE-8629381213 [2,0,0,0,0,0|2,0,0]=4 477 B8R1.4 C[C@@H]1CNC[C@@H](C1)C MCULE-5074164144 [2,0,0,0,0,0|1,0,0]=3 478 B8R1.4 C[C@@H]1CNC[C@@H](C1)C MCULE-6080949069 [2,0,0,0,0,0|1,0,0]=3 479 B8R1.4 C[C@@H]1CNC[C@H](C1)C MCULE-2125944179 [2,0,0,0,0,0|1,0,0]=3 480 B8R1.4 C[C@@H]1CNC[C@H](C1)C MCULE-2907126543 [2,0,0,0,0,0|1,0,0]=3 481 B8R1.4 C[C@@H]1CNC[C@H](N1)C MCULE-1696828647 [2,0,0,0,0,0|2,0,0]=4 482 B8R1.4 C[C@@H]1CNC[C@H](N1)C MCULE-2468311268 [2,0,0,0,0,0|2,0,0]=4 483 B8R1.4 C[C@@H]1CNC[C@H](N1)C MCULE-2908961419 [2,0,0,0,0,0|2,0,0]=4 484 B8R1.4 C[C@@H]1CNC[C@H](N1)C MCULE-5992167849 [2,0,0,0,0,0|2,0,0]=4 485 B8R1.4 C[C@@H]1CNC[C@H](N1)C MCULE-7171430893 [2,0,0,0,0,0|2,0,0]=4 486 B8R1.4 C[C@@H]1CNC[C@H](N1)C MCULE-7562808389 [2,0,0,0,0,0|2,0,0]=4 487 B8R1.4 C[C@@H]1CNC[C@H](N1)C MCULE-9110042896 [2,0,0,0,0,0|2,0,0]=4 488 B8R1.4 C[C@@H]1CNC[C@H](O1)C MCULE-8338777291 [2,0,0,0,0,0|2,0,0]=4 489 B8R1.4 C[C@@H]1CNC[C@H](O1)C MCULE-9597572516 [2,0,0,0,0,0|2,0,0]=4 490 B8R1.4 C[C@@H]1COC[C@H](N1)C MCULE-2736879628 [2,0,0,0,0,0|2,0,0]=4 491 B8R1.4 C[C@@H]1COC[C@H](N1)C MCULE-6480700093 [2,0,0,0,0,0|2,0,0]=4 492 B8R1.4 C[C@@H]1COC[C@H](N1)C MCULE-7175758116 [2,0,0,0,0,0|2,0,0]=4 493 B8R1.4 C[C@@H]1COC[C@H](N1)C MCULE-8111856201 [2,0,0,0,0,0|2,0,0]=4 494 B8R1.4 C[C@@H]1COC[C@H](N1)C MCULE-9185751584 [2,0,0,0,0,0|2,0,0]=4 495 B8R1.4 C[C@@H]1CSC[C@H](N1)C MCULE-1704971441 [2,0,0,0,0,0|2,0,0]=4 496 B8R1.4 C[C@@H]1C[C@@H](CCN1)F MCULE-1398077984 [2,0,0,0,0,0|2,0,0]=4 497 B8R1.4 C[C@@H]1C[C@@H](CCN1)F MCULE-2358777348 [2,0,0,0,0,0|2,0,0]=4 498 B8R1.4 C[C@@H]1C[C@@H](CCN1)F MCULE-3912836765 [2,0,0,0,0,0|2,0,0]=4 499 B8R1.4 C[C@@H]1C[C@@H](CCN1)F MCULE-4676698183 [2,0,0,0,0,0|2,0,0]=4 500 B8R1.4 C[C@@H]1C[C@@H](CCN1)N MCULE-5240939973 [2,0,0,0,0,0|2,0,0]=4 501 B8R1.4 C[C@@H]1C[C@@H](CCN1)N MCULE-7786078968 [2,0,0,0,0,0|2,0,0]=4 502 B8R1.4 C[C@@H]1C[C@@H](CCN1)O MCULE-4140093728 [2,0,0,0,0,0|1,0,0]=3 503 B8R1.4 C[C@@H]1C[C@@H](CCN1)O MCULE-5163618886 [2,0,0,0,0,0|1,0,0]=3 504 B8R1.4 C[C@@H]1C[C@@H](CCN1)O MCULE-7763919398 [2,0,0,0,0,0|1,0,0]=3 505 B8R1.4 C[C@@H]1C[C@@H](CCN1)O MCULE-8618284571 [2,0,0,0,0,0|1,0,0]=3 506 B8R1.4 C[C@@H]1C[C@@H](CCO1)N MCULE-5401313109 [2,0,0,0,0,0|2,0,0]=4 507 B8R1.4 C[C@@H]1C[C@@H](CCO1)N MCULE-6369939467 [2,0,0,0,0,0|2,0,0]=4 508 B8R1.4 C[C@@H]1C[C@@H](CCO1)O MCULE-6251959536 [2,0,0,0,0,0|1,0,0]=3 509 B8R1.4 C[C@@H]1C[C@H](CCN1)O MCULE-6703272966 [2,0,0,0,0,0|1,0,0]=3 510 B8R1.4 C[C@@H]1C[C@H](CCO1)Br MCULE-5055630042 [2,0,0,0,0,0|2,0,0]=4 511 B8R1.4 C[C@@H]1C[C@H](CCO1)N MCULE-3414529082 [2,0,0,0,0,0|2,0,0]=4 512 B8R1.4 C[C@@H]1C[C@H](CCO1)N MCULE-9424615508 [2,0,0,0,0,0|2,0,0]=4 513 B8R1.4 C[C@H]1CCCC(=O)C1 MCULE-4643975445 [2,0,0,0,0,0|0,0,2]=4 514 B8R1.4 C[C@H]1CCCC(=O)C1 MCULE-6122391840 [2,0,0,0,0,0|0,0,2]=4 515 B8R1.4 C[C@H]1CCC[C@@H](N1)C MCULE-1147260663 [2,0,0,0,0,0|1,0,0]=3 516 B8R1.4 C[C@H]1CCC[C@@H](N1)C MCULE-9029116005 [2,0,0,0,0,0|1,0,0]=3 517 B8R1.4 C[C@H]1CCC[C@H](C1)C MCULE-7889833647 [2,0,0,0,0,0|0,0,0]=2 518 B8R1.4 C[C@H]1CCC[C@H](C1)N MCULE-5054508849 [2,0,0,0,0,0|1,0,0]=3 519 B8R1.4 C[C@H]1CCC[C@H](C1)O MCULE-9355825371 [2,0,0,0,0,0|0,0,0]=2 520 B8R1.4 C[C@H]1CCC[C@H](N1)C MCULE-5870895189 [2,0,0,0,0,0|1,0,0]=3 521 B8R1.4 C[C@H]1CCC[C@H](N1)C MCULE-9926277933 [2,0,0,0,0,0|1,0,0]=3 522 B8R1.4 C[C@H]1CCN[C@H](C1)C MCULE-3280721182 [2,0,0,0,0,0|1,0,0]=3 523 B8R1.4 C[C@H]1CCN[C@H](C1)C MCULE-4356238844 [2,0,0,0,0,0|1,0,0]=3 524 B8R1.4 C[C@H]1CN(CCN1)C MCULE-3768688515 [2,0,0,0,0,0|2,0,0]=4 525 B8R1.4 C[C@H]1CN(CCN1)C MCULE-4142367217 [2,0,0,0,0,0|2,0,0]=4 526 B8R1.4 C[C@H]1CN(CCN1)C MCULE-7427337853 [2,0,0,0,0,0|2,0,0]=4 527 B8R1.4 C[C@H]1CN(CCN1)C MCULE-9194909314 [2,0,0,0,0,0|2,0,0]=4 528 B8R1.4 C[C@H]1CNC[C@@H](C1)C MCULE-3540731481 [2,0,0,0,0,0|1,0,0]=3 529 B8R1.4 C[C@H]1CNC[C@@H](N1)C MCULE-2085737588 [2,0,0,0,0,0|2,0,0]=4 530 B8R1.4 C[C@H]1CNC[C@@H](N1)C MCULE-3560259275 [2,0,0,0,0,0|2,0,0]=4 531 B8R1.4 C[C@H]1CNC[C@@H](N1)C MCULE-4934383491 [2,0,0,0,0,0|2,0,0]=4 532 B8R1.4 C[C@H]1CNC[C@@H](N1)C MCULE-5596475906 [2,0,0,0,0,0|2,0,0]=4 533 B8R1.4 C[C@H]1CNC[C@@H](N1)C MCULE-9160000333 [2,0,0,0,0,0|2,0,0]=4 534 B8R1.4 C[C@H]1CNC[C@@H](N1)C MCULE-9804669326 [2,0,0,0,0,0|2,0,0]=4 535 B8R1.4 C[C@H]1CNC[C@@H](O1)C MCULE-3690703731 [2,0,0,0,0,0|2,0,0]=4 536 B8R1.4 C[C@H]1CNC[C@@H](O1)C MCULE-4390136549 [2,0,0,0,0,0|2,0,0]=4 537 B8R1.4 C[C@H]1CNC[C@@H](O1)C MCULE-6341510399 [2,0,0,0,0,0|2,0,0]=4 538 B8R1.4 C[C@H]1CNC[C@H](N1)C MCULE-1933589286 [2,0,0,0,0,0|2,0,0]=4 539 B8R1.4 C[C@H]1CNC[C@H](O1)C MCULE-8184385886 [2,0,0,0,0,0|2,0,0]=4 540 B8R1.4 C[C@H]1COC[C@@H](N1)C MCULE-1719904204 [2,0,0,0,0,0|2,0,0]=4 541 B8R1.4 C[C@H]1COC[C@@H](N1)C MCULE-4982848827 [2,0,0,0,0,0|2,0,0]=4 542 B8R1.4 C[C@H]1COC[C@@H](N1)C MCULE-5187697554 [2,0,0,0,0,0|2,0,0]=4 543 B8R1.4 C[C@H]1COC[C@@H](N1)C MCULE-5502522190 [2,0,0,0,0,0|2,0,0]=4 544 B8R1.4 C[C@H]1COC[C@H](N1)C MCULE-1213066303 [2,0,0,0,0,0|2,0,0]=4 545 B8R1.4 C[C@H]1COC[C@H](N1)C MCULE-4127485214 [2,0,0,0,0,0|2,0,0]=4 546 B8R1.4 C[C@H]1CSC[C@@H](N1)C MCULE-8706645092 [2,0,0,0,0,0|2,0,0]=4 547 B8R1.4 C[C@H]1CSC[C@H](N1)C MCULE-8606563794 [2,0,0,0,0,0|2,0,0]=4 548 B8R1.4 C[C@H]1C[C@@H](CCN1)O MCULE-1694554479 [2,0,0,0,0,0|1,0,0]=3 549 B8R1.4 C[C@H]1C[C@@H](CCO1)N MCULE-1731421927 [2,0,0,0,0,0|2,0,0]=4 550 B8R1.4 C[C@H]1C[C@@H](CCO1)O MCULE-3846187212 [2,0,0,0,0,0|1,0,0]=3 551 B8R1.4 C[C@H]1C[C@H](CCN1)O MCULE-2129467220 [2,0,0,0,0,0|1,0,0]=3 552 B8R1.4 C[C@H]1C[C@H](CCN1)O MCULE-2293561927 [2,0,0,0,0,0|1,0,0]=3 553 B8R1.4 C[C@H]1C[C@H](CCN1)O MCULE-2465229358 [2,0,0,0,0,0|1,0,0]=3 554 B8R1.4 C[C@H]1C[C@H](CCN1)O MCULE-2588665539 [2,0,0,0,0,0|1,0,0]=3 555 B8R1.4 C[C@H]1C[C@H](CCN1)O MCULE-4194322726 [2,0,0,0,0,0|1,0,0]=3 556 B8R1.4 C[C@H]1C[C@H](CCN1)O MCULE-4666938059 [2,0,0,0,0,0|1,0,0]=3 557 B8R1.4 C[C@H]1C[C@H](CCO1)N MCULE-6954386064 [2,0,0,0,0,0|2,0,0]=4 558 B8R1.4 C[C@H]1C[C@H](CCO1)O MCULE-3007764630 [2,0,0,0,0,0|1,0,0]=3 559 B8R1.4 NC1CCCC(C1)Cl MCULE-7655504973 [2,0,0,0,0,0|2,0,0]=4 560 B8R1.4 NC1CCCC(C1)Cl MCULE-9341575456 [2,0,0,0,0,0|2,0,0]=4 561 B8R1.4 NC1CCCC(C1)F MCULE-5865882171 [2,0,0,0,0,0|2,0,0]=4 562 B8R1.4 NC1CCCC(C1)F MCULE-8837450344 [2,0,0,0,0,0|2,0,0]=4 563 B8R1.4 NC1CCCC(C1)N MCULE-3029985677 [2,0,0,0,0,0|2,0,0]=4 564 B8R1.4 NC1CCCC(C1)N MCULE-6391736640 [2,0,0,0,0,0|2,0,0]=4 565 B8R1.4 NC1CCCC(C1)O MCULE-6642881941 [2,0,0,0,0,0|1,0,0]=3 566 B8R1.4 NC1CCCC(C1)O MCULE-7481733301 [2,0,0,0,0,0|1,0,0]=3 567 B8R1.4 NC1CNCC(C1)O MCULE-6920221467 [2,0,0,0,0,0|2,0,0]=4 568 B8R1.4 NC1COCC(C1)O MCULE-4181084305 [2,0,0,0,0,0|2,0,0]=4 569 B8R1.4 NC1COCC(C1)O MCULE-5761305163 [2,0,0,0,0,0|2,0,0]=4 570 B8R1.4 NN1CCCC(C1)O MCULE-4022389356 [2,0,0,0,0,0|2,0,0]=4 571 B8R1.4 N[C@@H]1CCC[C@@H](C1)O MCULE-2185895220 [2,0,0,0,0,0|1,0,0]=3 572 B8R1.4 N[C@@H]1CCC[C@@H](C1)O MCULE-6878512399 [2,0,0,0,0,0|1,0,0]=3 573 B8R1.4 N[C@@H]1CCC[C@@H](C1)O MCULE-7794771906 [2,0,0,0,0,0|1,0,0]=3 574 B8R1.4 N[C@@H]1CCC[C@@H](C1)O MCULE-9600913098 [2,0,0,0,0,0|1,0,0]=3 575 B8R1.4 N[C@@H]1CCC[C@H](C1)F MCULE-2536282257 [2,0,0,0,0,0|2,0,0]=4 576 B8R1.4 N[C@@H]1CCC[C@H](C1)F MCULE-2736673815 [2,0,0,0,0,0|2,0,0]=4 577 B8R1.4 N[C@@H]1CCC[C@H](C1)F MCULE-4628461523 [2,0,0,0,0,0|2,0,0]=4 578 B8R1.4 N[C@@H]1CCC[C@H](C1)F MCULE-9688546453 [2,0,0,0,0,0|2,0,0]=4 579 B8R1.4 N[C@@H]1CCC[C@H](C1)N MCULE-2130309446 [2,0,0,0,0,0|2,0,0]=4 580 B8R1.4 N[C@@H]1CCC[C@H](C1)O MCULE-3943542357 [2,0,0,0,0,0|1,0,0]=3 581 B8R1.4 N[C@@H]1CCC[C@H](C1)O MCULE-7462583711 [2,0,0,0,0,0|1,0,0]=3 582 B8R1.4 N[C@@H]1CCC[C@H](C1)O MCULE-8163415958 [2,0,0,0,0,0|1,0,0]=3 583 B8R1.4 N[C@@H]1CCC[C@H](C1)O MCULE-9050533878 [2,0,0,0,0,0|1,0,0]=3 584 B8R1.4 N[C@@H]1COC[C@@H](C1)O MCULE-2589345375 [2,0,0,0,0,0|2,0,0]=4 585 B8R1.4 N[C@@H]1COC[C@@H](C1)O MCULE-5154891684 [2,0,0,0,0,0|2,0,0]=4 586 B8R1.4 N[C@@H]1COC[C@H](C1)O MCULE-1888308248 [2,0,0,0,0,0|2,0,0]=4 587 B8R1.4 N[C@@H]1COC[C@H](C1)O MCULE-4630509866 [2,0,0,0,0,0|2,0,0]=4 588 B8R1.4 N[C@H]1CCC[C@@H](C1)F MCULE-3206920587 [2,0,0,0,0,0|2,0,0]=4 589 B8R1.4 N[C@H]1CCC[C@@H](C1)F MCULE-3799023910 [2,0,0,0,0,0|2,0,0]=4 590 B8R1.4 N[C@H]1CCC[C@@H](C1)F MCULE-4345615346 [2,0,0,0,0,0|2,0,0]=4 591 B8R1.4 N[C@H]1CCC[C@@H](C1)F MCULE-6740747871 [2,0,0,0,0,0|2,0,0]=4 592 B8R1.4 N[C@H]1CCC[C@@H](C1)N MCULE-1460773264 [2,0,0,0,0,0|2,0,0]=4 593 B8R1.4 N[C@H]1CCC[C@@H](C1)N MCULE-7326708293 [2,0,0,0,0,0|2,0,0]=4 594 B8R1.4 N[C@H]1CCC[C@@H](C1)N MCULE-7679169264 [2,0,0,0,0,0|2,0,0]=4 595 B8R1.4 N[C@H]1CCC[C@@H](C1)N MCULE-8810866148 [2,0,0,0,0,0|2,0,0]=4 596 B8R1.4 N[C@H]1CCC[C@@H](C1)O MCULE-2088777566 [2,0,0,0,0,0|1,0,0]=3 597 B8R1.4 N[C@H]1CCC[C@@H](C1)O MCULE-6052884406 [2,0,0,0,0,0|1,0,0]=3 598 B8R1.4 N[C@H]1CCC[C@@H](C1)O MCULE-7145455722 [2,0,0,0,0,0|1,0,0]=3 599 B8R1.4 N[C@H]1CCC[C@@H](C1)O MCULE-8458598098 [2,0,0,0,0,0|1,0,0]=3 600 B8R1.4 N[C@H]1CCC[C@H](C1)Cl MCULE-1818262804 [2,0,0,0,0,0|2,0,0]=4 601 B8R1.4 N[C@H]1CCC[C@H](C1)Cl MCULE-8427852595 [2,0,0,0,0,0|2,0,0]=4 602 B8R1.4 N[C@H]1CCC[C@H](C1)F MCULE-1359534220 [2,0,0,0,0,0|2,0,0]=4 603 B8R1.4 N[C@H]1CCC[C@H](C1)F MCULE-1857618544 [2,0,0,0,0,0|2,0,0]=4 604 B8R1.4 N[C@H]1CCC[C@H](C1)F MCULE-4081113085 [2,0,0,0,0,0|2,0,0]=4 605 B8R1.4 N[C@H]1CCC[C@H](C1)F MCULE-9022718283 [2,0,0,0,0,0|2,0,0]=4 606 B8R1.4 N[C@H]1CCC[C@H](C1)N MCULE-7378030264 [2,0,0,0,0,0|2,0,0]=4 607 B8R1.4 N[C@H]1CCC[C@H](C1)N MCULE-8100723700 [2,0,0,0,0,0|2,0,0]=4 608 B8R1.4 N[C@H]1CCC[C@H](C1)N MCULE-8346537188 [2,0,0,0,0,0|2,0,0]=4 609 B8R1.4 N[C@H]1CCC[C@H](C1)O MCULE-1402442931 [2,0,0,0,0,0|1,0,0]=3 610 B8R1.4 N[C@H]1CCC[C@H](C1)O MCULE-2566868682 [2,0,0,0,0,0|1,0,0]=3 611 B8R1.4 N[C@H]1CCC[C@H](C1)O MCULE-8263508625 [2,0,0,0,0,0|1,0,0]=3 612 B8R1.4 N[C@H]1CCC[C@H](C1)O MCULE-9158452946 [2,0,0,0,0,0|1,0,0]=3 613 B8R1.4 N[C@H]1CCC[C@H](C1)O MCULE-9908500977 [2,0,0,0,0,0|1,0,0]=3 614 B8R1.4 N[C@H]1COC[C@@H](C1)O MCULE-6168789714 [2,0,0,0,0,0|2,0,0]=4 615 B8R1.4 N[C@H]1COC[C@H](C1)O MCULE-1887576189 [2,0,0,0,0,0|2,0,0]=4 616 B8R1.4 N[C@H]1COC[C@H](C1)O MCULE-2203204142 [2,0,0,0,0,0|2,0,0]=4 617 B8R1.4 O=C1CCCC(C1)O MCULE-3100717907 [2,0,0,0,0,0|1,0,1]=4 618 B8R1.4 O=C1CCC[C@@H](C1)O MCULE-3841179351 [2,0,0,0,0,0|1,0,1]=4 619 B8R1.4 OC1CCCC(C1)O MCULE-5377622416 [2,0,0,0,0,0|1,0,0]=3 620 B8R1.4 OC1CNCC(C1)O MCULE-1197120974 [2,0,0,0,0,0|2,0,0]=4 621 B8R1.4 OC1CNCC(C1)O MCULE-4759581472 [2,0,0,0,0,0|2,0,0]=4 622 B8R1.4 O[C@@H]1CCC[C@H](C1)O MCULE-1135108851 [2,0,0,0,0,0|1,0,0]=3 623 B8R1.4 O[C@@H]1CCC[C@H](C1)O MCULE-4488851523 [2,0,0,0,0,0|1,0,0]=3 624 B8R1.4 O[C@@H]1CNC[C@@H](C1)F MCULE-1439853464 [2,0,0,0,0,0|2,0,0]=4 625 B8R1.4 O[C@@H]1CNC[C@@H](C1)F MCULE-9096067151 [2,0,0,0,0,0|2,0,0]=4 626 B8R1.4 O[C@@H]1CNC[C@@H](C1)O MCULE-1294085941 [2,0,0,0,0,0|2,0,0]=4 627 B8R1.4 O[C@@H]1CNC[C@@H](C1)O MCULE-3774231585 [2,0,0,0,0,0|2,0,0]=4 628 B8R1.4 O[C@@H]1CNC[C@H](C1)O MCULE-5630014959 [2,0,0,0,0,0|2,0,0]=4 629 B8R1.4 O[C@@H]1CNC[C@H](C1)O MCULE-8096152429 [2,0,0,0,0,0|2,0,0]=4 630 B8R1.4 O[C@H]1CCC[C@@H](C1)O MCULE-4718573149 [2,0,0,0,0,0|1,0,0]=3 631 B8R1.4 O[C@H]1CCC[C@H](C1)O MCULE-9402957017 [2,0,0,0,0,0|1,0,0]=3 632 B8R1.4 O[C@H]1CNC[C@@H](C1)O MCULE-3635256197 [2,0,0,0,0,0|2,0,0]=4 633 B8R1.4 O[C@H]1CNC[C@@H](C1)O MCULE-7162868831 [2,0,0,0,0,0|2,0,0]=4 634 B8R1.4 [C@@H]1(CCC[C@@H](C1)N)C MCULE-3863430976 [2,0,0,0,0,0|1,0,0]=3 635 B8R1.4 [C@@H]1(CNC[C@@H](N1)C)C MCULE-6979318448 [2,0,0,0,0,0|2,0,0]=4 636 B8R1.4 [C@@H]1(CNC[C@@H](N1)C)C MCULE-8120831918 [2,0,0,0,0,0|2,0,0]=4 637 B8R1.4 [C@H]1(CCC[C@H](C1)O)N MCULE-1919170190 [2,0,0,0,0,0|1,0,0]=3 638 B8R1.4 [C@H]1(CCC[C@H](C1)O)N MCULE-2985238129 [2,0,0,0,0,0|1,0,0]=3 639 B8R1.4 [C@H]1(COC[C@H](N1)C)C MCULE-9060251275 [2,0,0,0,0,0|2,0,0]=4 640 B8R1.72 CC1(CCCCC1)Br MCULE-7638162883 [2,0,0,0,0,0|1,0,0]=3 641 B8R1.72 CC1(CCCCC1)C MCULE-1034948429 [2,0,0,0,0,0|0,0,0]=2 642 B8R1.72 CC1(CCCCC1)Cl MCULE-9694989677 [2,0,0,0,0,0|1,0,0]=3 643 B8R1.72 CC1(CCCCC1)N MCULE-4578526281 [2,0,0,0,0,0|1,0,0]=3 644 B8R1.72 CC1(CCCCC1)N MCULE-7255401200 [2,0,0,0,0,0|1,0,0]=3 645 B8R1.72 CC1(CCCCC1)O MCULE-9091358177 [2,0,0,0,0,0|1,0,0]=3 646 B8R1.72 CC1(CCCCN1)C MCULE-2685191354 [2,0,0,0,0,0|1,0,0]=3 647 B8R1.72 CC1(CCCCN1)C MCULE-5186772635 [2,0,0,0,0,0|1,0,0]=3 648 B8R1.72 CC1(CCCNC1)C MCULE-1520606122 [2,0,0,0,0,0|1,0,0]=3 649 B8R1.72 CC1(CCCNC1)C MCULE-1566131847 [2,0,0,0,0,0|1,0,0]=3 650 B8R1.72 CC1(CCCNC1)F MCULE-3330567861 [2,0,0,0,0,0|2,0,0]=4 651 B8R1.72 CC1(CCCNC1)F MCULE-6560412441 [2,0,0,0,0,0|2,0,0]=4 652 B8R1.72 CC1(CCCNC1)O MCULE-5451972522 [2,0,0,0,0,0|2,0,0]=4 653 B8R1.72 CC1(CCCNC1)O MCULE-8102952158 [2,0,0,0,0,0|2,0,0]=4 654 B8R1.72 CC1(CCCOC1)N MCULE-3473263481 [2,0,0,0,0,0|2,0,0]=4 655 B8R1.72 CC1(CCCOC1)N MCULE-9650675850 [2,0,0,0,0,0|2,0,0]=4 656 B8R1.72 CC1(CCNCC1)C MCULE-7337251134 [2,0,0,0,0,0|1,0,0]=3 657 B8R1.72 CC1(CCNCC1)C MCULE-8963260224 [2,0,0,0,0,0|1,0,0]=3 658 B8R1.72 CC1(CCNCC1)F MCULE-6260232530 [2,0,0,0,0,0|2,0,0]=4 659 B8R1.72 CC1(CCNCC1)F MCULE-7921954485 [2,0,0,0,0,0|2,0,0]=4 660 B8R1.72 CC1(CCNCC1)N MCULE-5607404765 [2,0,0,0,0,0|2,0,0]=4 661 B8R1.72 CC1(CCNCC1)N MCULE-9218523511 [2,0,0,0,0,0|2,0,0]=4 662 B8R1.72 CC1(CCNCC1)O MCULE-9361316232 [2,0,0,0,0,0|2,0,0]=4 663 B8R1.72 CC1(CCNCC1)O MCULE-9693067330 [2,0,0,0,0,0|2,0,0]=4 664 B8R1.72 CC1(CCOCC1)Br MCULE-5432776276 [2,0,0,0,0,0|2,0,0]=4 665 B8R1.72 CC1(CCOCC1)N MCULE-3034294114 [2,0,0,0,0,0|2,0,0]=4 666 B8R1.72 CC1(CCOCC1)N MCULE-3421238451 [2,0,0,0,0,0|2,0,0]=4 667 B8R1.72 CC1(CCOCC1)O MCULE-8543825418 [2,0,0,0,0,0|2,0,0]=4 668 B8R1.72 CC1(CCOCO1)C MCULE-7025894167 [2,0,0,0,0,0|2,0,0]=4 669 B8R1.72 CC1(CCSCC1)O MCULE-2057155888 [2,0,0,0,0,0|2,0,0]=4 670 B8R1.72 CC1(CNCCN1)C MCULE-7617898553 [2,0,0,0,0,0|2,0,0]=4 671 B8R1.72 CC1(CNCCN1)C MCULE-9166738285 [2,0,0,0,0,0|2,0,0]=4 672 B8R1.72 CC1(CNCCO1)C MCULE-1093588178 [2,0,0,0,0,0|2,0,0]=4 673 B8R1.72 CC1(CNCCO1)C MCULE-1377070600 [2,0,0,0,0,0|2,0,0]=4 674 B8R1.72 CC1(CNCCS1)C MCULE-4332173948 [2,0,0,0,0,0|2,0,0]=4 675 B8R1.72 CC1(COCCN1)C MCULE-1637404959 [2,0,0,0,0,0|2,0,0]=4 676 B8R1.72 CC1(COCCN1)C MCULE-4242032450 [2,0,0,0,0,0|2,0,0]=4 677 B8R1.72 CC1(COCOC1)C MCULE-9252788458 [2,0,0,0,0,0|2,0,0]=4 678 B8R1.72 CC1(CSCCN1)C MCULE-9621049146 [2,0,0,0,0,0|2,0,0]=4 679 B8R1.72 C[C@@]1(CCCNC1)O MCULE-4258412383 [2,0,0,0,0,0|2,0,0]=4 680 B8R1.72 C[C@@]1(CCCNC1)O MCULE-4809428117 [2,0,0,0,0,0|2,0,0]=4 681 B8R1.72 C[C@@]1(CCCNC1)O MCULE-5529196606 [2,0,0,0,0,0|2,0,0]=4 682 B8R1.72 C[C@@]1(CCCOC1)N MCULE-6911571931 [2,0,0,0,0,0|2,0,0]=4 683 B8R1.72 C[C@@]1(CCCOC1)N MCULE-7022092346 [2,0,0,0,0,0|2,0,0]=4 684 B8R1.72 C[C@]1(CCCNC1)O MCULE-1848066803 [2,0,0,0,0,0|2,0,0]=4 685 B8R1.72 C[C@]1(CCCNC1)O MCULE-4327624120 [2,0,0,0,0,0|2,0,0]=4 686 B8R1.72 C[C@]1(CCCNC1)O MCULE-4586680651 [2,0,0,0,0,0|2,0,0]=4 687 B8R1.72 C[C@]1(CCCNC1)O MCULE-5076504348 [2,0,0,0,0,0|2,0,0]=4 688 B8R1.72 C[C@]1(CCCOC1)N MCULE-2192532317 [2,0,0,0,0,0|2,0,0]=4 689 B8R1.72 C[C@]1(CCCOC1)N MCULE-9979909776 [2,0,0,0,0,0|2,0,0]=4 690 B8R1.72 C[N+]1(CCCCC1)C MCULE-6801078398 [2,0,0,0,0,0|1,0,0]=3 691 B8R1.72 C[N+]1(CCCCC1)C MCULE-8577219444 [2,0,0,0,0,0|1,0,0]=3 692 B8R1.72 C[N+]1(CCCCC1)C MCULE-8985387079 [2,0,0,0,0,0|1,0,0]=3 693 B8R1.72 C[N+]1(CCCCC1)[O-] MCULE-5049215438 [2,0,0,0,0,0|2,0,0]=4 694 B8R1.72 C[N+]1(CCNCC1)C MCULE-4445155532 [2,0,0,0,0,0|2,0,0]=4 695 B8R1.72 C[N+]1(CCNCC1)C MCULE-6305096635 [2,0,0,0,0,0|2,0,0]=4 696 B8R1.72 C[N+]1(CCNCC1)C MCULE-9913162377 [2,0,0,0,0,0|2,0,0]=4 697 B8R1.72 C[N+]1(CCOCC1)C MCULE-1342822828 [2,0,0,0,0,0|2,0,0]=4 698 B8R1.72 C[N+]1(CCOCC1)C MCULE-1523317682 [2,0,0,0,0,0|2,0,0]=4 699 B8R1.72 C[N+]1(CCOCC1)C MCULE-9524802069 [2,0,0,0,0,0|2,0,0]=4 700 B8R1.72 C[Si]1(CCCCC1)C MCULE-1044445418 [2,0,0,0,0,0|0,1,0]=3 701 B8R1.72 C[Si]1(CCCCO1)C MCULE-8051030048 [2,0,0,0,0,0|1,1,0]=4 702 B8R1.72 C[Si]1(CCNCC1)C MCULE-2532491736 [2,0,0,0,0,0|1,1,0]=4 703 B8R1.72 C[Si]1(CCNCC1)C MCULE-9194930068 [2,0,0,0,0,0|1,1,0]=4 704 B8R1.72 FC1(CCCCC1)F MCULE-7225537600 [2,0,0,0,0,0|2,0,0]=4 705 B10R0.7 CC(CCN)CC(C)(C)CN MCULE-8393125324 [0,1,1,0,0,0|1,0,0]=3 706 B10R0.7 CCCN(C)CC(C)(C)CO MCULE-8677477166 [0,1,1,0,0,0|2,0,0]=4 707 B10R0.28 CC(CC=NO)CC(C)(C)C MCULE-6091171789 [0,1,1,0,0,0|0,0,1]=3 708 B10R0.28 CC(CCC=O)CC(C)(C)C MCULE-3437563453 [0,1,1,0,0,0|0,0,1]=3 709 B10R0.31 CC(=O)CC(C)CC(C)(C)C MCULE-9082084348 [0,1,1,0,0,0|0,0,2]=4 710 B10R0.31 CC(C)(C)CC(N)CC(=O)O MCULE-6200056500 [0,1,1,0,0,0|1,0,1]=4 711 B10R0.31 CC(C)(C)CC(N)CC(=O)O MCULE-8474644246 [0,1,1,0,0,0|1,0,1]=4 712 B10R0.31 CC(C)(C)CC(O)CC(=O)O MCULE-2681590744 [0,1,1,0,0,0|1,0,1]=4 713 B10R0.31 CC(C)(C)C[C@H](N)CC(=O)O MCULE-4145699901 [0,1,1,0,0,0|1,0,1]=4 714 B10R0.31 CC(C)CC(O)CC(C)(C)O MCULE-1308090771 [0,1,1,0,0,0|1,0,0]=3 715 B10R0.31 CC(CC(=O)Cl)CC(C)(C)C MCULE-1318704435 [0,1,1,0,0,0|0,0,2]=4 716 B10R0.31 CC(CC(=O)N)CC(C)(C)C MCULE-2949303662 [0,1,1,0,0,0|0,0,2]=4 717 B10R0.31 CC(CC(=O)O)CC(C)(C)C MCULE-6835808948 [0,1,1,0,0,0|0,0,1]=3 718 B10R0.31 CN(CC(=O)O)CC(C)(C)C MCULE-2314044769 [0,1,1,0,0,0|1,0,1]=4 719 B10R0.31 CN(CC(=O)O)CC(C)(C)C MCULE-2348805903 [0,1,1,0,0,0|1,0,1]=4 720 B10R0.37 COC(=O)C(O)CC(C)(C)C MCULE-1915963171 [0,1,1,0,0,0|1,0,1]=4 721 B10R0.37 C[C@@H](OC(C)(C)C)[C@H](N)CO MCULE-9186012686 [0,1,1,0,0,0|1,0,0]=3 722 B10R0.70 CC(C)CC(=NO)CC(C)C MCULE-1714340389 [0,1,1,0,0,0|0,0,1]=3 723 B10R0.70 CC(C)CC(CN)CC(=O)O MCULE-3978936660 [0,1,1,0,0,0|1,0,1]=4 724 B10R0.70 CC(C)CN(C=O)CC(C)C MCULE-4013086029 [0,1,1,0,0,0|1,0,1]=4 725 B10R0.70 CC(C)CN(CC(C)C)N=O MCULE-4670951589 [0,1,1,0,0,0|1,0,1]=4 726 B10R0.70 CC(C)C[C@@H](CN)CC(=O)O MCULE-6777049998 [0,1,1,0,0,0|1,0,1]=4 727 B10R0.70 CC(C)C[C@H](CN)CC(=O)O MCULE-4620415947 [0,1,1,0,0,0|1,0,1]=4 728 B10R0.70 CC(C)C[C@H](CN)CC(=O)O MCULE-7020681779 [0,1,1,0,0,0|1,0,1]=4 729 B10R0.70 CCC(CC(=O)O)CC(C)C MCULE-6944277794 [0,1,1,0,0,0|1,0,1]=4 730 B10R0.70 CCN(CC(C)O)CC(C)O MCULE-5788318163 [0,1,1,0,0,0|2,0,0]=4 731 B10R0.165 CC(C)CP(=S)(S)CC(C)C MCULE-7019836056 [0,1,1,0,0,0|1,1,0]=4 732 B10R0.102 C=C(C)CC(C)(CC)CCC MCULE-8577868292 [0,1,1,0,0,0|1,0,1]=4 733 B10R0.122 C=C(C)CC(C)(C)CCCC MCULE-3861122001 [0,1,1,0,0,0|1,0,1]=4 734 B10R0.148 CC(CN)CC(C)(C)CCN MCULE-2076322812 [0,1,1,0,0,0|1,0,0]=3 735 B10R1.8 CC1CC(CC(C1)C#N)C MCULE-2746405353 [1,1,0,0,0,0|1,0,0]=3 736 B10R1.8 CC1CC(CC(C1)C=O)C MCULE-8057927767 [1,1,0,0,0,0|0,0,1]=3 737 B10R1.8 CC1CC(CC(C1)CBr)C MCULE-1489300728 [1,1,0,0,0,0|1,0,0]=3 738 B10R1.8 CC1CC(CC(C1)CN)C MCULE-8547220823 [1,1,0,0,0,0|1,0,0]=3 739 B10R1.8 CC1CC(CC(C1)CO)C MCULE-5331575122 [1,1,0,0,0,0|0,0,0]=2 740 B10R1.8 CC1CC(CC(N1)C)CO MCULE-5120639213 [1,1,0,0,0,0|1,0,0]=3 741 B10R1.8 CC1CC(CC(N1)C)CO MCULE-8192770059 [1,1,0,0,0,0|1,0,0]=3 742 B10R1.8 CC1CC(CC(O1)C)C#N MCULE-4948232033 [1,1,0,0,0,0|2,0,0]=4 743 B10R1.8 CC1CC(CC(O1)C)C=O MCULE-6382970154 [1,1,0,0,0,0|1,0,1]=4 744 B10R1.8 CC1CC(CC(O1)C)CN MCULE-1319687929 [1,1,0,0,0,0|2,0,0]=4 745 B10R1.8 CC1CC(CC(O1)C)CO MCULE-2203719785 [1,1,0,0,0,0|1,0,0]=3 746 B10R1.8 CC1CC(CC(O1)C)NN MCULE-6562613875 [1,1,0,0,0,0|2,0,0]=4 747 B10R1.8 CC1CC(CC(O1)C)NN MCULE-9875780953 [1,1,0,0,0,0|2,0,0]=4 748 B10R1.8 CCC1CN(CC(O1)O)C MCULE-7949918787 [1,1,0,0,0,0|2,0,0]=4 749 B10R1.8 CCN1CC(CC(C1)C)C MCULE-7085355035 [1,1,0,0,0,0|2,0,0]=4 750 B10R1.8 CCN1CC(CC(C1)O)C MCULE-1010882594 [1,1,0,0,0,0|1,0,0]=3 751 B10R1.8 CCN1CC(CC(C1)O)C MCULE-5669705831 [1,1,0,0,0,0|1,0,0]=3 752 B10R1.8 CNC1CC(OC(C1)C)C MCULE-7282628972 [1,1,0,0,0,0|2,0,0]=4 753 B10R1.8 C[C@H]1CC(C[C@H](O1)C)CBr MCULE-5205147785 [1,1,0,0,0,0|2,0,0]=4 754 B10R1.8 C[C@H]1CC(C[C@H](O1)C)CO MCULE-8494561530 [1,1,0,0,0,0|1,0,0]=3 755 B10R1.22 C1(CC(CN(C1C)C)C)O MCULE-3064237587 [1,1,0,0,0,0|1,0,0]=3 756 B10R1.22 C1(CC(CN(C1C)C)C)O MCULE-9470034851 [1,1,0,0,0,0|1,0,0]=3 757 B10R1.22 CC1CC(C(C(O1)O)O)O MCULE-5231916221 [1,1,0,0,0,0|2,0,0]=4 758 B10R1.22 CC1CC(CC(N1C)C)O MCULE-5998376732 [1,1,0,0,0,0|1,0,0]=3 759 B10R1.22 CC1OC(CC(C1O)N)O MCULE-4616714223 [1,1,0,0,0,0|2,0,0]=4 760 B10R1.22 CC1OC(CC(C1O)N)O MCULE-5441966301 [1,1,0,0,0,0|2,0,0]=4 761 B10R1.120 CC1(CC(=O)CCC1O)C MCULE-3406731798 [1,1,0,0,0,0|0,0,2]=4 762 B10R1.120 CC1(CC(CCC1=O)O)C MCULE-3017983928 [1,1,0,0,0,0|0,0,1]=3 763 B10R1.120 CC1(CC(CNC1=O)O)C MCULE-2099532471 [1,1,0,0,0,0|1,0,1]=4 764 B10R1.120 CC1(CN(CCN1O)O)C MCULE-1848571945 [1,1,0,0,0,0|2,0,0]=4 765 B10R1.120 CN1CCC(C(C1)(C)C)N MCULE-6995284721 [1,1,0,0,0,0|1,0,0]=3 766 B10R1.120 CN1CCC(C(C1)(C)C)N MCULE-7728442404 [1,1,0,0,0,0|1,0,0]=3 767 B10R1.120 CN1CC[C@@H](C(C1)(C)C)N MCULE-9787160755 [1,1,0,0,0,0|1,0,0]=3 768 B10R1.120 CN1CC[C@H](C(C1)(C)C)N MCULE-2033530008 [1,1,0,0,0,0|1,0,0]=3 769 B10R1.147 CC1(CC[C@H]([C@@H](C1)N)O)C MCULE-4905794012 [1,1,0,0,0,0|1,0,0]=3 770 B10R1.147 CC1(CC[C@H]([C@@H](C1)N)O)C MCULE-6702504403 [1,1,0,0,0,0|1,0,0]=3 771 B10R1.147 CC1CC(CCC1=O)(C)C MCULE-6032665191 [1,1,0,0,0,0|0,0,1]=3 772 B10R1.147 CC1CC(CCC1N)(C)C MCULE-8931165199 [1,1,0,0,0,0|0,0,0]=2 773 B10R1.147 CC1CCC(CC1=O)(C)C MCULE-4890293189 [1,1,0,0,0,0|0,0,2]=4 774 B10R1.147 CC1C[N+](CCC1=O)(C)C MCULE-2227899503 [1,1,0,0,0,0|1,0,1]=4 775 B10R1.147 CC1C[N+](CCC1=O)(C)C MCULE-7138280616 [1,1,0,0,0,0|1,0,1]=4 776 B10R1.147 NC1CCC(CC1O)(F)F MCULE-5746702185 [1,1,0,0,0,0|2,0,0]=4 777 B10R1.147 NC1CCC(CC1O)(F)F MCULE-9118673049 [1,1,0,0,0,0|2,0,0]=4 778 B10R1.147 N[C@@H]1CCC(C[C@@H]1O)(F)F MCULE-2769224483 [1,1,0,0,0,0|2,0,0]=4 779 B10R1.147 N[C@@H]1CCC(C[C@@H]1O)(F)F MCULE-8244669902 [1,1,0,0,0,0|2,0,0]=4 780 B10R1.147 N[C@@H]1CCC(C[C@H]1O)(F)F MCULE-1235893959 [1,1,0,0,0,0|2,0,0]=4 781 B10R1.147 N[C@@H]1CCC(C[C@H]1O)(F)F MCULE-6570560470 [1,1,0,0,0,0|2,0,0]=4 782 B10R1.147 N[C@H]1CCC(C[C@@H]1O)(F)F MCULE-3453383876 [1,1,0,0,0,0|2,0,0]=4 783 B10R1.147 N[C@H]1CCC(C[C@@H]1O)(F)F MCULE-6939066621 [1,1,0,0,0,0|2,0,0]=4 784 B10R1.147 N[C@H]1CCC(C[C@H]1O)(F)F MCULE-2193066605 [1,1,0,0,0,0|2,0,0]=4 785 B10R1.171 CC1(CC(=NO)CCO1)C MCULE-2784364474 [1,1,0,0,0,0|1,0,1]=4 786 B10R1.171 CC1(CC(CCN1)CO)C MCULE-1955271059 [1,1,0,0,0,0|1,0,0]=3 787 B10R1.171 CC1(CC(CCO1)C#N)C MCULE-2143777381 [1,1,0,0,0,0|1,0,1]=4 788 B10R1.171 CC1(CC(CCO1)C=O)C MCULE-7681885506 [1,1,0,0,0,0|1,0,1]=4 789 B10R1.171 CC1(CC(CCO1)CBr)C MCULE-8097359200 [1,1,0,0,0,0|1,0,0]=3 790 B10R1.171 CC1(CC(CCO1)CN)C MCULE-5586634215 [1,1,0,0,0,0|1,0,0]=3 791 B10R1.171 CC1(CC(CCO1)CN)C MCULE-8140567688 [1,1,0,0,0,0|1,0,0]=3 792 B10R1.171 CC1(CC(CCO1)CO)C MCULE-9082743031 [1,1,0,0,0,0|1,0,0]=3 793 B10R1.171 CC1(CC(CCO1)NN)C MCULE-1417383773 [1,1,0,0,0,0|2,0,0]=4 794 B10R1.171 CC1(CC(CCO1)NN)C MCULE-3184856839 [1,1,0,0,0,0|2,0,0]=4 795 B10R1.171 CC1(CC(CCO1)NN)C MCULE-4563650190 [1,1,0,0,0,0|2,0,0]=4 796 B10R1.171 CC1(CCCC(C1)C#N)C MCULE-8768863448 [1,1,0,0,0,0|0,0,1]=3 797 B10R1.171 CC1(CCCC(C1)C=O)C MCULE-2204954553 [1,1,0,0,0,0|0,0,1]=3 798 B10R1.171 CC1(CCCC(C1)CBr)C MCULE-6827732566 [1,1,0,0,0,0|0,0,0]=2 799 B10R1.171 CC1(CCCC(C1)CN)C MCULE-1309816062 [1,1,0,0,0,0|0,0,0]=2 800 B10R1.171 CC1(CCCC(C1)CN)C MCULE-9031442936 [1,1,0,0,0,0|0,0,0]=2 801 B10R1.171 CC1(CCCC(C1)CO)C MCULE-8689403766 [1,1,0,0,0,0|0,0,0]=2 802 B10R1.171 CC1(CCCC(O1)CBr)C MCULE-5779384506 [1,1,0,0,0,0|1,0,0]=3 803 B10R1.171 CC1(CCCC(O1)CN)C MCULE-3816264715 [1,1,0,0,0,0|1,0,0]=3 804 B10R1.171 CC1(CCCC(O1)CO)C MCULE-1867067691 [1,1,0,0,0,0|1,0,0]=3 805 B10R1.171 CC1(CNCC(O1)CO)C MCULE-6507862755 [1,1,0,0,0,0|2,0,0]=4 806 B10R1.171 CC1(CNCC(O1)CO)C MCULE-9375076720 [1,1,0,0,0,0|2,0,0]=4 807 B10R1.171 CC1(CNC[C@@H](O1)CO)C MCULE-3650294833 [1,1,0,0,0,0|2,0,0]=4 808 B10R1.171 CC1(CNC[C@@H](O1)CO)C MCULE-6483552042 [1,1,0,0,0,0|2,0,0]=4 809 B10R1.171 CC1(CNC[C@@H](O1)CO)C MCULE-9465474328 [1,1,0,0,0,0|2,0,0]=4 810 B10R1.171 CC1(CNC[C@@H](O1)CO)C MCULE-9570461644 [1,1,0,0,0,0|2,0,0]=4 811 B10R1.171 CC1(CNC[C@H](O1)CO)C MCULE-2895098961 [1,1,0,0,0,0|2,0,0]=4 812 B10R1.171 CC1(CNC[C@H](O1)CO)C MCULE-3490246150 [1,1,0,0,0,0|2,0,0]=4 813 B10R1.171 CC1(CNC[C@H](O1)CO)C MCULE-5127936928 [1,1,0,0,0,0|2,0,0]=4 814 B10R1.171 CC1(CNC[C@H](O1)CO)C MCULE-8584842450 [1,1,0,0,0,0|2,0,0]=4 815 B10R1.171 CC1(COCC(O1)CI)C MCULE-9843828179 [1,1,0,0,0,0|2,0,0]=4 816 B10R1.171 CC1(COCC(O1)CO)C MCULE-8002828835 [1,1,0,0,0,0|2,0,0]=4 817 B10R1.171 CC1(C[C@H](CCO1)C=O)C MCULE-3961352621 [1,1,0,0,0,0|1,0,1]=4 818 B10R1.171 CC1(OCC[C@H](O1)CBr)C MCULE-8263957716 [1,1,0,0,0,0|2,0,0]=4 819 B10R1.171 CCC1CNCC(N1)(C)C MCULE-4462902822 [1,1,0,0,0,0|2,0,0]=4 820 B10R1.171 CCN1CCNC(C1)(C)C MCULE-6149537326 [1,1,0,0,0,0|2,0,0]=4 821 B10R1.171 CNC1CCOC(C1)(C)C MCULE-7665979214 [1,1,0,0,0,0|1,0,0]=3 822 B10R1.171 NCC1CCCC(C1)(F)F MCULE-3118835745 [1,1,0,0,0,0|2,0,0]=4 823 B10R1.171 NCC1CCCC(C1)(F)F MCULE-8118294557 [1,1,0,0,0,0|2,0,0]=4 824 B10R1.171 NC[C@@H]1CCCC(C1)(F)F MCULE-5921039306 [1,1,0,0,0,0|2,0,0]=4 825 B10R1.171 NC[C@H]1CCCC(C1)(F)F MCULE-2634249384 [1,1,0,0,0,0|2,0,0]=4 826 B10R1.171 NC[C@H]1CCCC(C1)(F)F MCULE-2785146067 [1,1,0,0,0,0|2,0,0]=4 827 B10R1.171 NC[C@H]1CCCC(C1)(F)F MCULE-9003508929 [1,1,0,0,0,0|2,0,0]=4 828 B10R1.171 OCC1CCCC(C1)(F)F MCULE-3596045125 [1,1,0,0,0,0|2,0,0]=4 829 B10R1.301 CC1(CCCC(C1=O)Cl)C MCULE-6998065064 [1,1,0,0,0,0|1,0,1]=4 830 B10R1.301 CC1(CCCC(C1=O)F)C MCULE-9527807140 [1,1,0,0,0,0|1,0,1]=4 831 B10R1.301 CC1CCCC(C1=O)(C)C MCULE-3194713697 [1,1,0,0,0,0|0,0,1]=3 832 B10R1.307 CC1(CCCC(N1)(C)C)C MCULE-2103274997 [1,1,0,0,0,0|1,0,0]=3 833 B10R1.307 CC1(CNCC(C1)(C)C)C MCULE-5785442062 [1,1,0,0,0,0|1,0,0]=3 834 B10R1.307 CC1(CNCC(C1)(C)C)C MCULE-8398832588 [1,1,0,0,0,0|1,0,0]=3 835 B10R1.307 CC1(CNCC(N1)(C)C)C MCULE-7255783659 [1,1,0,0,0,0|2,0,0]=4 836 B10R1.307 CC1(CNCC(O1)(C)C)C MCULE-9069759486 [1,1,0,0,0,0|2,0,0]=4 837 B10R1.307 CC1(COCC(N1)(C)C)C MCULE-2409470363 [1,1,0,0,0,0|2,0,0]=4 838 B10R1.307 CC1(COCC(N1)(C)C)C MCULE-3410965092 [1,1,0,0,0,0|2,0,0]=4 839 B10R1.485 CC1CCCC(C1)(N)C#N MCULE-5888477254 [1,1,0,0,0,0|1,0,1]=4 840 B10R1.485 CC1CCCC(C1)(N)CO MCULE-2631831392 [1,1,0,0,0,0|1,0,0]=3 841 B10R1.485 CC1CCCC(C1)(O)C#N MCULE-3826837366 [1,1,0,0,0,0|1,0,1]=4 842 B10R1.485 CC1CCCC(C1)(O)CN MCULE-1845541401 [1,1,0,0,0,0|1,0,0]=3 843 B10R1.485 CC1CCCC(C1)(O)CN MCULE-9637857562 [1,1,0,0,0,0|1,0,0]=3 844 B10R1.485 CN1CCCC(C1)(C)CO MCULE-3371982615 [1,1,0,0,0,0|1,0,0]=3 845 B10R1.485 CO[C@@]1(CCC[C@@H](C1)N)C MCULE-6941154911 [1,1,0,0,0,0|1,0,0]=3 846 B10R1.485 CO[C@]1(CCC[C@@H](C1)N)C MCULE-7699708589 [1,1,0,0,0,0|1,0,0]=3 847 B10R1.485 CO[C@]1(CCC[C@H](C1)N)C MCULE-8610581080 [1,1,0,0,0,0|1,0,0]=3 848 B10R1.560 CC1(CC(=O)C(C1)(C)C)C MCULE-8121217649 [0,1,0,0,1,0|0,0,2]=4 849 B10R1.560 CC1(CC(C(C1)(C)C)N)C MCULE-5078808727 [0,1,0,0,1,0|1,0,0]=3 850 B10R1.560 CC1(CC(C(C1)(C)C)N)C MCULE-8876812596 [0,1,0,0,1,0|1,0,0]=3 851 B10R1.560 CC1(CC(C(O1)(C)C)N)C MCULE-1159090457 [0,1,0,0,1,0|2,0,0]=4 852 B10R1.560 CC1(CC(C(O1)(C)C)N)C MCULE-5878313513 [0,1,0,0,1,0|2,0,0]=4 853 B10R1.560 CC1(CC(C(O1)(C)C)O)C MCULE-3884758247 [0,1,0,0,1,0|1,0,0]=3 854 B10R1.560 CC1(C[C@@H](C(C1)(C)C)N)C MCULE-4247215849 [0,1,0,0,1,0|1,0,0]=3 855 B10R1.560 CC1(C[C@@H](C(C1)(C)C)N)C MCULE-7443986248 [0,1,0,0,1,0|1,0,0]=3 856 B10R1.36 CCN1CC(C(C1)(C)C)N MCULE-2747563354 [0,1,0,0,1,0|2,0,0]=4 857 B10R1.36 CCN1CC(C(C1)(C)C)N MCULE-8588776893 [0,1,0,0,1,0|2,0,0]=4 858 B10R1.272 CC1(CC(=O)CC1(C)C)C MCULE-8771877902 [0,1,0,0,1,0|0,0,2]=4 859 B10R1.272 CC1(CC(CC1(C)C)N)C MCULE-4283195514 [0,1,0,0,1,0|1,0,0]=3 860 B12R1.42 CC1CC(CC(C1)(C)C)CCN MCULE-6586875514 [0,2,0,0,0,0|1,0,0]=3 861 B12R1.42 CC1CC(CC(C1)(C)C)N=C=S MCULE-2412682646 [0,2,0,0,0,0|0,1,0]=3 862 B12R1.242 CC1(CC(=NO)CC(N1)(C)C)C MCULE-9202973877 [0,2,0,0,0,0|1,0,1]=4 863 B12R1.242 CC1(CC(CC(C1)(C)C)C#N)C MCULE-6432630962 [0,2,0,0,0,0|1,0,0]=3 864 B12R1.242 CC1(CC(CC(C1)(C)C)C=O)C MCULE-6574367541 [0,2,0,0,0,0|0,0,1]=3 865 B12R1.242 CC1(CC(CC(C1)(C)C)CN)C MCULE-6505676517 [0,2,0,0,0,0|1,0,0]=3 866 B12R1.242 CC1(CC(CC(C1)(C)C)CN)C MCULE-7582122743 [0,2,0,0,0,0|1,0,0]=3 867 B12R1.242 CC1(CC(CC(N1)(C)C)C#N)C MCULE-4792694848 [0,2,0,0,0,0|2,0,0]=4 868 B12R1.242 CC1(CC(CC(N1)(C)C)CN)C MCULE-9773374452 [0,2,0,0,0,0|2,0,0]=4 869 B12R1.242 CC1(CC(CC(N1)(C)C)CO)C MCULE-3075320529 [0,2,0,0,0,0|1,0,0]=3 870 B12R1.242 CC1(CC(CC(O1)(C)C)C#N)C MCULE-5563720716 [0,2,0,0,0,0|2,0,0]=4 871 B12R1.242 CC1(CC(CC(O1)(C)C)C=O)C MCULE-3371264516 [0,2,0,0,0,0|1,0,1]=4 872 B12R1.242 CC1(CC(CC(O1)(C)C)CBr)C MCULE-2204775925 [0,2,0,0,0,0|2,0,0]=4 873 B12R1.242 CC1(CC(CC(O1)(C)C)CN)C MCULE-5691530720 [0,2,0,0,0,0|2,0,0]=4 874 B12R1.242 CC1(CC(CC(O1)(C)C)CN)C MCULE-6542532443 [0,2,0,0,0,0|2,0,0]=4 875 B12R1.242 CC1(CC(CC(O1)(C)C)CO)C MCULE-4623242451 [0,2,0,0,0,0|1,0,0]=3 876 B12R1.242 CNC1CC(CC(C1)(C)C)(C)C MCULE-2806932516 [0,2,0,0,0,0|1,0,0]=3 877 B12R1.242 CNC1CC(CC(C1)(C)C)(C)C MCULE-3453886477 [0,2,0,0,0,0|1,0,0]=3 878 B12R1.242 CNC1CC(NC(C1)(C)C)(C)C MCULE-6668708710 [0,2,0,0,0,0|2,0,0]=4 879 B12R1.242 COC1CC(NC(C1)(C)C)(C)C MCULE-1650900334 [0,2,0,0,0,0|1,0,0]=3 880 B12R1.242 COC1CC(NC(C1)(C)C)(C)C MCULE-4358486697 [0,2,0,0,0,0|1,0,0]=3 881 B12R1.242 N1C(CC(=NO)CC1(C)C)(C)C MCULE-6156081497 [0,2,0,0,0,0|1,0,1]=4 882 B12R1.3005 C[C@H]1C[C@H](CC(C1)(C)C)C(=O)O MCULE-1133384955 [0,2,0,0,0,0|0,0,0]=2 883 B12R1.4126 CC1(CC(=O)CC(C1)(C)C#N)C MCULE-8979673825 [0,2,0,0,0,0|0,0,2]=4 884 B12R1.4126 CC1(CC(CC(C1)(C)C#N)O)C MCULE-5197643909 [0,2,0,0,0,0|0,0,0]=2 885 B12R1.4126 CC1(CC(CC(C1)(C)CN)N)C MCULE-8499525000 [0,2,0,0,0,0|1,0,0]=3 886 B12R1.4126 CC1(CC(CC(C1)(C)CN)O)C MCULE-4336837911 [0,2,0,0,0,0|0,0,0]=2 887 B12R1.4126 CC1CC(CC(C1)(N)CO)(C)C MCULE-9219637458 [0,2,0,0,0,0|0,0,0]=2 888 B12R1.510 CC1(CC(CC(N1O)(C)C)O)C MCULE-4728804324 [0,2,0,0,0,0|1,0,0]=3 889 B12R1.510 CN1C(CC(CC1(C)C)N)(C)C MCULE-2468161096 [0,2,0,0,0,0|2,0,0]=4 890 B12R1.510 CN1C(CC(CC1(C)C)N)(C)C MCULE-2833892344 [0,2,0,0,0,0|2,0,0]=4 891 B12R1.510 CN1C(CC(CC1(C)C)O)(C)C MCULE-8304613211 [0,2,0,0,0,0|1,0,0]=3 892 B12R1.3828 CC[N+]1(CC(CC(C1)C)C)CC MCULE-7733083759 [0,2,0,0,0,0|2,0,0]=4 893 B12R1.3828 CC[N+]1(CC(CC(C1)C)C)CC MCULE-8777867320 [0,2,0,0,0,0|2,0,0]=4 894 B12R1.4366 CC1(CC(CC(C1)(C)N)(C)C)C MCULE-1197310849 [0,2,0,0,0,0|1,0,0]=3 895 B12R1.4366 CC1(CC(CC(C1)(C)N)(C)C)C MCULE-6687301035 [0,2,0,0,0,0|1,0,0]=3 896 B12R1.4366 CC1(CC(CC(C1)(C)N)(C)C)C MCULE-7213542753 [0,2,0,0,0,0|1,0,0]=3 897 B12R1.4366 CC1(CC(CC(N1)(C)C)(F)F)C MCULE-3724338833 [0,2,0,0,0,0|2,0,0]=4 898 B12R1.4366 CC1(CC(CC(N1)(C)C)(F)F)C MCULE-9072212320 [0,2,0,0,0,0|2,0,0]=4 899 B10R1.65 CC(C)(C)C1CCCC1=O MCULE-9201623369 [0,0,1,1,0,0|0,0,2]=4 900 B10R1.65 CC(C)(C)C1CCCC1N MCULE-4907078385 [0,0,1,1,0,0|1,0,0]=3 901 B10R1.95 CC1(CCN(C1)CCN)C MCULE-4510145661 [0,0,1,1,0,0|2,0,0]=4 902 B10R1.95 CC1(OCC(O1)CCO)C MCULE-6686179342 [0,0,1,1,0,0|2,0,0]=4 903 B10R1.95 CC1(OC[C@@H](O1)CCO)C MCULE-3500329732 [0,0,1,1,0,0|2,0,0]=4 904 B10R1.95 CC1(OC[C@@H](O1)CCO)C MCULE-8004730878 [0,0,1,1,0,0|2,0,0]=4 905 B10R1.95 CC1(OC[C@H](O1)CCO)C MCULE-2465279380 [0,0,1,1,0,0|2,0,0]=4 906 B10R1.95 CC1(OC[C@H](O1)CCO)C MCULE-8091730647 [0,0,1,1,0,0|2,0,0]=4 907 B10R1.112 CC(C)(C)OC1CC(C1)Br MCULE-8756725069 [0,0,1,1,0,0|2,0,0]=4 908 B10R1.112 CC(C)(C)OC1CC(C1)N MCULE-1089691216 [0,0,1,1,0,0|2,0,0]=4 909 B10R1.112 CC(C)(C)OC1CC(C1)N MCULE-3220199438 [0,0,1,1,0,0|2,0,0]=4 910 B10R1.112 CC(C)(C)OC1CC(C1)O MCULE-7366334192 [0,0,1,1,0,0|1,0,0]=3 911 B10R1.276 CC1(CNCCC(C1)O)C MCULE-6374437169 [0,0,1,1,0,0|1,0,0]=3 912 B10R1.281 CC(C)(C)CC1CCCN1 MCULE-1822620124 [0,0,1,1,0,0|1,0,0]=3 913 B10R1.281 CC(C)(C)CC1CCNC1 MCULE-6770921069 [0,0,1,1,0,0|1,0,0]=3 914 B10R1.281 CC(C)(C)OC1CCNC1 MCULE-2759594352 [0,0,1,1,0,0|2,0,0]=4 915 B10R1.281 CC(C)(C)OC1CCNC1 MCULE-4511005955 [0,0,1,1,0,0|2,0,0]=4 916 B10R1.281 CC(C)(C)O[C@@H]1CCNC1 MCULE-4852307541 [0,0,1,1,0,0|2,0,0]=4 917 B10R1.281 CC(C)(C)O[C@@H]1CCNC1 MCULE-5705183643 [0,0,1,1,0,0|2,0,0]=4 918 B10R1.281 CC(C)(C)O[C@H]1CCNC1 MCULE-2905845493 [0,0,1,1,0,0|2,0,0]=4 919 B10R1.281 CC(C)(C)O[C@H]1CCNC1 MCULE-8620427409 [0,0,1,1,0,0|2,0,0]=4 920 B10R1.281 C[N+](C)(C)CC1COCO1 MCULE-2683245957 [0,0,1,1,0,0|2,0,0]=4 921 B10R1.281 C[N+](C)(C)CC1COCO1 MCULE-9863107484 [0,0,1,1,0,0|2,0,0]=4 922 B10R1.306 CC(C)(C)CC1(CNC1)O MCULE-3792126913 [0,0,1,1,0,0|1,0,0]=3 923 B10R1.373 CC(C)(C)CC(=O)C1CC1 MCULE-8181824467 [0,0,1,1,0,0|0,0,2]=4 924 B10R1.400 CCCC(=O)C1CC1(C)C MCULE-2712823382 [0,0,1,1,0,0|0,0,2]=4 925 B10R1.54 CC(C)CC1CCC(=O)C1 MCULE-8411928960 [0,0,1,1,0,0|0,0,2]=4 926 B10R1.54 CC(C)CC1CCC(C1)N MCULE-7060889690 [0,0,1,1,0,0|1,0,0]=3 927 B10R1.54 CC(C)CC1OCC(O1)C MCULE-6784853183 [0,0,1,1,0,0|1,0,0]=3 928 B10R1.54 CC(C)CN1CCC(C1)N MCULE-5426559651 [0,0,1,1,0,0|2,0,0]=4 929 B10R1.54 CC(C)CN1CCC(C1)N MCULE-9093123958 [0,0,1,1,0,0|2,0,0]=4 930 B10R1.54 CC(C)CN1CC[C@@H](C1)N MCULE-1817696862 [0,0,1,1,0,0|2,0,0]=4 931 B10R1.54 CC(C)CN1CC[C@H](C1)N MCULE-2567958037 [0,0,1,1,0,0|2,0,0]=4 932 B10R1.54 CC(C)CN1CC[C@H](C1)N MCULE-3029290218 [0,0,1,1,0,0|2,0,0]=4 933 B10R1.54 CC1CCC(C1)CC(=O)O MCULE-2712956835 [0,0,1,1,0,0|1,0,1]=4 934 B10R1.368 CC(C)C[C@@H]1C[C@H]1C(=O)O MCULE-7367162008 [0,0,1,1,0,0|1,0,1]=4 935 B10R1.371 CC(C)NC1CC(C1)(C)C MCULE-7950004078 [0,0,1,1,0,0|2,0,0]=4 936 B10R1.371 CC(C)NC1CC(C1)(C)C MCULE-9732632068 [0,0,1,1,0,0|2,0,0]=4 937 B10R1.128 CC(C)C1OCC[N+]1(C)C MCULE-4565923133 [0,0,1,1,0,0|1,0,0]=3 938 B10R1.128 CC(C)C1OCC[N+]1(C)C MCULE-9014688596 [0,0,1,1,0,0|1,0,0]=3 939 B10R1.128 CC1(CCCC1C(=O)O)C MCULE-4580682391 [0,0,1,1,0,0|1,0,1]=4 940 B10R1.254 CC1(OC(C1CO)(C)C)C MCULE-6702903222 [0,0,1,1,0,0|1,0,0]=3 941 B10R1.358 CC(C)(CC(=O)O)C1CC1 MCULE-9099960685 [0,0,1,1,0,0|1,0,1]=4 942 B10R1.370 CC(C)CC1(CCCN1)C MCULE-2855879384 [0,0,1,1,0,0|2,0,0]=4 943 B10R1.370 CC1(CCCC1)CC(=O)O MCULE-4967984413 [0,0,1,1,0,0|1,0,1]=4 944 B10R1.370 CN(C)CC1(CCNC1)C MCULE-8355932133 [0,0,1,1,0,0|2,0,0]=4 945 B10R1.370 CN(C)CC1(CCNC1)C MCULE-9102513856 [0,0,1,1,0,0|2,0,0]=4 946 B10R2.63 NC1CC2CC(C1C2)O MCULE-3175801783 [1,0,0,1,0,0|1,0,0]=3 947 B10R2.63 NC1CC2CC(C1C2)O MCULE-4511947514 [1,0,0,1,0,0|1,0,0]=3 948 B10R2.71 C1(CC2CCC(C1)O2)O MCULE-1647391755 [1,0,0,1,0,0|1,0,0]=3 949 B10R2.71 CC1CC2CCC(C1)N2 MCULE-1955785457 [1,0,0,1,0,0|2,0,0]=4 950 B10R2.71 FC1CC2CCC(C1)N2 MCULE-6770205882 [1,0,0,1,0,0|2,0,0]=4 951 B10R2.71 FC1CC2CCC(C1)N2 MCULE-8990681537 [1,0,0,1,0,0|2,0,0]=4 952 B10R2.71 F[C@H]1C[C@@H]2CC[C@H](C1)N2 MCULE-5894622698 [1,0,0,1,0,0|2,0,0]=4 953 B10R2.71 F[C@H]1C[C@@H]2CC[C@H](C1)N2 MCULE-8603742266 [1,0,0,1,0,0|2,0,0]=4 954 B10R2.71 NC1CC2CCC(C1)C2 MCULE-4574547962 [1,0,0,1,0,0|1,0,0]=3 955 B10R2.71 NC1CC2CCC(C1)C2 MCULE-9895969618 [1,0,0,1,0,0|1,0,0]=3 956 B10R2.71 NC1CC2CCC(C1)N2 MCULE-3854541258 [1,0,0,1,0,0|2,0,0]=4 957 B10R2.71 NC1CC2CCC(C1)N2 MCULE-7229082830 [1,0,0,1,0,0|2,0,0]=4 958 B10R2.71 NC1CC2CCC(C1)O2 MCULE-4457544306 [1,0,0,1,0,0|2,0,0]=4 959 B10R2.71 NC1CC2CCC(C1)O2 MCULE-9929281022 [1,0,0,1,0,0|2,0,0]=4 960 B10R2.71 NC1CC2CCC(C1)S2 MCULE-6100710495 [1,0,0,1,0,0|2,0,0]=4 961 B10R2.71 NC1CC2CCC(C1)S2 MCULE-9741713579 [1,0,0,1,0,0|2,0,0]=4 962 B10R2.71 N[C@@H]1C[C@@H]2CC[C@H](C1)O2 MCULE-3383622461 [1,0,0,1,0,0|2,0,0]=4 963 B10R2.71 O=C1CC2CCC(C1)C2 MCULE-7387433305 [1,0,0,1,0,0|0,0,2]=4 964 B10R2.71 OC1CC2CCC(C1)C2 MCULE-2298959952 [1,0,0,1,0,0|0,0,0]=2 965 B10R2.71 OC1CC2CCC(C1)N2 MCULE-1984182265 [1,0,0,1,0,0|1,0,0]=3 966 B10R2.71 OC1CC2CCC(C1)N2 MCULE-8723724278 [1,0,0,1,0,0|1,0,0]=3 967 B10R2.71 OC1CC2CNC(C1)C2 MCULE-7235392219 [1,0,0,1,0,0|1,0,0]=3 968 B10R2.71 O[C@@H]1C[C@@H]2CC[C@H](C1)N2 MCULE-5739413050 [1,0,0,1,0,0|1,0,0]=3 969 B10R2.71 O[C@@H]1C[C@@H]2CC[C@H](C1)N2 MCULE-7201642986 [1,0,0,1,0,0|1,0,0]=3 970 B10R2.71 [C@@H]1(C[C@@H]2CC[C@H](C1)N2)O MCULE-1257362100 [1,0,0,1,0,0|1,0,0]=3 971 B10R2.71 [C@@H]1(C[C@@H]2CC[C@H](C1)N2)O MCULE-6641612222 [1,0,0,1,0,0|1,0,0]=3 972 B10R2.71 [C@@H]1(C[C@@H]2CC[C@H](C1)O2)O MCULE-3855768470 [1,0,0,1,0,0|1,0,0]=3 973 B10R2.71 [C@@H]12CC[C@@H](N1)C[C@@H](C2)F MCULE-2006046888 [1,0,0,1,0,0|2,0,0]=4 974 B10R2.71 [C@@H]12CC[C@@H](N1)C[C@@H](C2)F MCULE-8693026463 [1,0,0,1,0,0|2,0,0]=4 975 B10R2.71 [C@@H]12CC[C@@H](O1)C[C@@H](C2)N MCULE-2499502135 [1,0,0,1,0,0|2,0,0]=4 976 B10R2.71 [C@@H]12CC[C@@H](O1)C[C@@H](C2)O MCULE-1754778403 [1,0,0,1,0,0|1,0,0]=3 977 B10R2.71 [C@@H]12CC[C@@H](O1)C[C@H](C2)N MCULE-4965442507 [1,0,0,1,0,0|2,0,0]=4 978 B10R2.71 [C@@H]12CC[C@@H](O1)C[C@H](C2)N MCULE-9924603903 [1,0,0,1,0,0|2,0,0]=4 979 B10R2.28 CC1(CC2CCC1C2)O MCULE-8233333167 [1,0,0,1,0,0|1,0,0]=3 980 B10R2.28 ClC1(CC2CCC1C2)Cl MCULE-2079435104 [1,0,0,1,0,0|2,0,0]=4 981 B10R2.177 CC12CC(=O)CCC1C2 MCULE-5784409358 [1,0,0,1,0,0|0,0,2]=4 982 B10R2.179 CC12CCCC(=O)C1C2 MCULE-5216940743 [1,0,0,1,0,0|0,0,2]=4 983 B10R2.189 FC1(CCCC2C1O2)F MCULE-3706219721 [1,0,0,1,0,0|2,0,0]=4 984 B10R2.235 NC12CCCC(C1)(C2)F MCULE-4300596844 [1,0,0,1,0,0|2,0,0]=4 985 B10R2.235 NC12CCCC(C1)(C2)F MCULE-4478085866 [1,0,0,1,0,0|2,0,0]=4 986 B10R2.235 NC12CCCC(C1)(C2)N MCULE-6759621588 [1,0,0,1,0,0|2,0,0]=4 987 B10R2.235 NC12CCCC(C1)(C2)N MCULE-7734028385 [1,0,0,1,0,0|2,0,0]=4 988 B10R2.235 NC12CCCC(C1)(C2)O MCULE-8021440200 [1,0,0,1,0,0|1,0,0]=3 989 B10R2.236 NC12CCCC(C1)CC2 MCULE-4834646455 [1,0,0,1,0,0|1,0,0]=3 990 B10R2.236 NC12CCCC(C1)CC2 MCULE-5964475647 [1,0,0,1,0,0|1,0,0]=3 991 B10R2.236 NC12CCCN(C1)CC2 MCULE-6583928178 [1,0,0,1,0,0|2,0,0]=4 992 B10R2.236 NC12CCCN(C1)CC2 MCULE-9637386686 [1,0,0,1,0,0|2,0,0]=4 993 B10R2.259 [C@@H]12CC[C@H]([C@@H]1C2(F)F)O MCULE-9384392055 [1,0,0,1,0,0|2,0,0]=4 994 B10R2.259 [C@H]12CC[C@H]([C@H]1C2(F)F)O MCULE-4891987904 [1,0,0,1,0,0|2,0,0]=4 995 B10R2.534 CC1CNCC2(C1)CC2 MCULE-4386601014 [1,0,0,1,0,0|1,0,0]=3 996 B10R2.534 CC1CNCC2(C1)CC2 MCULE-6632242581 [1,0,0,1,0,0|1,0,0]=3 997 B10R2.534 CC1CNCC2(N1)CC2 MCULE-5500468478 [1,0,0,1,0,0|2,0,0]=4 998 B10R2.534 CC1CNCC2(N1)CC2 MCULE-9357090635 [1,0,0,1,0,0|2,0,0]=4 999 B10R2.534 CN1CCNC2(C1)CC2 MCULE-3501562773 [1,0,0,1,0,0|2,0,0]=4 1000 B10R2.534 CN1CCNC2(C1)CC2 MCULE-6078417501 [1,0,0,1,0,0|2,0,0]=4 1001 B10R2.534 C[C@@H]1CNCC2(N1)CC2 MCULE-2252976571 [1,0,0,1,0,0|2,0,0]=4 1002 B10R2.534 C[C@@H]1CNCC2(N1)CC2 MCULE-4360915455 [1,0,0,1,0,0|2,0,0]=4 1003 B10R2.534 C[C@@H]1CNCC2(N1)CC2 MCULE-7683580827 [1,0,0,1,0,0|2,0,0]=4 1004 B10R2.534 C[C@@H]1CNCC2(N1)CC2 MCULE-8861340316 [1,0,0,1,0,0|2,0,0]=4 1005 B10R2.534 C[C@@H]1CNCC2(N1)CC2 MCULE-8928902766 [1,0,0,1,0,0|2,0,0]=4 1006 B10R2.534 C[C@H]1CNCC2(N1)CC2 MCULE-3900686951 [1,0,0,1,0,0|2,0,0]=4 1007 B10R2.534 C[C@H]1CNCC2(N1)CC2 MCULE-7934130869 [1,0,0,1,0,0|2,0,0]=4 1008 B10R2.534 C[C@H]1CNCC2(N1)CC2 MCULE-8694560680 [1,0,0,1,0,0|2,0,0]=4 1009 B10R2.534 C[C@H]1CNCC2(N1)CC2 MCULE-9758956157 [1,0,0,1,0,0|2,0,0]=4 1010 B10R2.534 NC1CCCC2(C1)CC2 MCULE-2187253925 [1,0,0,1,0,0|1,0,0]=3 1011 B10R2.534 NC1CCCC2(C1)CC2 MCULE-9296705646 [1,0,0,1,0,0|1,0,0]=3 1012 B10R2.534 N[C@@H]1CCCC2(C1)CC2 MCULE-1770559203 [1,0,0,1,0,0|1,0,0]=3 1013 B10R2.534 N[C@H]1CCCC2(C1)CC2 MCULE-4076893641 [1,0,0,1,0,0|1,0,0]=3 1014 B10R2.534 N[C@H]1CCCC2(C1)CC2 MCULE-4142713087 [1,0,0,1,0,0|1,0,0]=3 1015 B10R2.534 N[C@H]1CCCC2(C1)CC2 MCULE-7188601239 [1,0,0,1,0,0|1,0,0]=3 1016 B10R2.534 O=C1CCCC2(C1)CC2 MCULE-4819962384 [1,0,0,1,0,0|0,0,2]=4 1017 B10R2.534 OC1CCNC2(C1)CC2 MCULE-3702256154 [1,0,0,1,0,0|1,0,0]=3 1018 B10R2.534 OC1CCNC2(C1)CC2 MCULE-7283154436 [1,0,0,1,0,0|1,0,0]=3 1019 B10R2.19 CC12CCC(C1)CC2N MCULE-5335840100 [0,0,0,1,1,0|1,0,0]=3 1020 B10R2.19 CC12CCC(C1)CC2N MCULE-8981820625 [0,0,0,1,1,0|1,0,0]=3 1021 B12R2.2482 CC1(CC2CC(C1)(CN2)C)C MCULE-9951816787 [0,0,0,1,0,1|1,0,0]=3 1022 B12R2.2482 [C@@H]12CC(C[C@@](C1)(CN2)C)(C)C MCULE-5302137686 [0,0,0,1,0,1|1,0,0]=3 1023 B12R2.3021 CC1(CC(=O)C2OC2(C1)C)C MCULE-3463994724 [0,0,0,1,0,1|0,0,2]=4 1024 B12R2.766 C12CC(C1(C)C)C(C=C2C)O MCULE-2216758301 [0,1,0,1,0,0|0,0,2]=4 1025 B12R2.766 CC1=C[C@@H](C2CC1C2(C)C)O MCULE-2432339510 [0,1,0,1,0,0|0,0,2]=4 1026 B12R2.766 [C@@H]12C[C@@H](C1(C)C)[C@H](C=C2C)O MCULE-2551341762 [0,1,0,1,0,0|0,0,2]=4 1027 B12R2.766 [C@@H]12C[C@@H](C1(C)C)[C@H](C=C2C)O MCULE-7918435177 [0,1,0,1,0,0|0,0,2]=4 1028 B12R2.5368 O[C@H]1[C@@H](C[C@H]2CC[C@@]1(N2)O)O MCULE-2297428712 [0,1,0,1,0,0|2,0,0]=4 1029 B12R2.5368 O[C@H]1[C@@H](C[C@H]2CC[C@@]1(N2)O)O MCULE-8400569528 [0,1,0,1,0,0|2,0,0]=4 1030 B12R2.2840 O[C@H]1C[C@@]2(CC[C@@H](N2)[C@@H]1O)O MCULE-6556832593 [0,1,0,1,0,0|2,0,0]=4 1031 B12R3.584 NC12CC3CC(C1)CC2C3 MCULE-4047743905 [0,0,0,2,0,0|2,0,0]=4 1032 B12R3.584 NC12CC3CC(C1)CC2C3 MCULE-9977053672 [0,0,0,2,0,0|2,0,0]=4 1033 B12R3.584 [C@@H]12C[C@H]3C[C@@H](C1)C[C@]3(C2)N MCULE-2011309258 [0,0,0,2,0,0|2,0,0]=4 1034 B12R3.584 [C@@H]12C[C@H]3C[C@@H](C1)C[C@]3(C2)N MCULE-8411699479 [0,0,0,2,0,0|2,0,0]=4 1035 B12R3.988 OC12CCC3C1CC(C3)C2 MCULE-3170759845 [0,0,0,2,0,0|2,0,0]=4 1036 B12R3.1631 C1CC2CC3(CC3)CC1N2 MCULE-1714137917 [0,0,0,2,0,0|2,0,0]=4 1037 B12R3.1631 C1CC2CC3(CC3)CC1N2 MCULE-3954024433 [0,0,0,2,0,0|2,0,0]=4 1038 B8R0.14 C#CCC(O)C(C)(C)C MCULE-9989503890 [0,0,1,0,1,0|0,0,2]=4 1039 B8R0.14 CC(C)(C)C(N)CCO MCULE-1010726098 [0,0,1,0,1,0|1,0,0]=3 1040 B8R0.14 CC(C)(C)C(O)CCN MCULE-9149724547 [0,0,1,0,1,0|1,0,0]=3 1041 B8R0.14 CC(C)(C)C(O)CON MCULE-4687686608 [0,0,1,0,1,0|2,0,0]=4 1042 B8R0.14 CC(C)(O)[C@H](F)CCO MCULE-9185535119 [0,0,1,0,1,0|2,0,0]=4 1043 B8R0.14 CC(CCO)C(C)(C)O MCULE-9511812518 [0,0,1,0,1,0|1,0,0]=3 1044 B8R0.14 CCCC(=O)C(C)(C)C MCULE-9363300648 [0,0,1,0,1,0|0,0,2]=4 1045 B8R0.14 CCCC(C)C(C)(C)O MCULE-2569743231 [0,0,1,0,1,0|2,0,0]=4 1046 B8R0.14 CCCC(N)C(C)(C)C MCULE-1269755653 [0,0,1,0,1,0|1,0,0]=3 1047 B8R0.14 CCCC(N)C(C)(C)C MCULE-9780401895 [0,0,1,0,1,0|1,0,0]=3 1048 B8R0.14 CCCC(O)C(C)(C)C MCULE-6144967724 [0,0,1,0,1,0|0,0,0]=2 1049 B8R0.14 CNCC(C)C(C)(C)C MCULE-1738006503 [0,0,1,0,1,0|2,0,0]=4 1050 B8R0.14 CNCC(C)C(C)(C)C MCULE-2651685480 [0,0,1,0,1,0|2,0,0]=4 1051 B8R0.14 COCC(O)C(C)(C)C MCULE-2227683316 [0,0,1,0,1,0|1,0,0]=3 1052 B8R0.23 CC(=O)C(C)CC(C)C MCULE-9956513410 [0,0,1,0,1,0|0,0,2]=4 1053 B8R0.23 CC(C)C(C)CC(=O)O MCULE-8256978568 [0,0,1,0,1,0|1,0,1]=4 1054 B8R0.23 CC(C)C(N)CN(C)C MCULE-5094855086 [0,0,1,0,1,0|2,0,0]=4 1055 B8R0.23 CC(C)C(N)CN(C)C MCULE-5820692384 [0,0,1,0,1,0|2,0,0]=4 1056 B8R0.23 CC(C)C(O)CN(C)C MCULE-1527218492 [0,0,1,0,1,0|1,0,0]=3 1057 B8R0.23 CC(C)CC(=O)C(C)C MCULE-4667603330 [0,0,1,0,1,0|0,0,2]=4 1058 B8R0.23 CC(C)CC(C)C(=O)O MCULE-7217536279 [0,0,1,0,1,0|1,0,1]=4 1059 B8R0.23 CC(C)CC(O)C(C)C MCULE-6929077589 [0,0,1,0,1,0|0,0,0]=2 1060 B8R0.23 CC(C)CC(O)C(C)N MCULE-5726380235 [0,0,1,0,1,0|1,0,0]=3 1061 B8R0.23 CC(C)N(C)C[C@@H](C)N MCULE-2033239407 [0,0,1,0,1,0|2,0,0]=4 1062 B8R0.23 CC(C)N(C)C[C@H](C)N MCULE-7891789784 [0,0,1,0,1,0|2,0,0]=4 1063 B8R0.23 CC(C)[C@H](N)CN(C)C MCULE-3125045887 [0,0,1,0,1,0|2,0,0]=4 1064 B8R0.23 CC(C)[C@H](N)CN(C)C MCULE-4682777510 [0,0,1,0,1,0|2,0,0]=4 1065 B8R0.23 CC(C)[C@H](N)CN(C)C MCULE-5992134032 [0,0,1,0,1,0|2,0,0]=4 1066 B8R0.23 CC(C)[C@H](N)CN(C)C MCULE-8803088259 [0,0,1,0,1,0|2,0,0]=4 1067 B8R0.23 CC(O)CC(O)C(C)C MCULE-5906290473 [0,0,1,0,1,0|1,0,0]=3 1068 B8R0.12 CCCC(C)(C)C(=O)C MCULE-3472590451 [0,0,1,0,1,0|0,0,2]=4 1069 B8R0.12 CCCC(C)(C)C(=O)O MCULE-7950118630 [0,0,1,0,1,0|1,0,1]=4 1070 B8R1.18 CC1CC(C(O1)C)N MCULE-3274169856 [1,0,0,0,1,0|2,0,0]=4 1071 B8R1.18 CC1CC(C(O1)C)N MCULE-9455862703 [1,0,0,0,1,0|2,0,0]=4 1072 B8R1.18 CC1CC(C(O1)C)S MCULE-4786793091 [1,0,0,0,1,0|1,1,0]=4 1073 B8R1.18 CC1CN(CC1N)C MCULE-4537736727 [1,0,0,0,1,0|2,0,0]=4 1074 B8R1.18 CN1CC(C(C1)O)N MCULE-2599335817 [1,0,0,0,1,0|2,0,0]=4 1075 B8R1.18 CN1CC(C(C1)O)N MCULE-6847369546 [1,0,0,0,1,0|2,0,0]=4 1076 B8R1.18 CN1C[C@@H]([C@@H](C1)O)F MCULE-1004495465 [1,0,0,0,1,0|2,0,0]=4 1077 B8R1.18 CN1C[C@@H]([C@@H](C1)O)N MCULE-2486938322 [1,0,0,0,1,0|2,0,0]=4 1078 B8R1.18 CN1C[C@@H]([C@@H](C1)O)N MCULE-5836595032 [1,0,0,0,1,0|2,0,0]=4 1079 B8R1.18 CN1C[C@@H]([C@@H](C1)O)N MCULE-6830124811 [1,0,0,0,1,0|2,0,0]=4 1080 B8R1.18 CN1C[C@@H]([C@@H](C1)O)N MCULE-9514040195 [1,0,0,0,1,0|2,0,0]=4 1081 B8R1.18 CN1C[C@H]([C@@H](C1)O)N MCULE-3812148649 [1,0,0,0,1,0|2,0,0]=4 1082 B8R1.18 CN1C[C@H]([C@@H](C1)O)N MCULE-5853867679 [1,0,0,0,1,0|2,0,0]=4 1083 B8R1.18 CN1C[C@H]([C@@H](C1)O)N MCULE-7840416361 [1,0,0,0,1,0|2,0,0]=4 1084 B8R1.18 CN1C[C@H]([C@@H](C1)O)N MCULE-8395934464 [1,0,0,0,1,0|2,0,0]=4 1085 B8R1.18 NC1CC(C(C1)O)O MCULE-4578427017 [1,0,0,0,1,0|2,0,0]=4 1086 B8R1.18 NC1CC(C(C1)O)O MCULE-5175955370 [1,0,0,0,1,0|2,0,0]=4 1087 B8R1.18 NC1C[C@@H]([C@@H](C1)O)O MCULE-6906947518 [1,0,0,0,1,0|2,0,0]=4 1088 B8R1.18 NC1C[C@@H]([C@@H](C1)O)O MCULE-9885099468 [1,0,0,0,1,0|2,0,0]=4 1089 B8R1.18 N[C@@H]1C[C@@H]([C@@H](C1)O)O MCULE-1413629464 [1,0,0,0,1,0|2,0,0]=4 1090 B8R1.18 N[C@@H]1C[C@@H]([C@@H](C1)O)O MCULE-2282806557 [1,0,0,0,1,0|2,0,0]=4 1091 B8R1.18 N[C@H]1C[C@@H]([C@@H](C1)O)O MCULE-1533256813 [1,0,0,0,1,0|2,0,0]=4 1092 B8R1.18 N[C@H]1C[C@@H]([C@@H](C1)O)O MCULE-8968529452 [1,0,0,0,1,0|2,0,0]=4 1093 B8R1.19 CC1(CCCC1=O)C MCULE-2010694408 [1,0,0,0,1,0|0,0,2]=4 1094 B8R1.19 CC1(CCCC1Br)C MCULE-7575471396 [1,0,0,0,1,0|1,0,0]=3 1095 B8R1.19 CC1(CCCC1N)C MCULE-5921379560 [1,0,0,0,1,0|1,0,0]=3 1096 B8R1.19 CC1(CCCC1N)C MCULE-8867080038 [1,0,0,0,1,0|1,0,0]=3 1097 B8R1.19 CC1(CCCC1N)O MCULE-3396541731 [1,0,0,0,1,0|2,0,0]=4 1098 B8R1.19 CC1(CCCC1O)C MCULE-4878410443 [1,0,0,0,1,0|0,0,0]=2 1099 B8R1.19 CC1(CCCC1O)O MCULE-7509860049 [1,0,0,0,1,0|1,0,0]=3 1100 B8R1.19 CC1(CCC[C@@H]1N)C MCULE-2097025606 [1,0,0,0,1,0|1,0,0]=3 1101 B8R1.19 CC1(CCC[C@@H]1O)C MCULE-9402548740 [1,0,0,0,1,0|0,0,0]=2 1102 B8R1.19 CC1(CCC[C@H]1O)C MCULE-3856604720 [1,0,0,0,1,0|0,0,0]=2 1103 B8R1.19 CC1(CNCC1O)C MCULE-5213763198 [1,0,0,0,1,0|1,0,0]=3 1104 B8R1.19 CC1(CNCC1O)C MCULE-8373976987 [1,0,0,0,1,0|1,0,0]=3 1105 B8R1.19 CC1(CNC[C@@H]1O)C MCULE-4990738145 [1,0,0,0,1,0|1,0,0]=3 1106 B8R1.19 CC1(CNC[C@@H]1O)C MCULE-7313671873 [1,0,0,0,1,0|1,0,0]=3 1107 B8R1.19 CC1(CNC[C@@H]1O)C MCULE-9230991736 [1,0,0,0,1,0|1,0,0]=3 1108 B8R1.19 CC1(CNC[C@@H]1O)C MCULE-9959039343 [1,0,0,0,1,0|1,0,0]=3 1109 B8R1.19 CC1(CNC[C@H]1O)C MCULE-6924557368 [1,0,0,0,1,0|1,0,0]=3 1110 B8R1.19 CC1(COCC1N)C MCULE-7968039000 [1,0,0,0,1,0|2,0,0]=4 1111 B8R1.19 CC1(COCC1N)C MCULE-8618492637 [1,0,0,0,1,0|2,0,0]=4 1112 B8R1.19 CC1(NCCC1O)C MCULE-6224623963 [1,0,0,0,1,0|1,0,0]=3 1113 B8R1.19 CC1(NCCC1O)C MCULE-9850641476 [1,0,0,0,1,0|1,0,0]=3 1114 B8R1.19 CC1(OCCC1N)C MCULE-6592845715 [1,0,0,0,1,0|2,0,0]=4 1115 B8R1.19 CC1(OCCC1N)C MCULE-6909756281 [1,0,0,0,1,0|2,0,0]=4 1116 B8R1.19 CC1CCNC1(C)C MCULE-5566663812 [1,0,0,0,1,0|1,0,0]=3 1117 B8R1.19 CC1COCC1(C)O MCULE-8635665597 [1,0,0,0,1,0|2,0,0]=4 1118 B8R1.19 CC1NCCC1(C)C MCULE-1624409407 [1,0,0,0,1,0|1,0,0]=3 1119 B8R1.19 CC1NCCC1(C)C MCULE-5796908595 [1,0,0,0,1,0|1,0,0]=3 1120 B8R1.19 CC1OCCC1(C)N MCULE-3604874294 [1,0,0,0,1,0|2,0,0]=4 1121 B8R1.19 C[C@@H]1COC[C@]1(C)O MCULE-2882517612 [1,0,0,0,1,0|2,0,0]=4 1122 B8R1.19 C[C@@]1(CCC[C@@H]1N)O MCULE-4508286005 [1,0,0,0,1,0|2,0,0]=4 1123 B8R1.19 C[C@@]1(CCC[C@@H]1N)O MCULE-9668737274 [1,0,0,0,1,0|2,0,0]=4 1124 B8R1.19 C[C@@]1(CCC[C@H]1N)O MCULE-2369187970 [1,0,0,0,1,0|2,0,0]=4 1125 B8R1.19 C[C@H]1COC[C@@]1(C)O MCULE-6225656472 [1,0,0,0,1,0|2,0,0]=4 1126 B8R1.19 C[C@]1(CCC[C@@H]1N)O MCULE-2644040109 [1,0,0,0,1,0|2,0,0]=4 1127 B8R1.19 C[C@]1(CCC[C@H]1N)O MCULE-2446086306 [1,0,0,0,1,0|2,0,0]=4 1128 B8R1.19 C[C@]1(CCC[C@H]1N)O MCULE-8959851594 [1,0,0,0,1,0|2,0,0]=4 1129 B8R1.19 C[C@]1(CCC[C@H]1N)O MCULE-9937788175 [1,0,0,0,1,0|2,0,0]=4 1130 B8R1.19 OC1CCCC1(F)F MCULE-8959457751 [1,0,0,0,1,0|2,0,0]=4 1131 B8R1.19 [C@@H]1(COC[C@@]1(C)O)C MCULE-5554336121 [1,0,0,0,1,0|2,0,0]=4 1132 B8R1.51 CC1(CC(CN1)O)C MCULE-5350721787 [1,0,0,0,1,0|1,0,0]=3 1133 B8R1.51 CC1(CC(CO1)Br)C MCULE-6264816299 [1,0,0,0,1,0|2,0,0]=4 1134 B8R1.51 CC1(CC(CO1)N)C MCULE-7633375889 [1,0,0,0,1,0|2,0,0]=4 1135 B8R1.51 CC1(CC(CO1)N)C MCULE-7644576148 [1,0,0,0,1,0|2,0,0]=4 1136 B8R1.51 CC1(CC(CO1)O)C MCULE-6020499551 [1,0,0,0,1,0|1,0,0]=3 1137 B8R1.51 CC1(CC(CO1)S)C MCULE-1857889655 [1,0,0,0,1,0|1,1,0]=4 1138 B8R1.51 CC1(CCC(=O)C1)C MCULE-9814375082 [1,0,0,0,1,0|0,0,2]=4 1139 B8R1.51 CC1(CCC(C1)Br)C MCULE-7648461165 [1,0,0,0,1,0|1,0,0]=3 1140 B8R1.51 CC1(CCC(C1)N)C MCULE-1462634969 [1,0,0,0,1,0|1,0,0]=3 1141 B8R1.51 CC1(CCC(C1)N)C MCULE-7718074169 [1,0,0,0,1,0|1,0,0]=3 1142 B8R1.51 CC1(CCC(C1)N)O MCULE-2662110764 [1,0,0,0,1,0|2,0,0]=4 1143 B8R1.51 CC1(CCC(C1)N)O MCULE-8421528641 [1,0,0,0,1,0|2,0,0]=4 1144 B8R1.51 CC1(CCC(C1)O)N MCULE-1629381772 [1,0,0,0,1,0|1,0,0]=3 1145 B8R1.51 CC1(CCC(O1)O)C MCULE-7092868347 [1,0,0,0,1,0|1,0,0]=3 1146 B8R1.51 CC1(C[C@@H](CN1)O)C MCULE-2169130789 [1,0,0,0,1,0|1,0,0]=3 1147 B8R1.51 CC1(C[C@@H](CN1)O)C MCULE-9189212857 [1,0,0,0,1,0|1,0,0]=3 1148 B8R1.51 CC1CC(CN1)(C)C MCULE-1832572865 [1,0,0,0,1,0|1,0,0]=3 1149 B8R1.51 CC1CC(CN1)(C)C MCULE-4709005728 [1,0,0,0,1,0|1,0,0]=3 1150 B8R1.51 CC1CCC(C1)(C)O MCULE-5369529521 [1,0,0,0,1,0|1,0,0]=3 1151 B8R1.51 CC1CCC(N1)(C)C MCULE-3065789797 [1,0,0,0,1,0|1,0,0]=3 1152 B8R1.51 CC1CCC(N1)(C)C MCULE-6175622918 [1,0,0,0,1,0|1,0,0]=3 1153 B8R1.51 CC1CNC(C1)(C)C MCULE-4348406431 [1,0,0,0,1,0|1,0,0]=3 1154 B8R1.51 CC1CNC(C1)(C)C MCULE-8355103454 [1,0,0,0,1,0|1,0,0]=3 1155 B8R1.51 CC1COC(O1)(C)C MCULE-2118300632 [1,0,0,0,1,0|2,0,0]=4 1156 B8R1.51 CN1CCC(C1)(C)C MCULE-4501256940 [1,0,0,0,1,0|1,0,0]=3 1157 B8R1.51 CN1CCC(C1)(C)N MCULE-2137989070 [1,0,0,0,1,0|2,0,0]=4 1158 B8R1.51 CN1CCC(C1)(C)N MCULE-6642743142 [1,0,0,0,1,0|2,0,0]=4 1159 B8R1.51 C[C@@H]1CNC(C1)(C)C MCULE-2335301488 [1,0,0,0,1,0|1,0,0]=3 1160 B8R1.51 C[C@@H]1CNC(C1)(C)C MCULE-9812800093 [1,0,0,0,1,0|1,0,0]=3 1161 B8R1.51 C[C@]1(CC[C@@H](C1)N)O MCULE-4320731186 [1,0,0,0,1,0|2,0,0]=4 1162 B8R1.51 OC1CCC(C1)(F)F MCULE-1999450750 [1,0,0,0,1,0|2,0,0]=4 1163 B8R1.51 O[C@@H]1CCC(C1)(F)F MCULE-1706759710 [1,0,0,0,1,0|2,0,0]=4 1164 B8R1.51 O[C@H]1CCC(C1)(F)F MCULE-5850589839 [1,0,0,0,1,0|2,0,0]=4 1165 B8R1.51 O[C@H]1CCC(C1)(F)F MCULE-8927166685 [1,0,0,0,1,0|2,0,0]=4 1166 B8R1.24 CC1(C(CC1O)N)C MCULE-3161047738 [0,0,0,0,2,0|1,0,0]=3 1167 B8R1.24 CC1(C(CC1O)N)C MCULE-5651766781 [0,0,0,0,2,0|1,0,0]=3 1168 B8R1.24 CC1(C(CC1O)N)C MCULE-9975822471 [0,0,0,0,2,0|1,0,0]=3 1169 B8R1.24 CC1(C(CC1O)O)C MCULE-3292857168 [0,0,0,0,2,0|1,0,0]=3 1170 B8R1.24 CC1([C@@H](C[C@H]1O)N)C MCULE-3812300250 [0,0,0,0,2,0|1,0,0]=3 1171 B8R1.24 CC1([C@@H](C[C@H]1O)N)C MCULE-6109886528 [0,0,0,0,2,0|1,0,0]=3 1172 B8R1.24 CC1([C@@H](C[C@H]1O)N)C MCULE-6902780155 [0,0,0,0,2,0|1,0,0]=3 1173 B8R1.24 CC1([C@@H](C[C@H]1O)N)C MCULE-6997330478 [0,0,0,0,2,0|1,0,0]=3 1174 B8R1.24 CC1([C@H](C[C@H]1O)N)C MCULE-2114786882 [0,0,0,0,2,0|1,0,0]=3 1175 B8R1.24 CC1([C@H](C[C@H]1O)N)C MCULE-3752992263 [0,0,0,0,2,0|1,0,0]=3 1176 B8R1.24 CC1([C@H](C[C@H]1O)N)C MCULE-3787222612 [0,0,0,0,2,0|1,0,0]=3 1177 B8R1.24 CC1([C@H](C[C@H]1O)N)C MCULE-9529552439 [0,0,0,0,2,0|1,0,0]=3 1178 B8R1.24 [C@@H]1(C[C@H](C1(C)C)O)N MCULE-7200828513 [0,0,0,0,2,0|1,0,0]=3 1179 B8R1.24 [C@@H]1(C[C@H](C1(C)C)O)N MCULE-7549650861 [0,0,0,0,2,0|1,0,0]=3 1180 B10R0.96 CC(C)CCC(C)CC(=O)O MCULE-4888752092 [0,0,1,0,0,1|1,0,1]=4 1181 B10R0.96 CC(C)CNC(=O)CC(C)C MCULE-8271308344 [0,0,1,0,0,1|0,0,2]=4 1182 B10R0.96 CC(C)COC(=O)CC(C)C MCULE-9319345409 [0,0,1,0,0,1|0,0,2]=4 1183 B10R0.105 C=CCC(C)(C)CCC(C)C MCULE-3981799266 [0,0,1,0,0,1|1,0,1]=4 1184 B10R0.105 CCCC(C)(O)CCC(C)C MCULE-5117972964 [0,0,1,0,0,1|2,0,0]=4 1185 B10R1.302 CC1(CCCC(=O)CC1)C MCULE-5213760827 [1,0,0,0,0,1|0,0,2]=4 1186 B10R1.302 CC1(CCCC(CC1)N)C MCULE-8571447767 [1,0,0,0,0,1|1,0,0]=3 1187 B10R1.63 C1(CC(CNC1(C)C)C)O MCULE-9217963079 [0,0,0,0,1,1|0,0,0]=2 1188 B10R1.63 CC1CNC(C(=O)C1)(C)C MCULE-2397685634 [0,0,0,0,1,1|0,0,2]=4 1189 B10R1.63 CC1CNC(C(=O)C1)(C)C MCULE-9506573303 [0,0,0,0,1,1|0,0,2]=4 1190 B10R1.63 CC1CNC(C(C1)O)(C)C MCULE-5016891251 [0,0,0,0,1,1|0,0,0]=2