0 B9R1.132 OCC1NCC(C1O)O MCULE-7093172739 [0,0,0,0,0,0|0,0,0]=0 1 B9R1.132 OCC1NCC(C1O)O MCULE-9377849443 [0,0,0,0,0,0|0,0,0]=0 2 B9R1.132 OCC1OCC(C1O)O MCULE-6035918255 [0,0,0,0,0,0|1,0,0]=1 3 B9R1.132 OC[C@@H]1OC[C@H]([C@H]1O)O MCULE-5977248366 [0,0,0,0,0,0|1,0,0]=1 4 B9R1.132 OC[C@H]1NC[C@@H]([C@@H]1O)O MCULE-1707860323 [0,0,0,0,0,0|0,0,0]=0 5 B9R1.132 OC[C@H]1NC[C@@H]([C@@H]1O)O MCULE-3279393618 [0,0,0,0,0,0|0,0,0]=0 6 B9R1.132 OC[C@H]1NC[C@@H]([C@@H]1O)O MCULE-8001939489 [0,0,0,0,0,0|0,0,0]=0 7 B9R1.132 OC[C@H]1NC[C@@H]([C@@H]1O)O MCULE-9735967120 [0,0,0,0,0,0|0,0,0]=0 8 B9R1.132 OC[C@H]1NC[C@H]([C@@H]1O)O MCULE-2264267716 [0,0,0,0,0,0|0,0,0]=0 9 B9R1.132 OC[C@H]1NC[C@H]([C@@H]1O)O MCULE-3690741497 [0,0,0,0,0,0|0,0,0]=0 10 B9R1.132 OC[C@H]1NC[C@H]([C@H]1O)O MCULE-1695946114 [0,0,0,0,0,0|0,0,0]=0 11 B9R1.132 OC[C@H]1NC[C@H]([C@H]1O)O MCULE-4767198765 [0,0,0,0,0,0|0,0,0]=0 12 B9R1.132 OC[C@H]1NC[C@H]([C@H]1O)O MCULE-7740799111 [0,0,0,0,0,0|0,0,0]=0 13 B9R1.132 OC[C@H]1NC[C@H]([C@H]1O)O MCULE-9816210484 [0,0,0,0,0,0|0,0,0]=0 14 B9R1.132 OC[C@H]1OC[C@@H]([C@@H]1O)O MCULE-2426542638 [0,0,0,0,0,0|1,0,0]=1 15 B9R1.132 OC[C@H]1OC[C@@H]([C@H]1O)O MCULE-2697830391 [0,0,0,0,0,0|1,0,0]=1 16 B9R1.132 OC[C@H]1OC[C@@H]([C@H]1O)O MCULE-3664631398 [0,0,0,0,0,0|1,0,0]=1 17 B9R1.132 OC[C@H]1SC[C@@H]([C@@H]1O)O MCULE-5460809648 [0,0,0,0,0,0|1,0,0]=1 18 B8R1.1 C1(CCN(C1)C)CO MCULE-8028593286 [1,0,0,0,0,0|3,0,0]=4 19 B8R1.1 C=C1CN[C@@H](C1)CO MCULE-2356105510 [1,0,0,0,0,0|1,0,1]=3 20 B8R1.1 C=C1CN[C@@H](C1)CO MCULE-8856338816 [1,0,0,0,0,0|1,0,1]=3 21 B8R1.1 CC1CC(CN1)CO MCULE-3385267892 [1,0,0,0,0,0|3,0,0]=4 22 B8R1.1 CC1CC(CN1)CO MCULE-5508438719 [1,0,0,0,0,0|3,0,0]=4 23 B8R1.1 CC1CCC(C1)CN MCULE-9731521461 [1,0,0,0,0,0|3,0,0]=4 24 B8R1.1 CC1CCC(C1)CO MCULE-3130047677 [1,0,0,0,0,0|2,0,0]=3 25 B8R1.1 CC1CCC(N1)CO MCULE-7935473441 [1,0,0,0,0,0|3,0,0]=4 26 B8R1.1 CC1CCC(N1)CO MCULE-8743496847 [1,0,0,0,0,0|3,0,0]=4 27 B8R1.1 CC1CCC(O1)CO MCULE-1587985152 [1,0,0,0,0,0|3,0,0]=4 28 B8R1.1 CC1CNC(C1)CF MCULE-6699916370 [1,0,0,0,0,0|2,0,0]=3 29 B8R1.1 CC1CNC(C1)CF MCULE-9019063440 [1,0,0,0,0,0|2,0,0]=3 30 B8R1.1 CC1CNC(C1)CO MCULE-2461186712 [1,0,0,0,0,0|1,0,0]=2 31 B8R1.1 CC1CNC(C1)CO MCULE-5209280647 [1,0,0,0,0,0|1,0,0]=2 32 B8R1.1 CC1COC(C1)CO MCULE-4511313299 [1,0,0,0,0,0|2,0,0]=3 33 B8R1.1 CCC1CC(CN1)C MCULE-1050977557 [1,0,0,0,0,0|2,0,0]=3 34 B8R1.1 CCN1CCC(C1)O MCULE-5692205926 [1,0,0,0,0,0|3,0,0]=4 35 B8R1.1 CN1CCC(C1)CO MCULE-8101582241 [1,0,0,0,0,0|3,0,0]=4 36 B8R1.1 CN1CC[C@@H](C1)CO MCULE-3904654758 [1,0,0,0,0,0|3,0,0]=4 37 B8R1.1 CN1CC[C@@H](C1)CO MCULE-5091184467 [1,0,0,0,0,0|3,0,0]=4 38 B8R1.1 CN1CC[C@H](C1)CO MCULE-7548866217 [1,0,0,0,0,0|3,0,0]=4 39 B8R1.1 CN1CC[C@H](C1)CO MCULE-9206143876 [1,0,0,0,0,0|3,0,0]=4 40 B8R1.1 CNC1CCC(C1)O MCULE-1177292585 [1,0,0,0,0,0|3,0,0]=4 41 B8R1.1 CNC1CCC(C1)O MCULE-5259471149 [1,0,0,0,0,0|3,0,0]=4 42 B8R1.1 CN[C@@H]1CC[C@@H](C1)O MCULE-3921744037 [1,0,0,0,0,0|3,0,0]=4 43 B8R1.1 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C[C@H]1CC[C@H](O1)CO MCULE-2585928492 [1,0,0,0,0,0|3,0,0]=4 58 B8R1.1 C[C@H]1CC[C@H](O1)CO MCULE-3715649264 [1,0,0,0,0,0|3,0,0]=4 59 B8R1.1 C[C@H]1CN[C@@H](C1)CO MCULE-3784655204 [1,0,0,0,0,0|1,0,0]=2 60 B8R1.1 C[C@H]1CN[C@@H](C1)CO MCULE-3927798393 [1,0,0,0,0,0|1,0,0]=2 61 B8R1.1 C[C@H]1C[C@@H](CN1)CO MCULE-4062182666 [1,0,0,0,0,0|3,0,0]=4 62 B8R1.1 C[C@H]1C[C@@H](CN1)CO MCULE-6218632921 [1,0,0,0,0,0|3,0,0]=4 63 B8R1.1 FCC1CC(CN1)F MCULE-2675667218 [1,0,0,0,0,0|2,0,0]=3 64 B8R1.1 FCC1CC(CN1)F MCULE-9263946341 [1,0,0,0,0,0|2,0,0]=3 65 B8R1.1 FC[C@@H]1C[C@@H](CN1)F MCULE-6952912871 [1,0,0,0,0,0|2,0,0]=3 66 B8R1.1 FC[C@@H]1C[C@@H](CN1)F MCULE-9220587585 [1,0,0,0,0,0|2,0,0]=3 67 B8R1.1 FC[C@H]1C[C@H](CN1)F MCULE-1208494188 [1,0,0,0,0,0|2,0,0]=3 68 B8R1.1 FC[C@H]1C[C@H](CN1)F MCULE-2034962585 [1,0,0,0,0,0|2,0,0]=3 69 B8R1.1 N#CC1CC(CN1)F MCULE-2122766646 [1,0,0,0,0,0|2,0,1]=4 70 B8R1.1 N#CC1CC(CN1)F MCULE-2876487698 [1,0,0,0,0,0|2,0,1]=4 71 B8R1.1 N#CC1CCC(C1)O MCULE-5905406850 [1,0,0,0,0,0|2,0,1]=4 72 B8R1.1 N#C[C@@H]1CC[C@@H](C1)O MCULE-8121411873 [1,0,0,0,0,0|2,0,1]=4 73 B8R1.1 N#C[C@@H]1CC[C@H](C1)O MCULE-3581437653 [1,0,0,0,0,0|2,0,1]=4 74 B8R1.1 N#C[C@@H]1CC[C@H](C1)O MCULE-5514135227 [1,0,0,0,0,0|2,0,1]=4 75 B8R1.1 N#C[C@@H]1C[C@@H](CN1)F MCULE-1585643522 [1,0,0,0,0,0|2,0,1]=4 76 B8R1.1 N#C[C@@H]1C[C@@H](CN1)F MCULE-1793285797 [1,0,0,0,0,0|2,0,1]=4 77 B8R1.1 N#C[C@@H]1C[C@@H](CN1)F MCULE-3644076831 [1,0,0,0,0,0|2,0,1]=4 78 B8R1.1 N#C[C@@H]1C[C@@H](CN1)F MCULE-3832555558 [1,0,0,0,0,0|2,0,1]=4 79 B8R1.1 N#C[C@@H]1C[C@@H](CN1)F MCULE-6569939407 [1,0,0,0,0,0|2,0,1]=4 80 B8R1.1 N#C[C@@H]1C[C@@H](CN1)F MCULE-9967603029 [1,0,0,0,0,0|2,0,1]=4 81 B8R1.1 N#C[C@H]1CC[C@H](C1)O MCULE-5018154932 [1,0,0,0,0,0|2,0,1]=4 82 B8R1.1 N#C[C@H]1CC[C@H](C1)O MCULE-9804475995 [1,0,0,0,0,0|2,0,1]=4 83 B8R1.1 N#C[C@H]1C[C@@H](CN1)F MCULE-1819506724 [1,0,0,0,0,0|2,0,1]=4 84 B8R1.1 N#C[C@H]1C[C@@H](CN1)F MCULE-6331837178 [1,0,0,0,0,0|2,0,1]=4 85 B8R1.1 N#C[C@H]1C[C@@H](CN1)F MCULE-8016266496 [1,0,0,0,0,0|2,0,1]=4 86 B8R1.1 N#C[C@H]1C[C@@H](CN1)F MCULE-9440252626 [1,0,0,0,0,0|2,0,1]=4 87 B8R1.1 N#C[C@H]1C[C@H](CN1)F MCULE-5256715640 [1,0,0,0,0,0|2,0,1]=4 88 B8R1.1 N#C[C@H]1C[C@H](CN1)F MCULE-7513524025 [1,0,0,0,0,0|2,0,1]=4 89 B8R1.1 NC1C=CC(C1)CO MCULE-6409966211 [1,0,0,0,0,0|2,0,1]=4 90 B8R1.1 NC1C=CC(C1)CO MCULE-9217183744 [1,0,0,0,0,0|2,0,1]=4 91 B8R1.1 NCC1CCC(C1)F MCULE-2506364284 [1,0,0,0,0,0|3,0,0]=4 92 B8R1.1 NCC1CCC(C1)F MCULE-9762668275 [1,0,0,0,0,0|3,0,0]=4 93 B8R1.1 NCC1CCC(C1)O MCULE-1780130995 [1,0,0,0,0,0|2,0,0]=3 94 B8R1.1 NCC1CCC(C1)O MCULE-5002398342 [1,0,0,0,0,0|2,0,0]=3 95 B8R1.1 NCC1C[C@H](CN1)O MCULE-1428185082 [1,0,0,0,0,0|1,0,0]=2 96 B8R1.1 NC[C@@H]1CC[C@@H](C1)O MCULE-2662561877 [1,0,0,0,0,0|2,0,0]=3 97 B8R1.1 NC[C@@H]1CC[C@H](C1)F MCULE-1669600965 [1,0,0,0,0,0|3,0,0]=4 98 B8R1.1 NC[C@@H]1CC[C@H](C1)F MCULE-5430633197 [1,0,0,0,0,0|3,0,0]=4 99 B8R1.1 NC[C@@H]1CC[C@H](C1)O MCULE-9258933196 [1,0,0,0,0,0|2,0,0]=3 100 B8R1.1 NC[C@H]1CC[C@@H](C1)O MCULE-1995293557 [1,0,0,0,0,0|2,0,0]=3 101 B8R1.1 NC[C@H]1CC[C@@H](C1)O MCULE-9517253792 [1,0,0,0,0,0|2,0,0]=3 102 B8R1.1 NC[C@H]1CC[C@H](C1)O MCULE-5659749587 [1,0,0,0,0,0|2,0,0]=3 103 B8R1.1 NC[C@H]1CC[C@H](C1)O MCULE-9056303043 [1,0,0,0,0,0|2,0,0]=3 104 B8R1.1 N[C@@H]1C=C[C@@H](C1)CO MCULE-6317024482 [1,0,0,0,0,0|2,0,1]=4 105 B8R1.1 N[C@@H]1C=C[C@@H](C1)CO MCULE-7574782144 [1,0,0,0,0,0|2,0,1]=4 106 B8R1.1 N[C@@H]1C=C[C@@H](C1)CO MCULE-7925480161 [1,0,0,0,0,0|2,0,1]=4 107 B8R1.1 N[C@@H]1C=C[C@@H](C1)CO MCULE-8008829330 [1,0,0,0,0,0|2,0,1]=4 108 B8R1.1 N[C@@H]1CN[C@H](C1)CO MCULE-7916347231 [1,0,0,0,0,0|1,0,0]=2 109 B8R1.1 N[C@@H]1CN[C@H](C1)CO MCULE-8825406157 [1,0,0,0,0,0|1,0,0]=2 110 B8R1.1 N[C@H]1C=C[C@H](C1)CO MCULE-3324290612 [1,0,0,0,0,0|2,0,1]=4 111 B8R1.1 N[C@H]1C=C[C@H](C1)CO MCULE-3860506121 [1,0,0,0,0,0|2,0,1]=4 112 B8R1.1 N[C@H]1C=C[C@H](C1)CO MCULE-4118050926 [1,0,0,0,0,0|2,0,1]=4 113 B8R1.1 N[C@H]1C=C[C@H](C1)CO MCULE-4136002750 [1,0,0,0,0,0|2,0,1]=4 114 B8R1.1 N[C@H]1C=C[C@H](C1)CO MCULE-4159108338 [1,0,0,0,0,0|2,0,1]=4 115 B8R1.1 N[C@H]1CN[C@@H](C1)CO MCULE-3649010281 [1,0,0,0,0,0|1,0,0]=2 116 B8R1.1 N[C@H]1CN[C@@H](C1)CO MCULE-5102365319 [1,0,0,0,0,0|1,0,0]=2 117 B8R1.1 N[C@H]1CN[C@@H](C1)CO MCULE-8268517033 [1,0,0,0,0,0|1,0,0]=2 118 B8R1.1 O=C1CCC(C1)CO MCULE-7524267942 [1,0,0,0,0,0|1,0,2]=4 119 B8R1.1 O=C1CC[C@@H](C1)CO MCULE-2590805877 [1,0,0,0,0,0|1,0,2]=4 120 B8R1.1 O=C1CC[C@@H](C1)CO MCULE-7134607780 [1,0,0,0,0,0|1,0,2]=4 121 B8R1.1 O=C[C@@H]1CC(CN1)F MCULE-5331901113 [1,0,0,0,0,0|1,0,2]=4 122 B8R1.1 O=C[C@@H]1CC(CN1)F MCULE-6102557843 [1,0,0,0,0,0|1,0,2]=4 123 B8R1.1 OC1COC(C1)CI MCULE-9241971646 [1,0,0,0,0,0|2,0,0]=3 124 B8R1.1 OCC1CC(CN1)F MCULE-6111724005 [1,0,0,0,0,0|1,0,0]=2 125 B8R1.1 OCC1CC(CN1)F MCULE-9466287708 [1,0,0,0,0,0|1,0,0]=2 126 B8R1.1 OCC1CC(CN1)O MCULE-1017614151 [1,0,0,0,0,0|0,0,0]=1 127 B8R1.1 OCC1CC(CN1)O MCULE-5049675085 [1,0,0,0,0,0|0,0,0]=1 128 B8R1.1 OCC1CC(CO1)O MCULE-4648895678 [1,0,0,0,0,0|1,0,0]=2 129 B8R1.1 OCC1CCC(C1)F MCULE-4786923020 [1,0,0,0,0,0|2,0,0]=3 130 B8R1.1 OCC1CCC(C1)O MCULE-5225292788 [1,0,0,0,0,0|1,0,0]=2 131 B8R1.1 OC[C@@H]1CC[C@@H](C1)O MCULE-7117159358 [1,0,0,0,0,0|1,0,0]=2 132 B8R1.1 OC[C@@H]1CC[C@H](C1)F MCULE-4252726732 [1,0,0,0,0,0|2,0,0]=3 133 B8R1.1 OC[C@@H]1C[C@@H](CN1)F MCULE-2619594606 [1,0,0,0,0,0|1,0,0]=2 134 B8R1.1 OC[C@@H]1C[C@@H](CN1)F MCULE-3940168858 [1,0,0,0,0,0|1,0,0]=2 135 B8R1.1 OC[C@@H]1C[C@@H](CN1)F MCULE-6567372757 [1,0,0,0,0,0|1,0,0]=2 136 B8R1.1 OC[C@@H]1C[C@@H](CN1)O MCULE-2521610955 [1,0,0,0,0,0|0,0,0]=1 137 B8R1.1 OC[C@@H]1C[C@@H](CN1)O MCULE-3659134136 [1,0,0,0,0,0|0,0,0]=1 138 B8R1.1 OC[C@@H]1C[C@@H](CN1)O MCULE-8149895498 [1,0,0,0,0,0|0,0,0]=1 139 B8R1.1 OC[C@@H]1C[C@@H](CN1)O MCULE-9582350102 [1,0,0,0,0,0|0,0,0]=1 140 B8R1.1 OC[C@@H]1C[C@@H](CO1)O MCULE-7875239623 [1,0,0,0,0,0|1,0,0]=2 141 B8R1.1 OC[C@@H]1C[C@H](CN1)F MCULE-4754863670 [1,0,0,0,0,0|1,0,0]=2 142 B8R1.1 OC[C@@H]1C[C@H](CN1)F MCULE-4823692987 [1,0,0,0,0,0|1,0,0]=2 143 B8R1.1 OC[C@@H]1C[C@H](CN1)O MCULE-4908761192 [1,0,0,0,0,0|0,0,0]=1 144 B8R1.1 OC[C@@H]1C[C@H](CN1)O MCULE-5510339033 [1,0,0,0,0,0|0,0,0]=1 145 B8R1.1 OC[C@@H]1C[C@H](CN1)O MCULE-7612890329 [1,0,0,0,0,0|0,0,0]=1 146 B8R1.1 OC[C@@H]1C[C@H](CN1)O MCULE-8424913442 [1,0,0,0,0,0|0,0,0]=1 147 B8R1.1 OC[C@H]1CC[C@@H](C1)O MCULE-7760122854 [1,0,0,0,0,0|1,0,0]=2 148 B8R1.1 OC[C@H]1CC[C@@H](C1)O MCULE-9132554470 [1,0,0,0,0,0|1,0,0]=2 149 B8R1.1 OC[C@H]1C[C@@H](CN1)F MCULE-2106727383 [1,0,0,0,0,0|1,0,0]=2 150 B8R1.1 OC[C@H]1C[C@@H](CN1)F MCULE-3167425320 [1,0,0,0,0,0|1,0,0]=2 151 B8R1.1 OC[C@H]1C[C@@H](CN1)F MCULE-5656834651 [1,0,0,0,0,0|1,0,0]=2 152 B8R1.1 OC[C@H]1C[C@@H](CN1)F MCULE-9413584553 [1,0,0,0,0,0|1,0,0]=2 153 B8R1.1 OC[C@H]1C[C@@H](CN1)O MCULE-2855908983 [1,0,0,0,0,0|0,0,0]=1 154 B8R1.1 OC[C@H]1C[C@@H](CN1)O MCULE-5564885819 [1,0,0,0,0,0|0,0,0]=1 155 B8R1.1 OC[C@H]1C[C@@H](CN1)O MCULE-9276468823 [1,0,0,0,0,0|0,0,0]=1 156 B8R1.1 OC[C@H]1C[C@@H](CN1)O MCULE-9585503921 [1,0,0,0,0,0|0,0,0]=1 157 B8R1.1 OC[C@H]1C[C@@H](CO1)O MCULE-5801561749 [1,0,0,0,0,0|1,0,0]=2 158 B8R1.1 OC[C@H]1C[C@H](CN1)F MCULE-3583754715 [1,0,0,0,0,0|1,0,0]=2 159 B8R1.1 OC[C@H]1C[C@H](CN1)F MCULE-3654392017 [1,0,0,0,0,0|1,0,0]=2 160 B8R1.1 OC[C@H]1C[C@H](CN1)F MCULE-3959005096 [1,0,0,0,0,0|1,0,0]=2 161 B8R1.1 OC[C@H]1C[C@H](CN1)F MCULE-9542838904 [1,0,0,0,0,0|1,0,0]=2 162 B8R1.1 OC[C@H]1C[C@H](CN1)O MCULE-2099905531 [1,0,0,0,0,0|0,0,0]=1 163 B8R1.1 OC[C@H]1C[C@H](CN1)O MCULE-5693059049 [1,0,0,0,0,0|0,0,0]=1 164 B8R1.1 OC[C@H]1C[C@H](CN1)O MCULE-6004929736 [1,0,0,0,0,0|0,0,0]=1 165 B8R1.1 OC[C@H]1C[C@H](CN1)O MCULE-8607282785 [1,0,0,0,0,0|0,0,0]=1 166 B8R1.1 OC[C@H]1C[C@H](CO1)O MCULE-4197376814 [1,0,0,0,0,0|1,0,0]=2 167 B8R1.1 OC[C@H]1C[C@H](CO1)O MCULE-4573543387 [1,0,0,0,0,0|1,0,0]=2 168 B8R1.1 [C@H]1(C=C[C@@H](C1)N)CO MCULE-5721231711 [1,0,0,0,0,0|2,0,1]=4 169 B8R1.1 [C@H]1(CC[C@H](C1)CN)F MCULE-4146565646 [1,0,0,0,0,0|3,0,0]=4 170 B8R1.1 [C@H]1(CC[C@H](C1)CN)F MCULE-5300714166 [1,0,0,0,0,0|3,0,0]=4 171 B8R1.1 [C@H]1(CN[C@@H](C1)CF)F MCULE-2056395387 [1,0,0,0,0,0|2,0,0]=3 172 B8R1.1 [C@H]1(CN[C@@H](C1)CF)F MCULE-9578613289 [1,0,0,0,0,0|2,0,0]=3 173 B8R1.1 [C@H]1(CN[C@@H](C1)CO)C MCULE-1910074067 [1,0,0,0,0,0|1,0,0]=2 174 B8R1.1 [C@H]1(CN[C@@H](C1)CO)C MCULE-9340203932 [1,0,0,0,0,0|1,0,0]=2 175 B8R1.1 [C@H]1(CN[C@@H](C1)CO)F MCULE-7089143816 [1,0,0,0,0,0|1,0,0]=2 176 B8R1.1 [C@H]1(C[C@H](CN1)F)CO MCULE-2231031404 [1,0,0,0,0,0|1,0,0]=2 177 B8R1.1 [C@H]1(C[C@H](CN1)F)CO MCULE-6096542902 [1,0,0,0,0,0|1,0,0]=2 178 B8R1.1 [C@H]1(C[C@H](CN1)N)CO MCULE-6496782896 [1,0,0,0,0,0|1,0,0]=2 179 B8R1.1 [C@H]1(C[C@H](CN1)O)CO MCULE-4041584401 [1,0,0,0,0,0|0,0,0]=1 180 B8R1.1 [C@H]1(C[C@H](CN1)O)CO MCULE-9607072956 [1,0,0,0,0,0|0,0,0]=1 181 B8R1.11 C#CC1CCCC1O MCULE-6037624903 [1,0,0,0,0,0|2,0,1]=4 182 B8R1.11 C#C[C@@H]1CCC[C@H]1O MCULE-7417393541 [1,0,0,0,0,0|2,0,1]=4 183 B8R1.11 C#C[C@H]1CCC[C@@H]1O MCULE-6017503361 [1,0,0,0,0,0|2,0,1]=4 184 B8R1.11 C#C[C@H]1CCC[C@H]1O MCULE-2764710000 [1,0,0,0,0,0|2,0,1]=4 185 B8R1.11 C1(CCCN1C)CO MCULE-1790699840 [1,0,0,0,0,0|3,0,0]=4 186 B8R1.11 CC1CCCC1CN MCULE-3896736641 [1,0,0,0,0,0|3,0,0]=4 187 B8R1.11 CC1CCCC1CN MCULE-8678978716 [1,0,0,0,0,0|3,0,0]=4 188 B8R1.11 CC1CCCC1CO MCULE-9356546543 [1,0,0,0,0,0|2,0,0]=3 189 B8R1.11 CC1CCNC1CO MCULE-3727613396 [1,0,0,0,0,0|1,0,0]=2 190 B8R1.11 CC1CNCC1CO MCULE-2423357421 [1,0,0,0,0,0|3,0,0]=4 191 B8R1.11 CC1CNCC1CO MCULE-9628020162 [1,0,0,0,0,0|3,0,0]=4 192 B8R1.11 CC1COCC1CO MCULE-7218606126 [1,0,0,0,0,0|3,0,0]=4 193 B8R1.11 CC1NCCC1CO MCULE-2170675444 [1,0,0,0,0,0|3,0,0]=4 194 B8R1.11 CC1NCCC1CO MCULE-6327696584 [1,0,0,0,0,0|3,0,0]=4 195 B8R1.11 CC1OCCC1CO MCULE-4507531306 [1,0,0,0,0,0|3,0,0]=4 196 B8R1.11 CCC1CCCC1N MCULE-3368757457 [1,0,0,0,0,0|3,0,0]=4 197 B8R1.11 CCC1CNCC1O MCULE-2095082658 [1,0,0,0,0,0|3,0,0]=4 198 B8R1.11 CCC1NCCC1C MCULE-2665209322 [1,0,0,0,0,0|2,0,0]=3 199 B8R1.11 CCC1NCCC1C MCULE-2699257293 [1,0,0,0,0,0|2,0,0]=3 200 B8R1.11 CCC1NCCC1O MCULE-6141963287 [1,0,0,0,0,0|1,0,0]=2 201 B8R1.11 CCC1NCCC1O MCULE-9283391049 [1,0,0,0,0,0|1,0,0]=2 202 B8R1.11 CC[C@@H]1CCC[C@H]1N MCULE-6461151240 [1,0,0,0,0,0|3,0,0]=4 203 B8R1.11 CC[C@@H]1OCC[C@H]1N MCULE-6631183888 [1,0,0,0,0,0|3,0,0]=4 204 B8R1.11 CN1CCCC1CO MCULE-9904095173 [1,0,0,0,0,0|3,0,0]=4 205 B8R1.11 CN1CCC[C@@H]1CO MCULE-1873370971 [1,0,0,0,0,0|3,0,0]=4 206 B8R1.11 CN1CCC[C@@H]1CO MCULE-5652991406 [1,0,0,0,0,0|3,0,0]=4 207 B8R1.11 CN1CCC[C@H]1CO MCULE-4291089054 [1,0,0,0,0,0|3,0,0]=4 208 B8R1.11 CN1CCC[C@H]1CO MCULE-8245872227 [1,0,0,0,0,0|3,0,0]=4 209 B8R1.11 CNC1CCCC1O MCULE-9589316744 [1,0,0,0,0,0|3,0,0]=4 210 B8R1.11 CN[C@@H]1CCC[C@@H]1O MCULE-5540430832 [1,0,0,0,0,0|3,0,0]=4 211 B8R1.11 CN[C@@H]1CCC[C@H]1O MCULE-5681644013 [1,0,0,0,0,0|3,0,0]=4 212 B8R1.11 CN[C@H]1CCC[C@@H]1O MCULE-2896940586 [1,0,0,0,0,0|3,0,0]=4 213 B8R1.11 CN[C@H]1CCC[C@@H]1O MCULE-4568895508 [1,0,0,0,0,0|3,0,0]=4 214 B8R1.11 CN[C@H]1CCC[C@H]1O MCULE-3676766170 [1,0,0,0,0,0|3,0,0]=4 215 B8R1.11 CO[C@@H]1CCC[C@H]1O MCULE-8222306700 [1,0,0,0,0,0|3,0,0]=4 216 B8R1.11 C[C@@H]1CCN[C@@H]1CO MCULE-7458696223 [1,0,0,0,0,0|1,0,0]=2 217 B8R1.11 C[C@@H]1CCN[C@H]1CO MCULE-7407237429 [1,0,0,0,0,0|1,0,0]=2 218 B8R1.11 C[C@@H]1CNC[C@H]1CO MCULE-9810701855 [1,0,0,0,0,0|3,0,0]=4 219 B8R1.11 C[C@@H]1NCC[C@@H]1CO MCULE-3472303985 [1,0,0,0,0,0|3,0,0]=4 220 B8R1.11 C[C@@H]1NCC[C@H]1CO MCULE-2404886012 [1,0,0,0,0,0|3,0,0]=4 221 B8R1.11 C[C@@H]1NCC[C@H]1CO MCULE-3480517072 [1,0,0,0,0,0|3,0,0]=4 222 B8R1.11 C[C@@H]1NCC[C@H]1CO MCULE-5374631986 [1,0,0,0,0,0|3,0,0]=4 223 B8R1.11 C[C@@H]1OCC[C@H]1CO MCULE-2815374259 [1,0,0,0,0,0|3,0,0]=4 224 B8R1.11 C[C@H]1CCN[C@@H]1CO MCULE-9913318158 [1,0,0,0,0,0|1,0,0]=2 225 B8R1.11 C[C@H]1CCN[C@H]1CO MCULE-4322110368 [1,0,0,0,0,0|1,0,0]=2 226 B8R1.11 C[C@H]1CNC[C@@H]1CO MCULE-2024872524 [1,0,0,0,0,0|3,0,0]=4 227 B8R1.11 C[C@H]1CNC[C@@H]1CO MCULE-3327012262 [1,0,0,0,0,0|3,0,0]=4 228 B8R1.11 C[C@H]1CNC[C@@H]1CO MCULE-4174376777 [1,0,0,0,0,0|3,0,0]=4 229 B8R1.11 C[C@H]1CNC[C@@H]1CO MCULE-4680966874 [1,0,0,0,0,0|3,0,0]=4 230 B8R1.11 C[C@H]1CNC[C@@H]1CO MCULE-8985861060 [1,0,0,0,0,0|3,0,0]=4 231 B8R1.11 C[C@H]1NCC[C@@H]1CO MCULE-1622957258 [1,0,0,0,0,0|3,0,0]=4 232 B8R1.11 C[C@H]1NCC[C@H]1CO MCULE-7769712307 [1,0,0,0,0,0|3,0,0]=4 233 B8R1.11 C[C@H]1NCC[C@H]1CO MCULE-9254010133 [1,0,0,0,0,0|3,0,0]=4 234 B8R1.11 C[C@H]1OCC[C@H]1CO MCULE-8680094992 [1,0,0,0,0,0|3,0,0]=4 235 B8R1.11 N#CC1CCCC1O MCULE-8441776059 [1,0,0,0,0,0|2,0,1]=4 236 B8R1.11 N#C[C@@H]1CCC[C@H]1O MCULE-4467355190 [1,0,0,0,0,0|2,0,1]=4 237 B8R1.11 N#C[C@@H]1CCC[C@H]1O MCULE-8795058387 [1,0,0,0,0,0|2,0,1]=4 238 B8R1.11 NC1CCCC1CO MCULE-9652022908 [1,0,0,0,0,0|2,0,0]=3 239 B8R1.11 NC1COCC1CO MCULE-6651647999 [1,0,0,0,0,0|3,0,0]=4 240 B8R1.11 NCC1CCCC1F MCULE-6144218913 [1,0,0,0,0,0|3,0,0]=4 241 B8R1.11 NCC1CCCC1F MCULE-6567537087 [1,0,0,0,0,0|3,0,0]=4 242 B8R1.11 NCC1CCCC1N MCULE-8430269654 [1,0,0,0,0,0|3,0,0]=4 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MCULE-9441669251 [1,0,0,0,0,0|3,0,0]=4 258 B8R1.11 NC[C@H]1COC[C@H]1O MCULE-8711391145 [1,0,0,0,0,0|3,0,0]=4 259 B8R1.11 NC[C@H]1COC[C@H]1O MCULE-9812036421 [1,0,0,0,0,0|3,0,0]=4 260 B8R1.11 NN1CCCC1CO MCULE-1842894120 [1,0,0,0,0,0|3,0,0]=4 261 B8R1.11 NN1CCC[C@H]1CO MCULE-2058705707 [1,0,0,0,0,0|3,0,0]=4 262 B8R1.11 NNC1CCCC1O MCULE-4679888412 [1,0,0,0,0,0|3,0,0]=4 263 B8R1.11 NN[C@@H]1CCC[C@H]1O MCULE-6631597748 [1,0,0,0,0,0|3,0,0]=4 264 B8R1.11 NN[C@@H]1CCC[C@H]1O MCULE-9568290705 [1,0,0,0,0,0|3,0,0]=4 265 B8R1.11 N[C@@H]1CCC[C@H]1CO MCULE-7218353328 [1,0,0,0,0,0|2,0,0]=3 266 B8R1.11 N[C@@H]1COC[C@@H]1CO MCULE-8267820303 [1,0,0,0,0,0|3,0,0]=4 267 B8R1.11 N[C@@H]1COC[C@H]1CO MCULE-3070797384 [1,0,0,0,0,0|3,0,0]=4 268 B8R1.11 N[C@@H]1COC[C@H]1CO MCULE-4572096805 [1,0,0,0,0,0|3,0,0]=4 269 B8R1.11 N[C@H]1CCC[C@H]1CO MCULE-3793323277 [1,0,0,0,0,0|2,0,0]=3 270 B8R1.11 N[C@H]1CCC[C@H]1CO MCULE-5297422093 [1,0,0,0,0,0|2,0,0]=3 271 B8R1.11 N[C@H]1COC[C@@H]1CO MCULE-2948740480 [1,0,0,0,0,0|3,0,0]=4 272 B8R1.11 N[C@H]1COC[C@H]1CO MCULE-3409455124 [1,0,0,0,0,0|3,0,0]=4 273 B8R1.11 N[C@H]1COC[C@H]1CO MCULE-6058647833 [1,0,0,0,0,0|3,0,0]=4 274 B8R1.11 N[C@H]1COC[C@H]1CO MCULE-6847790594 [1,0,0,0,0,0|3,0,0]=4 275 B8R1.11 N[C@H]1COC[C@H]1CO MCULE-8456266436 [1,0,0,0,0,0|3,0,0]=4 276 B8R1.11 O=C1CCCC1CO MCULE-9171970685 [1,0,0,0,0,0|1,0,2]=4 277 B8R1.11 OCC1CCCC1O MCULE-7244611817 [1,0,0,0,0,0|1,0,0]=2 278 B8R1.11 OCC1CNCC1O MCULE-6800319532 [1,0,0,0,0,0|2,0,0]=3 279 B8R1.11 OCC1CNCC1O MCULE-8508401397 [1,0,0,0,0,0|2,0,0]=3 280 B8R1.11 OCC1NCCC1O MCULE-6288507636 [1,0,0,0,0,0|0,0,0]=1 281 B8R1.11 OCC1NCCC1O MCULE-6806405470 [1,0,0,0,0,0|0,0,0]=1 282 B8R1.11 OCC1OCCC1O MCULE-2601628372 [1,0,0,0,0,0|1,0,0]=2 283 B8R1.11 OC[C@@H]1CNC[C@@H]1O MCULE-4006152813 [1,0,0,0,0,0|2,0,0]=3 284 B8R1.11 OC[C@@H]1CNC[C@@H]1O MCULE-5884019743 [1,0,0,0,0,0|2,0,0]=3 285 B8R1.11 OC[C@@H]1CNC[C@H]1O MCULE-4276332736 [1,0,0,0,0,0|2,0,0]=3 286 B8R1.11 OC[C@@H]1CNC[C@H]1O MCULE-5570487527 [1,0,0,0,0,0|2,0,0]=3 287 B8R1.11 OC[C@@H]1NCC[C@@H]1O MCULE-8384230507 [1,0,0,0,0,0|0,0,0]=1 288 B8R1.11 OC[C@@H]1NCC[C@H]1O MCULE-3549294738 [1,0,0,0,0,0|0,0,0]=1 289 B8R1.11 OC[C@H]1CNC[C@@H]1O MCULE-4150422763 [1,0,0,0,0,0|2,0,0]=3 290 B8R1.11 OC[C@H]1CNC[C@@H]1O MCULE-4399626759 [1,0,0,0,0,0|2,0,0]=3 291 B8R1.11 OC[C@H]1CNC[C@H]1O MCULE-1964844966 [1,0,0,0,0,0|2,0,0]=3 292 B8R1.11 OC[C@H]1CNC[C@H]1O MCULE-2031563638 [1,0,0,0,0,0|2,0,0]=3 293 B8R1.11 OC[C@H]1CNC[C@H]1O MCULE-5072230521 [1,0,0,0,0,0|2,0,0]=3 294 B8R1.11 OC[C@H]1CNC[C@H]1O MCULE-6483520020 [1,0,0,0,0,0|2,0,0]=3 295 B8R1.11 OC[C@H]1NCC[C@@H]1O MCULE-3020492285 [1,0,0,0,0,0|0,0,0]=1 296 B8R1.11 OC[C@H]1NCC[C@@H]1O MCULE-4180813715 [1,0,0,0,0,0|0,0,0]=1 297 B8R1.11 OC[C@H]1NCC[C@@H]1O MCULE-8831128340 [1,0,0,0,0,0|0,0,0]=1 298 B8R1.11 OC[C@H]1NCC[C@@H]1O MCULE-9415023769 [1,0,0,0,0,0|0,0,0]=1 299 B8R1.11 OC[C@H]1NCC[C@H]1O MCULE-9396804561 [1,0,0,0,0,0|0,0,0]=1 300 B8R1.11 OC[C@H]1OC=C[C@@H]1O MCULE-7880756266 [1,0,0,0,0,0|1,0,2]=4 301 B8R1.11 OC[C@H]1OCC[C@@H]1O MCULE-4089527318 [1,0,0,0,0,0|1,0,0]=2 302 B8R1.11 OC[C@H]1OCC[C@@H]1O MCULE-9198335558 [1,0,0,0,0,0|1,0,0]=2 303 B8R1.11 [C@H]1(CCC[C@H]1CO)N MCULE-8523302139 [1,0,0,0,0,0|2,0,0]=3 304 B8R1.11 [C@H]1(CCN[C@@H]1C)CO MCULE-8740397030 [1,0,0,0,0,0|3,0,0]=4 305 B8R1.11 [C@H]1(CCN[C@@H]1C)CO MCULE-9648533132 [1,0,0,0,0,0|3,0,0]=4 306 B8R1.11 [C@H]1(CCO[C@@H]1C)CO MCULE-5629055834 [1,0,0,0,0,0|3,0,0]=4 307 B8R1.11 [C@H]1(COC[C@@H]1CN)O MCULE-1038770438 [1,0,0,0,0,0|3,0,0]=4 308 B8R1.11 [C@H]1(COC[C@H]1CN)O MCULE-3362382906 [1,0,0,0,0,0|3,0,0]=4 309 B8R1.11 [C@H]1(COC[C@H]1CN)O MCULE-8153203630 [1,0,0,0,0,0|3,0,0]=4 310 B8R1.50 CC1CCC(C1N)C MCULE-5534270110 [1,0,0,0,0,0|3,0,0]=4 311 B8R1.50 CC1CCC(C1N)C MCULE-9569539393 [1,0,0,0,0,0|3,0,0]=4 312 B8R1.50 CC1CCC(C1O)O MCULE-3292232581 [1,0,0,0,0,0|1,0,0]=2 313 B8R1.50 NC1CCC(C1O)O MCULE-2902511864 [1,0,0,0,0,0|2,0,0]=3 314 B8R1.50 NC1CCC(C1O)O MCULE-2997796956 [1,0,0,0,0,0|2,0,0]=3 315 B8R1.50 N[C@@H]1C(=O)NC[C@H]1O MCULE-6840872048 [1,0,0,0,0,0|1,0,2]=4 316 B8R1.50 N[C@@H]1CC[C@@H]([C@H]1O)O MCULE-4654712954 [1,0,0,0,0,0|2,0,0]=3 317 B8R1.50 N[C@@H]1CC[C@@H]([C@H]1O)O MCULE-4756579413 [1,0,0,0,0,0|2,0,0]=3 318 B8R1.50 N[C@@H]1CC[C@@H]([C@H]1O)O MCULE-5386854672 [1,0,0,0,0,0|2,0,0]=3 319 B8R1.50 N[C@@H]1CC[C@@H]([C@H]1O)O MCULE-8517121727 [1,0,0,0,0,0|2,0,0]=3 320 B8R1.50 N[C@@H]1CC[C@H]([C@@H]1O)O MCULE-1001347318 [1,0,0,0,0,0|2,0,0]=3 321 B8R1.50 N[C@@H]1CC[C@H]([C@@H]1O)O MCULE-3161518566 [1,0,0,0,0,0|2,0,0]=3 322 B8R1.50 N[C@@H]1CC[C@H]([C@@H]1O)O MCULE-8097854840 [1,0,0,0,0,0|2,0,0]=3 323 B8R1.50 N[C@@H]1CC[C@H]([C@@H]1O)O MCULE-9614047785 [1,0,0,0,0,0|2,0,0]=3 324 B8R1.50 N[C@@H]1CC[C@H]([C@H]1O)O MCULE-3397642974 [1,0,0,0,0,0|2,0,0]=3 325 B8R1.50 N[C@@H]1CC[C@H]([C@H]1O)O MCULE-5620525999 [1,0,0,0,0,0|2,0,0]=3 326 B8R1.50 N[C@@H]1CC[C@H]([C@H]1O)O MCULE-8393185418 [1,0,0,0,0,0|2,0,0]=3 327 B8R1.50 N[C@@H]1CC[C@H]([C@H]1O)O MCULE-9763920178 [1,0,0,0,0,0|2,0,0]=3 328 B8R1.50 O=C1OCC(C1O)O MCULE-9766741798 [1,0,0,0,0,0|1,0,2]=4 329 B8R1.50 O=C1OC[C@@H]([C@@H]1O)O MCULE-8629460196 [1,0,0,0,0,0|1,0,2]=4 330 B8R1.50 O=C1OC[C@@H]([C@H]1O)O MCULE-7303431003 [1,0,0,0,0,0|1,0,2]=4 331 B8R1.50 O=C1OC[C@H]([C@H]1O)O MCULE-4704805755 [1,0,0,0,0,0|1,0,2]=4 332 B8R1.50 O=C1OC[C@H]([C@H]1O)O MCULE-7070309718 [1,0,0,0,0,0|1,0,2]=4 333 B8R1.50 O=C1OC[C@H]([C@H]1O)O MCULE-7824820688 [1,0,0,0,0,0|1,0,2]=4 334 B8R1.50 OC1COC(C1O)O MCULE-2562953459 [1,0,0,0,0,0|1,0,0]=2 335 B8R1.50 OC1OC[C@@H]([C@H]1O)O MCULE-4484765937 [1,0,0,0,0,0|1,0,0]=2 336 B8R1.50 OC1OC[C@H]([C@@H]1O)O MCULE-4663451850 [1,0,0,0,0,0|1,0,0]=2 337 B10R1.34 C[C@@H]1N[C@@H]([C@H]([C@H]1O)O)CO MCULE-1757530382 [0,1,0,0,0,0|0,0,0]=1 338 B10R1.34 NC1CC(C(C1O)O)CO MCULE-4781103038 [0,1,0,0,0,0|1,0,0]=2 339 B10R1.34 NC1CC(C(C1O)O)CO MCULE-9752985058 [0,1,0,0,0,0|1,0,0]=2 340 B10R1.34 NC[C@@H]1C[C@@H]([C@H]([C@H]1O)O)O MCULE-2863382493 [0,1,0,0,0,0|2,0,0]=3 341 B10R1.34 N[C@@H]1C[C@@H]([C@H]([C@H]1O)O)CO MCULE-6136081245 [0,1,0,0,0,0|1,0,0]=2 342 B10R1.34 N[C@@H]1C[C@@H]([C@H]([C@H]1O)O)CO MCULE-6555702533 [0,1,0,0,0,0|1,0,0]=2 343 B10R1.34 N[C@@H]1C[C@@H]([C@H]([C@H]1O)O)CO MCULE-6721976300 [0,1,0,0,0,0|1,0,0]=2 344 B10R1.34 N[C@@H]1C[C@@H]([C@H]([C@H]1O)O)CO MCULE-7773344673 [0,1,0,0,0,0|1,0,0]=2 345 B10R1.34 N[C@@H]1C[C@@H]([C@H]([C@H]1O)O)CO MCULE-9054312870 [0,1,0,0,0,0|1,0,0]=2 346 B10R1.34 N[C@@H]1C[C@@H]([C@H]([C@H]1O)O)CO MCULE-9159193440 [0,1,0,0,0,0|1,0,0]=2 347 B10R1.34 N[C@H]1C[C@H]([C@@H]([C@@H]1O)O)CO MCULE-1219204107 [0,1,0,0,0,0|1,0,0]=2 348 B10R1.34 N[C@H]1C[C@H]([C@@H]([C@@H]1O)O)CO MCULE-4690664029 [0,1,0,0,0,0|1,0,0]=2 349 B10R1.34 O=C1OC(C(C1O)O)CO MCULE-4992937478 [0,1,0,0,0,0|1,0,1]=3 350 B10R1.34 O=C1O[C@@H]([C@@H]([C@@H]1O)O)CO MCULE-4238222743 [0,1,0,0,0,0|1,0,1]=3 351 B10R1.34 O=C1O[C@@H]([C@@H]([C@@H]1O)O)CO MCULE-8746085882 [0,1,0,0,0,0|1,0,1]=3 352 B10R1.34 O=C1O[C@@H]([C@@H]([C@H]1O)O)CO MCULE-1302555586 [0,1,0,0,0,0|1,0,1]=3 353 B10R1.34 O=C1O[C@@H]([C@@H]([C@H]1O)O)CO MCULE-6947519194 [0,1,0,0,0,0|1,0,1]=3 354 B10R1.34 O=C1O[C@@H]([C@H]([C@@H]1O)O)CO MCULE-3419728176 [0,1,0,0,0,0|1,0,1]=3 355 B10R1.34 O=C1O[C@@H]([C@H]([C@H]1F)O)CO MCULE-9538867890 [0,1,0,0,0,0|2,0,1]=4 356 B10R1.34 O=C1O[C@@H]([C@H]([C@H]1O)O)CO MCULE-1946078293 [0,1,0,0,0,0|1,0,1]=3 357 B10R1.34 O=C1O[C@@H]([C@H]([C@H]1O)O)CO MCULE-4119913524 [0,1,0,0,0,0|1,0,1]=3 358 B10R1.34 O=C1O[C@@H]([C@H]([C@H]1O)O)CO MCULE-7655191062 [0,1,0,0,0,0|1,0,1]=3 359 B10R1.34 O=C1O[C@H]([C@@H]([C@@H]1O)O)CO MCULE-9668504351 [0,1,0,0,0,0|1,0,1]=3 360 B10R1.34 O=C1O[C@H]([C@@H]([C@H]1O)O)CO MCULE-2196473829 [0,1,0,0,0,0|1,0,1]=3 361 B10R1.34 O=C1O[C@H]([C@@H]([C@H]1O)O)CO MCULE-2293188422 [0,1,0,0,0,0|1,0,1]=3 362 B10R1.34 O=C1O[C@H]([C@H]([C@H]1O)O)CO MCULE-7094668506 [0,1,0,0,0,0|1,0,1]=3 363 B10R1.34 O=C1O[C@H]([C@H]([C@H]1O)O)CO MCULE-8957458384 [0,1,0,0,0,0|1,0,1]=3 364 B10R1.34 OCC1OC(C(C1F)O)O MCULE-2681429625 [0,1,0,0,0,0|2,0,0]=3 365 B10R1.34 OCC1OC(C(C1O)F)O MCULE-2207660627 [0,1,0,0,0,0|2,0,0]=3 366 B10R1.34 OCC1OC(C(C1O)O)O MCULE-6940372378 [0,1,0,0,0,0|1,0,0]=2 367 B10R1.34 OC[C@H]1OC([C@@H]([C@H]1F)O)O MCULE-3142888978 [0,1,0,0,0,0|2,0,0]=3 368 B10R1.34 OC[C@H]1OC([C@H](C1O)O)O MCULE-7204456313 [0,1,0,0,0,0|1,0,0]=2 369 B10R1.34 OC[C@H]1OC([C@H]([C@@H]1O)O)O MCULE-4065300614 [0,1,0,0,0,0|1,0,0]=2 370 B10R1.34 OC[C@H]1O[C@@H]([C@@H]([C@@H]1O)O)O MCULE-5542181665 [0,1,0,0,0,0|1,0,0]=2 371 B10R1.34 OC[C@H]1O[C@@H]([C@H]([C@H]1O)O)O MCULE-9522337799 [0,1,0,0,0,0|1,0,0]=2 372 B10R1.34 OC[C@H]1O[C@H]([C@H]([C@H]1O)O)O MCULE-1427364722 [0,1,0,0,0,0|1,0,0]=2 373 B10R1.236 OCC1(COC(C1O)O)O MCULE-3740926726 [0,1,0,0,0,0|2,0,0]=3 374 B10R1.236 OCC1(OCC(C1O)O)O MCULE-4442933068 [0,1,0,0,0,0|1,0,0]=2 375 B10R1.236 OCC1(OC[C@@H]([C@H]1O)O)O MCULE-9865138473 [0,1,0,0,0,0|1,0,0]=2 376 B10R1.236 OCC1(OC[C@H]([C@@H]1O)O)O MCULE-7137289323 [0,1,0,0,0,0|1,0,0]=2 377 B10R1.236 OCC1(OC[C@H]([C@H]1O)O)O MCULE-1992709058 [0,1,0,0,0,0|1,0,0]=2 378 B10R1.236 OCC1(OC[C@H]([C@H]1O)O)O MCULE-6600191072 [0,1,0,0,0,0|1,0,0]=2 379 B10R1.236 OC[C@]1(COC([C@@H]1O)O)O MCULE-2488906341 [0,1,0,0,0,0|2,0,0]=3 380 B8R0.2 CC(=O)C(O)C(O)CO MCULE-1853649042 [0,0,1,0,0,0|1,0,2]=4 381 B8R0.2 CC(=O)[C@@H](O)[C@H](O)CO MCULE-9565941206 [0,0,1,0,0,0|1,0,2]=4 382 B8R0.2 CC(C)C(O)/C(=N\O)/N MCULE-1823794660 [0,0,1,0,0,0|2,0,1]=4 383 B8R0.2 CC(O)C(O)C(O)C=O MCULE-2576273900 [0,0,1,0,0,0|1,0,2]=4 384 B8R0.2 CCC(C)C(C)C(C)O MCULE-2099710154 [0,0,1,0,0,0|3,0,0]=4 385 B8R0.2 CCC(C)C(O)C(C)C MCULE-1108508487 [0,0,1,0,0,0|3,0,0]=4 386 B8R0.2 CCC(N)C(O)C(C)C MCULE-1144815530 [0,0,1,0,0,0|2,0,0]=3 387 B8R0.2 CCC(N)C(O)C(C)C MCULE-7062182958 [0,0,1,0,0,0|2,0,0]=3 388 B8R0.2 CCC(N)C(O)C(F)F MCULE-8040533324 [0,0,1,0,0,0|3,0,0]=4 389 B8R0.2 CCC(N)C(O)C(F)F MCULE-9737477996 [0,0,1,0,0,0|3,0,0]=4 390 B8R0.2 C[C@@H](O)[C@@H](O)[C@@H](O)C=O MCULE-1942337033 [0,0,1,0,0,0|1,0,2]=4 391 B8R0.2 C[C@@H](O)[C@@H](O)[C@@H](O)C=O MCULE-4131864005 [0,0,1,0,0,0|1,0,2]=4 392 B8R0.2 C[C@H](O)[C@H](O)[C@@H](O)C=O MCULE-8061692459 [0,0,1,0,0,0|1,0,2]=4 393 B8R0.2 C[C@H](O)[C@H](O)[C@H](O)C=O MCULE-5963868974 [0,0,1,0,0,0|1,0,2]=4 394 B8R0.2 O=C(O)C(O)C(O)CO MCULE-1397527919 [0,0,1,0,0,0|2,0,1]=4 395 B8R0.2 O=C(O)[C@H](O)[C@H](O)CO MCULE-1531474304 [0,0,1,0,0,0|2,0,1]=4 396 B8R0.2 O=C(O)[C@H](O)[C@H](O)CO MCULE-3829421433 [0,0,1,0,0,0|2,0,1]=4 397 B8R0.3 CCCC(C)C(O)CC MCULE-5128705007 [0,0,1,0,0,0|3,0,0]=4 398 B8R0.3 CCCC(O)C(C)CC MCULE-5746279508 [0,0,1,0,0,0|3,0,0]=4 399 B8R0.3 CCCC(O)C(N)CO MCULE-6983866986 [0,0,1,0,0,0|3,0,0]=4 400 B8R0.3 O=CCC(O)C(O)CO MCULE-3895407431 [0,0,1,0,0,0|1,0,2]=4 401 B8R0.3 O=CC[C@@H](O)[C@@H](O)CO MCULE-1639637147 [0,0,1,0,0,0|1,0,2]=4 402 B8R0.3 O=CC[C@@H](O)[C@@H](O)CO MCULE-4968821647 [0,0,1,0,0,0|1,0,2]=4 403 B8R0.3 O=CC[C@@H](O)[C@H](O)CO MCULE-5691852027 [0,0,1,0,0,0|1,0,2]=4 404 B8R0.3 O=CC[C@H](O)[C@H](O)CO MCULE-4741377107 [0,0,1,0,0,0|1,0,2]=4 405 B8R0.3 O=CC[C@H](O)[C@H](O)CO MCULE-6728124442 [0,0,1,0,0,0|1,0,2]=4 406 B8R0.3 O=CC[C@H](O)[C@H](O)CO MCULE-7223741689 [0,0,1,0,0,0|1,0,2]=4 407 B8R0.6 C=CCOCC(O)CO MCULE-2581090167 [0,0,1,0,0,0|2,0,1]=4 408 B8R0.6 C=CCOC[C@H](O)CO MCULE-2586134581 [0,0,1,0,0,0|2,0,1]=4 409 B8R0.6 C=CCOC[C@H](O)CO MCULE-2761205966 [0,0,1,0,0,0|2,0,1]=4 410 B8R0.6 CCC(C)CCCCO MCULE-9107164434 [0,0,1,0,0,0|3,0,0]=4 411 B8R0.6 CCCCCC(C)CO MCULE-4884757032 [0,0,1,0,0,0|3,0,0]=4 412 B8R0.6 CCCCCC(O)CC MCULE-6682377557 [0,0,1,0,0,0|3,0,0]=4 413 B8R0.6 CCCCCC(O)CCl MCULE-5610334497 [0,0,1,0,0,0|3,0,0]=4 414 B8R0.6 CCCCCC(O)CN MCULE-6091710122 [0,0,1,0,0,0|3,0,0]=4 415 B8R0.6 CCCCCC(O)CO MCULE-4124719814 [0,0,1,0,0,0|2,0,0]=3 416 B8R0.6 CCCNCC(O)CO MCULE-1611893086 [0,0,1,0,0,0|1,0,0]=2 417 B8R0.6 CCCOCC(C)CO MCULE-8326797774 [0,0,1,0,0,0|3,0,0]=4 418 B8R0.6 CCCOCC(O)CO MCULE-8815613620 [0,0,1,0,0,0|2,0,0]=3 419 B8R0.6 CCCOC[C@H](O)CO MCULE-7750792134 [0,0,1,0,0,0|2,0,0]=3 420 B8R0.6 CC[C@H](C)CCCCO MCULE-2674922341 [0,0,1,0,0,0|3,0,0]=4 421 B8R0.6 CC[C@H](C)CCCCO MCULE-7482991055 [0,0,1,0,0,0|3,0,0]=4 422 B8R0.6 N#CC(O)CCCCO MCULE-3554580179 [0,0,1,0,0,0|2,0,1]=4 423 B8R0.6 NCCCCC(N)CO MCULE-5938273372 [0,0,1,0,0,0|3,0,0]=4 424 B8R0.6 NCCCCC(N)CO MCULE-9464237285 [0,0,1,0,0,0|3,0,0]=4 425 B8R0.6 NCCCC[C@H](N)CO MCULE-4735749396 [0,0,1,0,0,0|3,0,0]=4 426 B8R0.6 NCCCC[C@H](N)CO MCULE-6997150748 [0,0,1,0,0,0|3,0,0]=4 427 B8R0.6 NCCCC[C@H](N)CO MCULE-7936699760 [0,0,1,0,0,0|3,0,0]=4 428 B8R0.6 NCCCC[C@H](N)CO MCULE-9135547877 [0,0,1,0,0,0|3,0,0]=4 429 B8R0.6 NCCNCC(O)CO MCULE-4818647623 [0,0,1,0,0,0|1,0,0]=2 430 B8R0.6 OC(CCl)COCCCl MCULE-4547951832 [0,0,1,0,0,0|3,0,0]=4 431 B8R0.6 OCCCCC(O)CO MCULE-5891501842 [0,0,1,0,0,0|1,0,0]=2 432 B8R0.6 OCCNCC(O)CO MCULE-1632492020 [0,0,1,0,0,0|0,0,0]=1 433 B8R0.6 OCCOCC(O)CCl MCULE-1530998868 [0,0,1,0,0,0|2,0,0]=3 434 B8R0.6 OCCOCC(O)CO MCULE-4768071463 [0,0,1,0,0,0|1,0,0]=2 435 B8R0.6 [C@H](O)(CC)CCCCC MCULE-7121730436 [0,0,1,0,0,0|3,0,0]=4 436 B8R0.11 CCC(CC)NCCN MCULE-5623637031 [0,0,1,0,0,0|3,0,0]=4 437 B8R0.11 CCC(CC)NCCO MCULE-3949639362 [0,0,1,0,0,0|2,0,0]=3 438 B8R0.11 CCCCC(CC)CO MCULE-1768780358 [0,0,1,0,0,0|3,0,0]=4 439 B8R0.11 CCCCC(CO)CO MCULE-4148067977 [0,0,1,0,0,0|2,0,0]=3 440 B8R0.11 CCCNC(CC)CC MCULE-3635515629 [0,0,1,0,0,0|3,0,0]=4 441 B8R0.11 CCCNC(CC)CC MCULE-6579619354 [0,0,1,0,0,0|3,0,0]=4 442 B8R0.20 CCC(C)C(CO)OC MCULE-9009724151 [0,0,1,0,0,0|3,0,0]=4 443 B8R0.20 CCC(CC)C(O)CN MCULE-3311357012 [0,0,1,0,0,0|3,0,0]=4 444 B8R0.20 CCC(CC)C(O)CO MCULE-2947428739 [0,0,1,0,0,0|2,0,0]=3 445 B8R0.20 CCC(O)C(CC)CC MCULE-1113039438 [0,0,1,0,0,0|3,0,0]=4 446 B8R0.20 COC(CO)C(Br)CO MCULE-7125758160 [0,0,1,0,0,0|2,0,0]=3 447 B8R0.20 COC(OC)C(O)CO MCULE-6139329169 [0,0,1,0,0,0|3,0,0]=4 448 B10R2.25 OC1C2CNC(C2)C1O MCULE-5174905071 [0,0,0,1,0,0|2,0,0]=3 449 B10R2.25 OC1C2CNC(C2)C1O MCULE-5852133152 [0,0,0,1,0,0|2,0,0]=3 450 B10R2.32 NC1CCC2C1COC2 MCULE-1223133187 [0,0,0,1,0,0|3,0,0]=4 451 B10R2.32 OC1CCC2C1CCC2 MCULE-5911929358 [0,0,0,1,0,0|3,0,0]=4 452 B10R2.32 OC1CCC2C1CNC2 MCULE-6125988514 [0,0,0,1,0,0|3,0,0]=4 453 B10R2.32 OC1CCC2C1CNC2 MCULE-7064719551 [0,0,0,1,0,0|3,0,0]=4 454 B10R2.32 OC1CCC2C1COC2 MCULE-3917523138 [0,0,0,1,0,0|2,0,0]=3 455 B10R2.32 O[C@@H]1CC[C@@H]2[C@H]1NCC2 MCULE-5080250769 [0,0,0,1,0,0|3,0,0]=4 456 B10R2.32 O[C@@H]1CC[C@@H]2[C@H]1NCC2 MCULE-7790238150 [0,0,0,1,0,0|3,0,0]=4 457 B10R2.32 O[C@@H]1CC[C@H]2[C@@H]1CNC2 MCULE-7707138682 [0,0,0,1,0,0|3,0,0]=4 458 B10R2.32 O[C@@H]1CC[C@H]2[C@@H]1CNC2 MCULE-9752128929 [0,0,0,1,0,0|3,0,0]=4 459 B10R2.32 O[C@@H]1CO[C@H]2[C@@H]1OCC2 MCULE-7718906696 [0,0,0,1,0,0|2,0,0]=3 460 B10R2.32 [C@H]12CC[C@@H]([C@H]1COC2)O MCULE-2634958500 [0,0,0,1,0,0|2,0,0]=3 461 B10R2.32 [C@H]12CC[C@H]([C@H]1CNC2)O MCULE-2498565757 [0,0,0,1,0,0|3,0,0]=4 462 B10R2.32 [C@H]12CC[C@H]([C@H]1CNC2)O MCULE-2579954489 [0,0,0,1,0,0|3,0,0]=4 463 B10R2.32 [C@H]12CC[C@H]([C@H]1CNC2)O MCULE-4244361875 [0,0,0,1,0,0|3,0,0]=4 464 B10R2.32 [C@H]12CC[C@H]([C@H]1CNC2)O MCULE-7470655017 [0,0,0,1,0,0|3,0,0]=4 465 B10R2.32 [C@H]12CC[C@H]([C@H]1COC2)O MCULE-7175558123 [0,0,0,1,0,0|2,0,0]=3 466 B10R2.41 OC1C2CCC1CNC2 MCULE-4258734063 [0,0,0,1,0,0|3,0,0]=4 467 B10R2.41 OC1C2CCC1CNC2 MCULE-9412192288 [0,0,0,1,0,0|3,0,0]=4 468 B10R2.41 OC1C2CCC1COC2 MCULE-6695569372 [0,0,0,1,0,0|2,0,0]=3 469 B10R2.41 OC1C2CNCC1OC2 MCULE-5447151121 [0,0,0,1,0,0|3,0,0]=4 470 B10R2.41 OC1[C@@H]2CC[C@@H]1CNC2 MCULE-7299179617 [0,0,0,1,0,0|3,0,0]=4 471 B10R2.41 OC1[C@@H]2CC[C@@H]1CNC2 MCULE-9240905969 [0,0,0,1,0,0|3,0,0]=4 472 B10R2.41 O[C@@H]1C2CC[C@@H]1CNC2 MCULE-2776722494 [0,0,0,1,0,0|3,0,0]=4 473 B10R2.41 O[C@@H]1C2CC[C@@H]1CNC2 MCULE-3317184032 [0,0,0,1,0,0|3,0,0]=4 474 B10R2.41 O[C@@H]1C2CC[C@@H]1CNC2 MCULE-6525902703 [0,0,0,1,0,0|3,0,0]=4 475 B10R2.41 O[C@@H]1C2CC[C@@H]1CNC2 MCULE-7363125004 [0,0,0,1,0,0|3,0,0]=4 476 B10R2.41 O[C@@H]1[C@H]2CC[C@@H]1CNC2 MCULE-3609257256 [0,0,0,1,0,0|3,0,0]=4 477 B10R2.41 O[C@@H]1[C@H]2CC[C@@H]1CNC2 MCULE-5549096986 [0,0,0,1,0,0|3,0,0]=4 478 B10R2.41 O[C@@H]1[C@H]2CNC[C@@H]1OC2 MCULE-3056704084 [0,0,0,1,0,0|3,0,0]=4 479 B10R2.41 O[C@H]1[C@H]2CC[C@@H]1CNC2 MCULE-1845673645 [0,0,0,1,0,0|3,0,0]=4 480 B10R2.41 O[C@H]1[C@H]2CC[C@@H]1CNC2 MCULE-5351686463 [0,0,0,1,0,0|3,0,0]=4 481 B10R2.41 O[C@H]1[C@H]2CNC[C@@H]1OC2 MCULE-7557877999 [0,0,0,1,0,0|3,0,0]=4 482 B10R2.41 [C@H]12CNC[C@H]([C@@H]1O)OC2 MCULE-3073596415 [0,0,0,1,0,0|3,0,0]=4 483 B10R1.2 C1(C=COC(C1O)CO)O MCULE-4150827844 [0,0,0,0,0,1|1,0,1]=3 484 B10R1.2 CN[C@@H]1CCC[C@H]([C@@H]1O)O MCULE-2638179747 [0,0,0,0,0,1|3,0,0]=4 485 B10R1.2 N[C@H]1CCO[C@@H]([C@H]1O)CO MCULE-3135160668 [0,0,0,0,0,1|2,0,0]=3 486 B10R1.2 N[C@H]1CCO[C@@H]([C@H]1O)CO MCULE-4840233170 [0,0,0,0,0,1|2,0,0]=3 487 B10R1.2 OC[C@H]1CNC[C@H]([C@@H]1O)O MCULE-5106848192 [0,0,0,0,0,1|0,0,0]=1 488 B10R1.2 OC[C@H]1CNC[C@H]([C@@H]1O)O MCULE-6551511352 [0,0,0,0,0,1|0,0,0]=1 489 B10R1.2 OC[C@H]1CNC[C@H]([C@@H]1O)O MCULE-8271266524 [0,0,0,0,0,1|0,0,0]=1 490 B10R1.2 OC[C@H]1NCC[C@H](C1O)O MCULE-3419174170 [0,0,0,0,0,1|0,0,0]=1 491 B10R1.2 OC[C@H]1NCC[C@H]([C@@H]1O)O MCULE-2511097258 [0,0,0,0,0,1|0,0,0]=1 492 B10R1.2 OC[C@H]1NCC[C@H]([C@@H]1O)O MCULE-5560787253 [0,0,0,0,0,1|0,0,0]=1 493 B10R1.2 OC[C@H]1OC=C[C@H]([C@@H]1O)O MCULE-2319652394 [0,0,0,0,0,1|1,0,1]=3 494 B10R1.2 OC[C@H]1OC=C[C@H]([C@@H]1O)O MCULE-8693280045 [0,0,0,0,0,1|1,0,1]=3 495 B10R1.2 OC[C@H]1OC=C[C@H]([C@H]1O)O MCULE-3153067382 [0,0,0,0,0,1|1,0,1]=3 496 B10R1.2 OC[C@H]1OC=C[C@H]([C@H]1O)O MCULE-5842959899 [0,0,0,0,0,1|1,0,1]=3 497 B10R1.25 CC1CCC(C(C1)C)CO MCULE-5468256653 [0,0,0,0,0,1|3,0,0]=4 498 B10R1.176 COC1CC(C(CO1)O)O MCULE-5630589307 [0,0,0,0,0,1|3,0,0]=4 499 B7R0.2 C=C(C)CC(N)CO MCULE-9114906744 [1,0,1,0,0,0|1,0,1]=4 500 B7R0.2 CC(C)CC(C)CO MCULE-5856507691 [1,0,1,0,0,0|2,0,0]=4 501 B7R0.2 CC(C)CC(N)CF MCULE-3937400151 [1,0,1,0,0,0|2,0,0]=4 502 B7R0.2 CC(C)CC(N)CF MCULE-7951827838 [1,0,1,0,0,0|2,0,0]=4 503 B7R0.2 CC(C)CC(N)CN MCULE-3441513735 [1,0,1,0,0,0|2,0,0]=4 504 B7R0.2 CC(C)CC(N)CO MCULE-6347344178 [1,0,1,0,0,0|1,0,0]=3 505 B7R0.2 CC(C)CC(N)CO MCULE-7024759986 [1,0,1,0,0,0|1,0,0]=3 506 B7R0.2 CC(C)CC(N)CS MCULE-8932651812 [1,0,1,0,0,0|1,1,0]=4 507 B7R0.2 CC(C)C[C@@H](N)CBr MCULE-4869966214 [1,0,1,0,0,0|2,0,0]=4 508 B7R0.2 CC(C)C[C@@H](N)CO MCULE-1979401982 [1,0,1,0,0,0|1,0,0]=3 509 B7R0.2 CC(C)C[C@@H](N)CO MCULE-3025407298 [1,0,1,0,0,0|1,0,0]=3 510 B7R0.2 CC(C)C[C@H](N)CBr MCULE-4224057266 [1,0,1,0,0,0|2,0,0]=4 511 B7R0.2 CC(C)C[C@H](N)CO MCULE-2790872575 [1,0,1,0,0,0|1,0,0]=3 512 B7R0.2 CC(C)C[C@H](N)CO MCULE-9198147139 [1,0,1,0,0,0|1,0,0]=3 513 B7R0.2 CC(O)CC(C)CN MCULE-3086796159 [1,0,1,0,0,0|2,0,0]=4 514 B7R0.2 CCC(N)CC(C)O MCULE-1447243469 [1,0,1,0,0,0|1,0,0]=3 515 B7R0.2 CCC(O)CC(C)O MCULE-3115543235 [1,0,1,0,0,0|2,0,0]=4 516 B7R0.2 CN(C)CC(N)CO MCULE-2789134862 [1,0,1,0,0,0|2,0,0]=4 517 B7R0.2 CN(C)CC(N)CO MCULE-4090276677 [1,0,1,0,0,0|2,0,0]=4 518 B7R0.2 NC(CO)CC(=O)O MCULE-4749383822 [1,0,1,0,0,0|1,0,1]=4 519 B7R0.2 NC(CO)CC(=O)O MCULE-7973334774 [1,0,1,0,0,0|1,0,1]=4 520 B7R0.2 NC(CO)CC(=O)O MCULE-8406665261 [1,0,1,0,0,0|1,0,1]=4 521 B7R0.2 NC(CO)CC(F)F MCULE-5033329865 [1,0,1,0,0,0|2,0,0]=4 522 B7R0.2 NC(CO)CC(F)F MCULE-6986507912 [1,0,1,0,0,0|2,0,0]=4 523 B7R0.2 N[C@@H](CO)CC(=O)O MCULE-1773927420 [1,0,1,0,0,0|1,0,1]=4 524 B7R0.2 N[C@@H](CO)CC(=O)O MCULE-2797951743 [1,0,1,0,0,0|1,0,1]=4 525 B7R0.2 N[C@@H](CO)CC(=O)O MCULE-3839766977 [1,0,1,0,0,0|1,0,1]=4 526 B7R0.2 N[C@H](CO)CC(=O)O MCULE-4130106630 [1,0,1,0,0,0|1,0,1]=4 527 B7R0.5 CC(C)C(C)CCO MCULE-9837449555 [1,0,1,0,0,0|2,0,0]=4 528 B7R0.5 CC(C)C(N)CCO MCULE-4571836019 [1,0,1,0,0,0|2,0,0]=4 529 B7R0.5 CC(C)C(O)CCCl MCULE-3510291624 [1,0,1,0,0,0|2,0,0]=4 530 B7R0.5 CC(C)C(O)CCN MCULE-2039463209 [1,0,1,0,0,0|2,0,0]=4 531 B7R0.5 CC(C)C(O)CCN MCULE-2941304015 [1,0,1,0,0,0|2,0,0]=4 532 B7R0.5 CC(C)C(O)CCO MCULE-8819967893 [1,0,1,0,0,0|1,0,0]=3 533 B7R0.5 CC(C)[C@H](N)CCO MCULE-5628923252 [1,0,1,0,0,0|2,0,0]=4 534 B7R0.5 CC(C)[C@H](O)CCN MCULE-1853419872 [1,0,1,0,0,0|2,0,0]=4 535 B7R0.5 CC(C)[C@H](O)CCN MCULE-1886424228 [1,0,1,0,0,0|2,0,0]=4 536 B7R0.5 CC(C)[C@H](O)CCN MCULE-7762475170 [1,0,1,0,0,0|2,0,0]=4 537 B7R0.5 CC(C)[C@H](O)CCN MCULE-8675177820 [1,0,1,0,0,0|2,0,0]=4 538 B7R0.5 CCCC(C)C(C)O MCULE-3222709632 [1,0,1,0,0,0|2,0,0]=4 539 B7R0.5 CCCC(O)C(C)C MCULE-8942406791 [1,0,1,0,0,0|2,0,0]=4 540 B7R0.5 O=C(O)C(O)CCO MCULE-9096271794 [1,0,1,0,0,0|1,0,1]=4 541 B7R0.10 CC(CN)C(N)CO MCULE-1520376315 [1,0,1,0,0,0|2,0,0]=4 542 B7R0.10 CC(CN)[C@H](N)CO MCULE-9250442888 [1,0,1,0,0,0|2,0,0]=4 543 B7R0.10 CCC(C)C(N)CO MCULE-3990781918 [1,0,1,0,0,0|1,0,0]=3 544 B7R0.10 CCC(C)C(N)CO MCULE-9261445768 [1,0,1,0,0,0|1,0,0]=3 545 B7R0.10 CCC(C)C(O)CC MCULE-3936368693 [1,0,1,0,0,0|2,0,0]=4 546 B7R0.10 CCC(C)C(O)CN MCULE-1941564207 [1,0,1,0,0,0|1,0,0]=3 547 B7R0.10 CCC(C)C(O)CO MCULE-9999862073 [1,0,1,0,0,0|1,0,0]=3 548 B7R0.10 CCC(N)C(O)CC MCULE-3578258801 [1,0,1,0,0,0|1,0,0]=3 549 B7R0.10 CCC(O)C(C)CO MCULE-3930931405 [1,0,1,0,0,0|1,0,0]=3 550 B7R0.10 CCC(O)C(C)CO MCULE-4472852672 [1,0,1,0,0,0|1,0,0]=3 551 B7R0.10 CCC(S)C(C)CO MCULE-1500370684 [1,0,1,0,0,0|1,1,0]=4 552 B7R0.10 CC[C@@H](C)[C@@H](N)CO MCULE-2122638055 [1,0,1,0,0,0|1,0,0]=3 553 B7R0.10 CC[C@@H](C)[C@@H](N)CO MCULE-7964651759 [1,0,1,0,0,0|1,0,0]=3 554 B7R0.10 CC[C@@H](C)[C@@H](N)CO MCULE-8482653298 [1,0,1,0,0,0|1,0,0]=3 555 B7R0.10 CC[C@H](C)[C@H](N)CF MCULE-3409941550 [1,0,1,0,0,0|2,0,0]=4 556 B7R0.10 CC[C@H](C)[C@H](N)CF MCULE-9750756690 [1,0,1,0,0,0|2,0,0]=4 557 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-3647332227 [1,0,1,0,0,0|1,0,0]=3 558 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-5774547825 [1,0,1,0,0,0|1,0,0]=3 559 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-8401203397 [1,0,1,0,0,0|1,0,0]=3 560 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-8452836661 [1,0,1,0,0,0|1,0,0]=3 561 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-9307589673 [1,0,1,0,0,0|1,0,0]=3 562 B7R0.10 NC[C@H](O)[C@H](O)CN MCULE-1073397630 [1,0,1,0,0,0|1,0,0]=3 563 B7R0.10 NC[C@H](O)[C@H](O)CN MCULE-8068595970 [1,0,1,0,0,0|1,0,0]=3 564 B7R0.10 N[C@@H](CO)[C@@H](N)CO MCULE-2394488011 [1,0,1,0,0,0|1,0,0]=3 565 B7R0.10 O=C(CO)C(O)CO MCULE-9818197491 [1,0,1,0,0,0|1,0,1]=4 566 B7R0.10 O=C(CO)[C@@H](O)CO MCULE-8306776225 [1,0,1,0,0,0|1,0,1]=4 567 B7R0.10 O=C(CO)[C@@H](O)CO MCULE-8666498937 [1,0,1,0,0,0|1,0,1]=4 568 B7R0.10 O=C(CO)[C@H](O)CO MCULE-7828531161 [1,0,1,0,0,0|1,0,1]=4 569 B7R0.10 O=CC(O)C(O)CO MCULE-9564469242 [1,0,1,0,0,0|1,0,1]=4 570 B7R0.10 O=C[C@@H](O)[C@@H](O)CO MCULE-3532911413 [1,0,1,0,0,0|1,0,1]=4 571 B7R0.10 O=C[C@@H](O)[C@@H](O)CO MCULE-5707669784 [1,0,1,0,0,0|1,0,1]=4 572 B7R0.10 O=C[C@@H](O)[C@H](O)CO MCULE-4902023669 [1,0,1,0,0,0|1,0,1]=4 573 B7R0.10 O=C[C@H](O)[C@@H](O)CO MCULE-5975565699 [1,0,1,0,0,0|1,0,1]=4 574 B7R0.10 O=C[C@H](O)[C@H](O)CO MCULE-3036594515 [1,0,1,0,0,0|1,0,1]=4 575 B7R0.10 O=C[C@H](O)[C@H](O)CO MCULE-5412566780 [1,0,1,0,0,0|1,0,1]=4 576 B7R0.10 OC(CBr)C(O)CBr MCULE-4608370293 [1,0,1,0,0,0|2,0,0]=4 577 B7R0.10 OC(CCl)C(O)CCl MCULE-9282587936 [1,0,1,0,0,0|2,0,0]=4 578 B7R0.10 OC(CS)C(O)CS MCULE-7432075835 [1,0,1,0,0,0|1,1,0]=4 579 B7R0.10 OCC(Br)C(Br)CO MCULE-4593943249 [1,0,1,0,0,0|2,0,0]=4 580 B7R0.10 OCC(O)C(O)CO MCULE-9009953851 [1,0,1,0,0,0|1,0,0]=3 581 B7R0.10 OC[C@@H](Br)[C@H](Br)CO MCULE-7293448690 [1,0,1,0,0,0|2,0,0]=4 582 B7R0.10 OC[C@@H](O)[C@H](O)CO MCULE-1593828237 [1,0,1,0,0,0|1,0,0]=3 583 B7R0.10 OC[C@@H](O)[C@H](O)CO MCULE-7577661973 [1,0,1,0,0,0|1,0,0]=3 584 B7R0.10 OC[C@@H](O)[C@H](S)CS MCULE-1423721945 [1,0,1,0,0,0|1,1,0]=4 585 B7R0.10 OC[C@H](O)[C@@H](O)CO MCULE-7306394407 [1,0,1,0,0,0|1,0,0]=3 586 B7R0.10 OC[C@H](O)[C@@H](O)CO MCULE-8013265935 [1,0,1,0,0,0|1,0,0]=3 587 B7R0.10 OC[C@H](O)[C@H](O)CO MCULE-6886999157 [1,0,1,0,0,0|1,0,0]=3 588 B7R0.10 O[C@@H](CS)[C@@H](O)CS MCULE-6947486648 [1,0,1,0,0,0|1,1,0]=4 589 B7R0.10 O[C@@H](CS)[C@@H](O)CS MCULE-8883019394 [1,0,1,0,0,0|1,1,0]=4 590 B7R0.10 O[C@H](CBr)[C@H](O)CBr MCULE-5914686116 [1,0,1,0,0,0|2,0,0]=4 591 B7R0.10 O[C@H](CCl)[C@@H](O)CCl MCULE-8266433235 [1,0,1,0,0,0|2,0,0]=4 592 B7R0.10 O[C@H](CS)[C@@H](O)CS MCULE-3618084743 [1,0,1,0,0,0|1,1,0]=4 593 B7R0.10 O[C@H](CS)[C@H](O)CS MCULE-3329450277 [1,0,1,0,0,0|1,1,0]=4 594 B7R0.10 O[C@H](CS)[C@H](O)CS MCULE-9065556670 [1,0,1,0,0,0|1,1,0]=4 595 B7R0.10 O[C@H](CS)[C@H](O)CS MCULE-9666091728 [1,0,1,0,0,0|1,1,0]=4 596 B7R0.10 [C@@H](C)(CC)[C@@H](N)CO MCULE-4423825378 [1,0,1,0,0,0|1,0,0]=3 597 B7R0.16 CC(C)C(O)C(C)C MCULE-3471523029 [1,0,1,0,0,0|2,0,0]=4 598 B7R0.16 CC(C)C(O)C(C)N MCULE-1856841813 [1,0,1,0,0,0|1,0,0]=3 599 B7R0.16 CC(N)C(O)C(=O)O MCULE-1086139043 [1,0,1,0,0,0|1,0,1]=4 600 B7R0.16 CC(N)C(O)C(=O)O MCULE-6405300346 [1,0,1,0,0,0|1,0,1]=4 601 B7R0.16 C[C@@H](O)[C@H](O)C(=O)O MCULE-9383777855 [1,0,1,0,0,0|1,0,1]=4 602 B7R0.16 C[C@H](N)[C@@H](O)C(=O)O MCULE-2574349608 [1,0,1,0,0,0|1,0,1]=4 603 B7R0.16 C[C@H](N)[C@@H](O)C(=O)O MCULE-6297204649 [1,0,1,0,0,0|1,0,1]=4 604 B7R0.3 C#CCCC(O)CN MCULE-7845137108 [1,0,1,0,0,0|1,0,1]=4 605 B7R0.3 C=CCCC(O)CN MCULE-4695723420 [1,0,1,0,0,0|1,0,1]=4 606 B7R0.3 C=CCC[C@@H](O)CO MCULE-6352864696 [1,0,1,0,0,0|1,0,1]=4 607 B7R0.3 CC(CCCO)NN MCULE-8201748999 [1,0,1,0,0,0|2,0,0]=4 608 B7R0.3 CC(CN)CCCN MCULE-1249275042 [1,0,1,0,0,0|2,0,0]=4 609 B7R0.3 CC(CN)CCCO MCULE-2908684674 [1,0,1,0,0,0|1,0,0]=3 610 B7R0.3 CC(CN)CCCO MCULE-5608783947 [1,0,1,0,0,0|1,0,0]=3 611 B7R0.3 CC(CN)CCCO MCULE-9269954426 [1,0,1,0,0,0|1,0,0]=3 612 B7R0.3 CC(CO)CCCO MCULE-8589885622 [1,0,1,0,0,0|1,0,0]=3 613 B7R0.3 CC(CO)NCCO MCULE-5180763491 [1,0,1,0,0,0|0,0,0]=2 614 B7R0.3 CCC(C)CCCO MCULE-2323419626 [1,0,1,0,0,0|2,0,0]=4 615 B7R0.3 CCC(C)NCCO MCULE-1340916666 [1,0,1,0,0,0|1,0,0]=3 616 B7R0.3 CCC(N)CCCO MCULE-3868205501 [1,0,1,0,0,0|2,0,0]=4 617 B7R0.3 CCC(O)CCCN MCULE-1491163174 [1,0,1,0,0,0|2,0,0]=4 618 B7R0.3 CCC(O)CCCN MCULE-5150508895 [1,0,1,0,0,0|2,0,0]=4 619 B7R0.3 CCC(O)CCCO MCULE-1099760826 [1,0,1,0,0,0|1,0,0]=3 620 B7R0.3 CCCCC(N)CN MCULE-2038464943 [1,0,1,0,0,0|2,0,0]=4 621 B7R0.3 CCCCC(N)CO MCULE-1874423109 [1,0,1,0,0,0|2,0,0]=4 622 B7R0.3 CCCCC(N)CO MCULE-2041767659 [1,0,1,0,0,0|2,0,0]=4 623 B7R0.3 CCCCC(N)CO MCULE-4533575851 [1,0,1,0,0,0|2,0,0]=4 624 B7R0.3 CCCCC(N)CO MCULE-7141990411 [1,0,1,0,0,0|2,0,0]=4 625 B7R0.3 CCCCC(O)CBr MCULE-8416535559 [1,0,1,0,0,0|2,0,0]=4 626 B7R0.3 CCCCC(O)CC MCULE-3912386534 [1,0,1,0,0,0|2,0,0]=4 627 B7R0.3 CCCCC(O)CN MCULE-1383380728 [1,0,1,0,0,0|1,0,0]=3 628 B7R0.3 CCCCC(O)CO MCULE-6903923961 [1,0,1,0,0,0|1,0,0]=3 629 B7R0.3 CCCC[C@@H](N)CO MCULE-1379297850 [1,0,1,0,0,0|2,0,0]=4 630 B7R0.3 CCCC[C@@H](N)CO MCULE-5016786633 [1,0,1,0,0,0|2,0,0]=4 631 B7R0.3 CCCC[C@@H](N)CO MCULE-6669873658 [1,0,1,0,0,0|2,0,0]=4 632 B7R0.3 CCCC[C@@H](N)CO MCULE-6809294141 [1,0,1,0,0,0|2,0,0]=4 633 B7R0.3 CCCC[C@H](N)CO MCULE-3277509271 [1,0,1,0,0,0|2,0,0]=4 634 B7R0.3 CCCC[C@H](N)CO MCULE-5867397890 [1,0,1,0,0,0|2,0,0]=4 635 B7R0.3 CCCNC(C)CC MCULE-8533643430 [1,0,1,0,0,0|2,0,0]=4 636 B7R0.3 CCCNC(C)CO MCULE-6575712324 [1,0,1,0,0,0|1,0,0]=3 637 B7R0.3 CCNCC(C)CC MCULE-8768620428 [1,0,1,0,0,0|2,0,0]=4 638 B7R0.3 CCNCC(C)CC MCULE-9491990692 [1,0,1,0,0,0|2,0,0]=4 639 B7R0.3 CCNCC(O)CC MCULE-9820144398 [1,0,1,0,0,0|1,0,0]=3 640 B7R0.3 CCOCC(C)CO MCULE-6831759423 [1,0,1,0,0,0|2,0,0]=4 641 B7R0.3 CCOCC(N)CO MCULE-8546500751 [1,0,1,0,0,0|2,0,0]=4 642 B7R0.3 CCOCC(O)CCl MCULE-5119359541 [1,0,1,0,0,0|2,0,0]=4 643 B7R0.3 CCOCC(O)CN MCULE-2355759727 [1,0,1,0,0,0|2,0,0]=4 644 B7R0.3 CCOCC(O)CO MCULE-2728952355 [1,0,1,0,0,0|1,0,0]=3 645 B7R0.3 CC[C@H](C)CCCO MCULE-1760153718 [1,0,1,0,0,0|2,0,0]=4 646 B7R0.3 CC[C@H](C)CCCO MCULE-3488695651 [1,0,1,0,0,0|2,0,0]=4 647 B7R0.3 CSCCC(O)CN MCULE-3835830442 [1,0,1,0,0,0|2,0,0]=4 648 B7R0.3 C[C@@H](CN)CCCO MCULE-2859776250 [1,0,1,0,0,0|1,0,0]=3 649 B7R0.3 C[C@@H](CN)CCCO MCULE-3245433953 [1,0,1,0,0,0|1,0,0]=3 650 B7R0.3 C[C@@H](CN)CCCO MCULE-7698870351 [1,0,1,0,0,0|1,0,0]=3 651 B7R0.3 C[C@@H](CN)CCCO MCULE-9900676606 [1,0,1,0,0,0|1,0,0]=3 652 B7R0.3 NCC(Cl)CCCCl MCULE-1250767606 [1,0,1,0,0,0|2,0,0]=4 653 B7R0.3 NCC(Cl)CCCCl MCULE-1634382406 [1,0,1,0,0,0|2,0,0]=4 654 B7R0.3 O=C(CO)NCCO MCULE-8933511918 [1,0,1,0,0,0|0,0,2]=4 655 B7R0.3 OCCCC(O)CO MCULE-3529953491 [1,0,1,0,0,0|0,0,0]=2 656 B7R0.7 CC(CCN)CCO MCULE-7864092529 [1,0,1,0,0,0|1,0,0]=3 657 B7R0.7 CC(CCO)CCO MCULE-5426211201 [1,0,1,0,0,0|2,0,0]=4 658 B7R0.7 CCCC(C)CCO MCULE-6887128167 [1,0,1,0,0,0|2,0,0]=4 659 B7R0.7 CCCC(N)CCO MCULE-3641094890 [1,0,1,0,0,0|2,0,0]=4 660 B7R0.7 CCCC(N)CCO MCULE-5323991138 [1,0,1,0,0,0|2,0,0]=4 661 B7R0.7 CCCC(N)CCO MCULE-6597027417 [1,0,1,0,0,0|2,0,0]=4 662 B7R0.7 CCCC(N)CCO MCULE-8093709628 [1,0,1,0,0,0|2,0,0]=4 663 B7R0.7 CCCC(O)CCC MCULE-1942797307 [1,0,1,0,0,0|2,0,0]=4 664 B7R0.7 CCCC(O)CCN MCULE-3796998426 [1,0,1,0,0,0|1,0,0]=3 665 B7R0.7 CCCC(O)CCO MCULE-6957178966 [1,0,1,0,0,0|1,0,0]=3 666 B7R0.7 CCCC(S)CCO MCULE-7972451905 [1,0,1,0,0,0|1,1,0]=4 667 B7R0.7 CCC[C@@H](N)CCO MCULE-1862127512 [1,0,1,0,0,0|2,0,0]=4 668 B7R0.7 CCC[C@@H](N)CCO MCULE-3031366486 [1,0,1,0,0,0|2,0,0]=4 669 B7R0.7 CCC[C@@H](N)CCO MCULE-4433535200 [1,0,1,0,0,0|2,0,0]=4 670 B7R0.7 CCC[C@@H](N)CCO MCULE-8325506694 [1,0,1,0,0,0|2,0,0]=4 671 B7R0.7 CCC[C@H](N)CCO MCULE-3164100995 [1,0,1,0,0,0|2,0,0]=4 672 B7R0.7 CCC[C@H](N)CCO MCULE-3262978007 [1,0,1,0,0,0|2,0,0]=4 673 B7R0.7 CCC[C@H](N)CCO MCULE-3382311889 [1,0,1,0,0,0|2,0,0]=4 674 B7R0.7 CCC[C@H](N)CCO MCULE-4865013919 [1,0,1,0,0,0|2,0,0]=4 675 B7R0.7 CN(CCN)CCO MCULE-2960427748 [1,0,1,0,0,0|2,0,0]=4 676 B7R0.7 COCC(O)CCN MCULE-9524454931 [1,0,1,0,0,0|2,0,0]=4 677 B7R0.7 OCCC(O)CCO MCULE-1162803524 [1,0,1,0,0,0|1,0,0]=3 678 B7R0.1 C=CCCNCCO MCULE-8357008337 [1,0,1,0,0,0|1,0,1]=4 679 B7R0.1 CCCCCCCO MCULE-5882959353 [1,0,1,0,0,0|2,0,0]=4 680 B7R0.1 CCCCNCCC MCULE-6342731867 [1,0,1,0,0,0|2,0,0]=4 681 B7R0.1 CCCCNCCN MCULE-3865190511 [1,0,1,0,0,0|2,0,0]=4 682 B7R0.1 CCCCNCCO MCULE-3582031814 [1,0,1,0,0,0|1,0,0]=3 683 B7R0.1 CCCCNCCS MCULE-6926403617 [1,0,1,0,0,0|1,1,0]=4 684 B7R0.1 CCCCOCCO MCULE-1727546427 [1,0,1,0,0,0|2,0,0]=4 685 B7R0.1 CCCCOCCO MCULE-4417721312 [1,0,1,0,0,0|2,0,0]=4 686 B7R0.1 CCCCSCCO MCULE-8791357083 [1,0,1,0,0,0|2,0,0]=4 687 B7R0.1 CCCNCCCN MCULE-6668094176 [1,0,1,0,0,0|2,0,0]=4 688 B7R0.1 CCCNCCCO MCULE-4366982860 [1,0,1,0,0,0|1,0,0]=3 689 B7R0.1 COCCNCCO MCULE-3082225541 [1,0,1,0,0,0|2,0,0]=4 690 B7R0.1 ClCCCNCCCl MCULE-1885721760 [1,0,1,0,0,0|2,0,0]=4 691 B7R0.1 ClCCCNCCCl MCULE-9511755738 [1,0,1,0,0,0|2,0,0]=4 692 B7R0.1 N#CCCNCCO MCULE-4867229301 [1,0,1,0,0,0|1,0,1]=4 693 B7R0.1 N#CCCNCCO MCULE-9947925933 [1,0,1,0,0,0|1,0,1]=4 694 B7R0.1 NCCCCCCO MCULE-2264326846 [1,0,1,0,0,0|2,0,0]=4 695 B7R0.1 NCCCNCCBr MCULE-3804557930 [1,0,1,0,0,0|2,0,0]=4 696 B7R0.1 NCCCNCCBr MCULE-7533614613 [1,0,1,0,0,0|2,0,0]=4 697 B7R0.1 NCCCNCCBr MCULE-9607733996 [1,0,1,0,0,0|2,0,0]=4 698 B7R0.1 NCCCNCCN MCULE-4817006723 [1,0,1,0,0,0|2,0,0]=4 699 B7R0.1 NCCCNCCO MCULE-1084481336 [1,0,1,0,0,0|1,0,0]=3 700 B7R0.1 NCCCNCCS MCULE-2204209594 [1,0,1,0,0,0|1,1,0]=4 701 B7R0.1 NCCCNCCS MCULE-8506055366 [1,0,1,0,0,0|1,1,0]=4 702 B7R0.1 NCCCOCCO MCULE-7244821044 [1,0,1,0,0,0|2,0,0]=4 703 B7R0.1 NCCNCCCO MCULE-6476789217 [1,0,1,0,0,0|1,0,0]=3 704 B7R0.1 NCCOCCCO MCULE-2435588099 [1,0,1,0,0,0|2,0,0]=4 705 B7R0.1 NCCOCCCO MCULE-9188421727 [1,0,1,0,0,0|2,0,0]=4 706 B7R0.1 NCCSCCCO MCULE-1578023056 [1,0,1,0,0,0|2,0,0]=4 707 B7R0.1 OCCC=CCCO MCULE-7933051592 [1,0,1,0,0,0|1,0,1]=4 708 B7R0.1 OCCCCCCBr MCULE-3500356936 [1,0,1,0,0,0|2,0,0]=4 709 B7R0.1 OCCCCCCCl MCULE-4507452440 [1,0,1,0,0,0|2,0,0]=4 710 B7R0.1 OCCCCCCF MCULE-7082491218 [1,0,1,0,0,0|2,0,0]=4 711 B7R0.1 OCCCCCCI MCULE-3710706648 [1,0,1,0,0,0|2,0,0]=4 712 B7R0.1 OCCCCCCO MCULE-8817570517 [1,0,1,0,0,0|1,0,0]=3 713 B7R0.1 OCCCCCCS MCULE-9135853131 [1,0,1,0,0,0|1,1,0]=4 714 B7R0.1 OCCCNCCO MCULE-1959450493 [1,0,1,0,0,0|0,0,0]=2 715 B7R0.1 OCCCOCCCl MCULE-9172390990 [1,0,1,0,0,0|2,0,0]=4 716 B7R0.1 OCCNNCCO MCULE-5335815164 [1,0,1,0,0,0|1,0,0]=3 717 B7R0.1 OCCOCCCBr MCULE-3397483886 [1,0,1,0,0,0|2,0,0]=4 718 B7R0.1 OCCSSCCO MCULE-9443383082 [1,0,1,0,0,0|2,0,0]=4 719 B7R0.4 CC(Br)CCCCO MCULE-2106751856 [1,0,1,0,0,0|2,0,0]=4 720 B7R0.4 CC(C)CCCCO MCULE-9053698607 [1,0,1,0,0,0|2,0,0]=4 721 B7R0.4 CC(C)CNCCN MCULE-3059280265 [1,0,1,0,0,0|2,0,0]=4 722 B7R0.4 CC(C)CNCCO MCULE-3948234461 [1,0,1,0,0,0|1,0,0]=3 723 B7R0.4 CC(C)CNCCO MCULE-6673201049 [1,0,1,0,0,0|1,0,0]=3 724 B7R0.4 CC(C)COCCO MCULE-2997702641 [1,0,1,0,0,0|2,0,0]=4 725 B7R0.4 CC(C)CSCCO MCULE-5481216581 [1,0,1,0,0,0|2,0,0]=4 726 B7R0.4 CC(Cl)CNCCCl MCULE-2269449058 [1,0,1,0,0,0|2,0,0]=4 727 B7R0.4 CC(Cl)CNCCCl MCULE-4107266640 [1,0,1,0,0,0|2,0,0]=4 728 B7R0.4 CC(N)CCCCO MCULE-7039935081 [1,0,1,0,0,0|2,0,0]=4 729 B7R0.4 CC(N)CCCCO MCULE-8167834378 [1,0,1,0,0,0|2,0,0]=4 730 B7R0.4 CC(O)CCCCO MCULE-3790969400 [1,0,1,0,0,0|1,0,0]=3 731 B7R0.4 CC(O)CNCCN MCULE-3904214677 [1,0,1,0,0,0|1,0,0]=3 732 B7R0.4 CC(O)CNCCO MCULE-4873845500 [1,0,1,0,0,0|0,0,0]=2 733 B7R0.4 CC(O)CSCCO MCULE-8885458360 [1,0,1,0,0,0|1,0,0]=3 734 B7R0.4 CCCCCC(C)O MCULE-2463855771 [1,0,1,0,0,0|2,0,0]=4 735 B7R0.4 CCCCC[C@@H](C)O MCULE-1984852239 [1,0,1,0,0,0|2,0,0]=4 736 B7R0.4 CCCCC[C@@H](C)O MCULE-2769933740 [1,0,1,0,0,0|2,0,0]=4 737 B7R0.4 CCCCC[C@H](C)O MCULE-2305379902 [1,0,1,0,0,0|2,0,0]=4 738 B7R0.4 CCCCC[C@H](C)O MCULE-5898721044 [1,0,1,0,0,0|2,0,0]=4 739 B7R0.4 CCCNCC(C)C MCULE-2869656642 [1,0,1,0,0,0|2,0,0]=4 740 B7R0.4 CCCNCC(C)O MCULE-8110237473 [1,0,1,0,0,0|1,0,0]=3 741 B7R0.4 CCCOCC(C)O MCULE-9214840563 [1,0,1,0,0,0|2,0,0]=4 742 B7R0.4 O=C(O)CNCCO MCULE-7501311949 [1,0,1,0,0,0|0,0,2]=4 743 B7R0.4 OCCNCC(F)F MCULE-3691382123 [1,0,1,0,0,0|2,0,0]=4 744 B7R0.12 C=CCC(CO)CO MCULE-4178696072 [1,0,1,0,0,0|1,0,1]=4 745 B7R0.12 CCC(CC)CCO MCULE-1684491793 [1,0,1,0,0,0|2,0,0]=4 746 B7R0.12 CCC(CN)CCO MCULE-4612619767 [1,0,1,0,0,0|2,0,0]=4 747 B7R0.12 CCCC(CO)CO MCULE-2372919180 [1,0,1,0,0,0|1,0,0]=3 748 B7R0.12 CCCC(CO)OC MCULE-9427398002 [1,0,1,0,0,0|2,0,0]=4 749 B7R0.12 CCNC(CC)CC MCULE-2150962345 [1,0,1,0,0,0|2,0,0]=4 750 B7R0.12 CCNC(CC)CC MCULE-7819167061 [1,0,1,0,0,0|2,0,0]=4 751 B7R0.12 CCNC(CC)CO MCULE-2240229411 [1,0,1,0,0,0|1,0,0]=3 752 B7R0.12 CCN[C@@H](CC)CO MCULE-3793090402 [1,0,1,0,0,0|1,0,0]=3 753 B7R0.12 CCN[C@@H](CC)CO MCULE-7960570694 [1,0,1,0,0,0|1,0,0]=3 754 B7R0.12 CCOC(CO)CBr MCULE-3004663873 [1,0,1,0,0,0|2,0,0]=4 755 B7R0.12 COC(CO)CCN MCULE-1177905249 [1,0,1,0,0,0|2,0,0]=4 756 B7R0.12 NCCC(CO)CO MCULE-7028267284 [1,0,1,0,0,0|1,0,0]=3 757 B7R0.12 NCCC(CO)CO MCULE-8865812482 [1,0,1,0,0,0|1,0,0]=3 758 B7R0.12 OCCC(CO)CO MCULE-7198799967 [1,0,1,0,0,0|0,0,0]=2 759 B7R0.15 CC(O)C(CO)CO MCULE-9986430379 [1,0,1,0,0,0|2,0,0]=4 760 B7R0.15 CCC(CC)C(C)O MCULE-9742014522 [1,0,1,0,0,0|2,0,0]=4 761 B7R0.15 CCC(CO)C(C)C MCULE-5089280337 [1,0,1,0,0,0|2,0,0]=4 762 B7R0.15 CNC(CO)C(=O)O MCULE-1439435474 [1,0,1,0,0,0|0,0,2]=4 763 B7R0.15 CNC(CO)C(=O)O MCULE-7611211207 [1,0,1,0,0,0|0,0,2]=4 764 B7R0.15 CNC(CO)C(C)C MCULE-5445088789 [1,0,1,0,0,0|1,0,0]=3 765 B7R0.15 CN[C@@H](CO)C(=O)O MCULE-3320307572 [1,0,1,0,0,0|0,0,2]=4 766 B7R0.15 CN[C@@H](CO)C(=O)O MCULE-5844994620 [1,0,1,0,0,0|0,0,2]=4 767 B7R0.15 CN[C@@H](CO)C(=O)O MCULE-6293854138 [1,0,1,0,0,0|0,0,2]=4 768 B7R0.15 CN[C@@H](CO)C(=O)O MCULE-6463850730 [1,0,1,0,0,0|0,0,2]=4 769 B7R0.15 CN[C@H](CO)C(=O)O MCULE-1791141182 [1,0,1,0,0,0|0,0,2]=4 770 B7R0.15 CN[C@H](CO)C(=O)O MCULE-9346314213 [1,0,1,0,0,0|0,0,2]=4 771 B7R0.15 COC(CO)C(C)Br MCULE-6071239484 [1,0,1,0,0,0|2,0,0]=4 772 B7R0.15 COC(CO)C(C)C MCULE-8695619177 [1,0,1,0,0,0|2,0,0]=4 773 B7R0.15 COC(CO)C(C)N MCULE-9816044841 [1,0,1,0,0,0|2,0,0]=4 774 B7R0.15 CO[C@@H](CO)C(C)C MCULE-3676351737 [1,0,1,0,0,0|2,0,0]=4 775 B7R0.15 CO[C@H](CO)C(C)C MCULE-2189146072 [1,0,1,0,0,0|2,0,0]=4 776 B7R0.15 CSC(CO)C(C)N MCULE-6491195363 [1,0,1,0,0,0|2,0,0]=4 777 B7R1.1 BrCC1CCCC1 MCULE-2472505847 [2,0,0,0,0,0|2,0,0]=4 778 B7R1.1 BrCC1CCCN1 MCULE-2152950124 [2,0,0,0,0,0|1,0,0]=3 779 B7R1.1 BrCC1CCCN1 MCULE-6083580584 [2,0,0,0,0,0|1,0,0]=3 780 B7R1.1 BrCC1CCCN1 MCULE-8116807965 [2,0,0,0,0,0|1,0,0]=3 781 B7R1.1 BrCC1CCCO1 MCULE-6801721633 [2,0,0,0,0,0|2,0,0]=4 782 B7R1.1 BrC[C@@H]1CCCN1 MCULE-2609238545 [2,0,0,0,0,0|1,0,0]=3 783 B7R1.1 BrC[C@@H]1CCCN1 MCULE-4300877722 [2,0,0,0,0,0|1,0,0]=3 784 B7R1.1 BrC[C@@H]1CCCN1 MCULE-7501559292 [2,0,0,0,0,0|1,0,0]=3 785 B7R1.1 BrC[C@@H]1CCCN1 MCULE-9528927495 [2,0,0,0,0,0|1,0,0]=3 786 B7R1.1 BrC[C@H]1CCCO1 MCULE-3468061610 [2,0,0,0,0,0|2,0,0]=4 787 B7R1.1 BrC[C@H]1CCCO1 MCULE-9305844681 [2,0,0,0,0,0|2,0,0]=4 788 B7R1.1 C#CC1CCCN1 MCULE-2312235714 [2,0,0,0,0,0|1,0,1]=4 789 B7R1.1 C#CC1CCCN1 MCULE-2368649911 [2,0,0,0,0,0|1,0,1]=4 790 B7R1.1 C#C[C@@H]1CCCN1 MCULE-1635908608 [2,0,0,0,0,0|1,0,1]=4 791 B7R1.1 C#C[C@@H]1CCCN1 MCULE-4766446168 [2,0,0,0,0,0|1,0,1]=4 792 B7R1.1 C#C[C@@H]1CCCN1 MCULE-7265052825 [2,0,0,0,0,0|1,0,1]=4 793 B7R1.1 C#C[C@@H]1CCCN1 MCULE-8496158135 [2,0,0,0,0,0|1,0,1]=4 794 B7R1.1 C#C[C@H]1CCCN1 MCULE-1874586489 [2,0,0,0,0,0|1,0,1]=4 795 B7R1.1 C#C[C@H]1CCCN1 MCULE-8338634355 [2,0,0,0,0,0|1,0,1]=4 796 B7R1.1 C1(CCCN1)CF MCULE-2705678622 [2,0,0,0,0,0|1,0,0]=3 797 B7R1.1 C1(CCCN1)CF MCULE-3175080744 [2,0,0,0,0,0|1,0,0]=3 798 B7R1.1 C1(CCCN1)CN MCULE-3568349121 [2,0,0,0,0,0|1,0,0]=3 799 B7R1.1 C1(CCCN1)CN MCULE-9944820727 [2,0,0,0,0,0|1,0,0]=3 800 B7R1.1 C1(CCCN1)CO MCULE-7277085817 [2,0,0,0,0,0|0,0,0]=2 801 B7R1.1 C1(CCNC1)CO MCULE-7897000858 [2,0,0,0,0,0|2,0,0]=4 802 B7R1.1 C1(CCNC1)CO MCULE-9939548436 [2,0,0,0,0,0|2,0,0]=4 803 B7R1.1 C1(CCOC1)CO MCULE-2350780678 [2,0,0,0,0,0|2,0,0]=4 804 B7R1.1 C=CC1CCCN1 MCULE-5736974496 [2,0,0,0,0,0|1,0,1]=4 805 B7R1.1 C=CC1CCCN1 MCULE-7626074228 [2,0,0,0,0,0|1,0,1]=4 806 B7R1.1 CCC1CCCC1 MCULE-1974854934 [2,0,0,0,0,0|2,0,0]=4 807 B7R1.1 CCC1CCCN1 MCULE-1775351089 [2,0,0,0,0,0|1,0,0]=3 808 B7R1.1 CCC1CCCN1 MCULE-2065682250 [2,0,0,0,0,0|1,0,0]=3 809 B7R1.1 CCC1CCCN1 MCULE-8326168982 [2,0,0,0,0,0|1,0,0]=3 810 B7R1.1 CCC1CCCN1 MCULE-9831560442 [2,0,0,0,0,0|1,0,0]=3 811 B7R1.1 CC[C@@H]1CCCN1 MCULE-1829706908 [2,0,0,0,0,0|1,0,0]=3 812 B7R1.1 CC[C@@H]1CCCN1 MCULE-6310895621 [2,0,0,0,0,0|1,0,0]=3 813 B7R1.1 CC[C@@H]1CCCN1 MCULE-6770634475 [2,0,0,0,0,0|1,0,0]=3 814 B7R1.1 CC[C@@H]1CCCN1 MCULE-9259891597 [2,0,0,0,0,0|1,0,0]=3 815 B7R1.1 CC[C@H]1CCCN1 MCULE-2347458277 [2,0,0,0,0,0|1,0,0]=3 816 B7R1.1 CC[C@H]1CCCN1 MCULE-3796565634 [2,0,0,0,0,0|1,0,0]=3 817 B7R1.1 CC[C@H]1CCCN1 MCULE-6193768639 [2,0,0,0,0,0|1,0,0]=3 818 B7R1.1 CC[C@H]1CCCN1 MCULE-9679619003 [2,0,0,0,0,0|1,0,0]=3 819 B7R1.1 ClCC1CCCC1 MCULE-7652893931 [2,0,0,0,0,0|2,0,0]=4 820 B7R1.1 ClCC1CCCN1 MCULE-3656101962 [2,0,0,0,0,0|1,0,0]=3 821 B7R1.1 ClCC1CCCN1 MCULE-9792407426 [2,0,0,0,0,0|1,0,0]=3 822 B7R1.1 ClCC1CCCO1 MCULE-9816764842 [2,0,0,0,0,0|2,0,0]=4 823 B7R1.1 ClC[C@@H]1CCCN1 MCULE-1712418178 [2,0,0,0,0,0|1,0,0]=3 824 B7R1.1 ClC[C@@H]1CCCN1 MCULE-2092217865 [2,0,0,0,0,0|1,0,0]=3 825 B7R1.1 ClC[C@@H]1CCCN1 MCULE-4473753787 [2,0,0,0,0,0|1,0,0]=3 826 B7R1.1 ClC[C@@H]1CCCN1 MCULE-9545872560 [2,0,0,0,0,0|1,0,0]=3 827 B7R1.1 ClC[C@H]1CCCN1 MCULE-1186865731 [2,0,0,0,0,0|1,0,0]=3 828 B7R1.1 ClC[C@H]1CCCN1 MCULE-3107383611 [2,0,0,0,0,0|1,0,0]=3 829 B7R1.1 FCC1CCCN1 MCULE-3216030316 [2,0,0,0,0,0|1,0,0]=3 830 B7R1.1 FCC1CCCN1 MCULE-4540803550 [2,0,0,0,0,0|1,0,0]=3 831 B7R1.1 FC[C@@H]1CCCN1 MCULE-2463314208 [2,0,0,0,0,0|1,0,0]=3 832 B7R1.1 FC[C@@H]1CCCN1 MCULE-3740139569 [2,0,0,0,0,0|1,0,0]=3 833 B7R1.1 FC[C@@H]1CCCN1 MCULE-6899304468 [2,0,0,0,0,0|1,0,0]=3 834 B7R1.1 FC[C@@H]1CCCN1 MCULE-9916936373 [2,0,0,0,0,0|1,0,0]=3 835 B7R1.1 FC[C@H]1CCCN1 MCULE-1380365453 [2,0,0,0,0,0|1,0,0]=3 836 B7R1.1 FC[C@H]1CCCN1 MCULE-1512160666 [2,0,0,0,0,0|1,0,0]=3 837 B7R1.1 FC[C@H]1CCCN1 MCULE-2904385734 [2,0,0,0,0,0|1,0,0]=3 838 B7R1.1 FC[C@H]1CCCN1 MCULE-9837641384 [2,0,0,0,0,0|1,0,0]=3 839 B7R1.1 ICC1CCCC1 MCULE-5940886897 [2,0,0,0,0,0|2,0,0]=4 840 B7R1.1 ICC1CCCN1 MCULE-3467617934 [2,0,0,0,0,0|1,0,0]=3 841 B7R1.1 ICC1CCCN1 MCULE-7784862806 [2,0,0,0,0,0|1,0,0]=3 842 B7R1.1 ICC1CCCO1 MCULE-3981288245 [2,0,0,0,0,0|2,0,0]=4 843 B7R1.1 IC[C@@H]1CCCN1 MCULE-4843756038 [2,0,0,0,0,0|1,0,0]=3 844 B7R1.1 IC[C@@H]1CCCN1 MCULE-8213667136 [2,0,0,0,0,0|1,0,0]=3 845 B7R1.1 N#CC1CCCN1 MCULE-1423410021 [2,0,0,0,0,0|1,0,1]=4 846 B7R1.1 N#CC1CCCN1 MCULE-2656253866 [2,0,0,0,0,0|1,0,1]=4 847 B7R1.1 N#CC1CCCN1 MCULE-4406196575 [2,0,0,0,0,0|1,0,1]=4 848 B7R1.1 N#CC1CCCN1 MCULE-7456938108 [2,0,0,0,0,0|1,0,1]=4 849 B7R1.1 N#CC1CCCN1 MCULE-7786777677 [2,0,0,0,0,0|1,0,1]=4 850 B7R1.1 N#CC1CCCN1 MCULE-9566371551 [2,0,0,0,0,0|1,0,1]=4 851 B7R1.1 N#C[C@@H]1CCCN1 MCULE-4099952481 [2,0,0,0,0,0|1,0,1]=4 852 B7R1.1 N#C[C@@H]1CCCN1 MCULE-4644423856 [2,0,0,0,0,0|1,0,1]=4 853 B7R1.1 N#C[C@@H]1CCCN1 MCULE-5675394665 [2,0,0,0,0,0|1,0,1]=4 854 B7R1.1 N#C[C@@H]1CCCN1 MCULE-5881469353 [2,0,0,0,0,0|1,0,1]=4 855 B7R1.1 N#C[C@@H]1CCCN1 MCULE-8875516240 [2,0,0,0,0,0|1,0,1]=4 856 B7R1.1 N#C[C@@H]1CCCN1 MCULE-9993553976 [2,0,0,0,0,0|1,0,1]=4 857 B7R1.1 N#C[C@H]1CCCN1 MCULE-4472756314 [2,0,0,0,0,0|1,0,1]=4 858 B7R1.1 N#C[C@H]1CCCN1 MCULE-6157392186 [2,0,0,0,0,0|1,0,1]=4 859 B7R1.1 N#C[C@H]1CCCN1 MCULE-6672062231 [2,0,0,0,0,0|1,0,1]=4 860 B7R1.1 N#C[C@H]1CCCN1 MCULE-7774660242 [2,0,0,0,0,0|1,0,1]=4 861 B7R1.1 N#C[C@H]1CCCN1 MCULE-7910694136 [2,0,0,0,0,0|1,0,1]=4 862 B7R1.1 N#C[C@H]1CCCN1 MCULE-8564583246 [2,0,0,0,0,0|1,0,1]=4 863 B7R1.1 NCC1CCCC1 MCULE-3629796849 [2,0,0,0,0,0|2,0,0]=4 864 B7R1.1 NCC1CCCC1 MCULE-8453900433 [2,0,0,0,0,0|2,0,0]=4 865 B7R1.1 NCC1CCCN1 MCULE-4764684364 [2,0,0,0,0,0|1,0,0]=3 866 B7R1.1 NCC1CCCN1 MCULE-8971980286 [2,0,0,0,0,0|1,0,0]=3 867 B7R1.1 NCC1CCCO1 MCULE-2797516262 [2,0,0,0,0,0|2,0,0]=4 868 B7R1.1 NCC1CCCO1 MCULE-5970677903 [2,0,0,0,0,0|2,0,0]=4 869 B7R1.1 NCC1CCCO1 MCULE-6166235034 [2,0,0,0,0,0|2,0,0]=4 870 B7R1.1 NCC1CCCS1 MCULE-5278325816 [2,0,0,0,0,0|2,0,0]=4 871 B7R1.1 NC[C@@H]1CCCN1 MCULE-4726727563 [2,0,0,0,0,0|1,0,0]=3 872 B7R1.1 NC[C@@H]1CCCN1 MCULE-7513400460 [2,0,0,0,0,0|1,0,0]=3 873 B7R1.1 NC[C@@H]1CCCN1 MCULE-7622329174 [2,0,0,0,0,0|1,0,0]=3 874 B7R1.1 NC[C@@H]1CCCN1 MCULE-8573395464 [2,0,0,0,0,0|1,0,0]=3 875 B7R1.1 NC[C@@H]1CCCO1 MCULE-1103643839 [2,0,0,0,0,0|2,0,0]=4 876 B7R1.1 NC[C@@H]1CCCO1 MCULE-1402571993 [2,0,0,0,0,0|2,0,0]=4 877 B7R1.1 NC[C@@H]1CCCO1 MCULE-1448381041 [2,0,0,0,0,0|2,0,0]=4 878 B7R1.1 NC[C@@H]1CCCO1 MCULE-6664501749 [2,0,0,0,0,0|2,0,0]=4 879 B7R1.1 NC[C@H]1CCCN1 MCULE-2813912286 [2,0,0,0,0,0|1,0,0]=3 880 B7R1.1 NC[C@H]1CCCN1 MCULE-5505144820 [2,0,0,0,0,0|1,0,0]=3 881 B7R1.1 NC[C@H]1CCCN1 MCULE-7325312327 [2,0,0,0,0,0|1,0,0]=3 882 B7R1.1 NC[C@H]1CCCN1 MCULE-7708925831 [2,0,0,0,0,0|1,0,0]=3 883 B7R1.1 NC[C@H]1CCCO1 MCULE-1196018690 [2,0,0,0,0,0|2,0,0]=4 884 B7R1.1 NC[C@H]1CCCO1 MCULE-2037746017 [2,0,0,0,0,0|2,0,0]=4 885 B7R1.1 NC[C@H]1CCCO1 MCULE-3470426685 [2,0,0,0,0,0|2,0,0]=4 886 B7R1.1 NC[C@H]1CCCO1 MCULE-9918683284 [2,0,0,0,0,0|2,0,0]=4 887 B7R1.1 O/N=C/1\CCCN1 MCULE-9494233692 [2,0,0,0,0,0|1,0,1]=4 888 B7R1.1 OCC1=CCCC1 MCULE-8850570361 [2,0,0,0,0,0|1,0,1]=4 889 B7R1.1 OCC1C=CCC1 MCULE-1237002603 [2,0,0,0,0,0|1,0,1]=4 890 B7R1.1 OCC1C=CCN1 MCULE-1461746159 [2,0,0,0,0,0|0,0,2]=4 891 B7R1.1 OCC1C=CCN1 MCULE-5814337815 [2,0,0,0,0,0|0,0,2]=4 892 B7R1.1 OCC1CCCC1 MCULE-2985338933 [2,0,0,0,0,0|1,0,0]=3 893 B7R1.1 OCC1CCCN1 MCULE-1016922679 [2,0,0,0,0,0|0,0,0]=2 894 B7R1.1 OCC1CCCN1 MCULE-8224535891 [2,0,0,0,0,0|0,0,0]=2 895 B7R1.1 OCC1CCCO1 MCULE-5877114547 [2,0,0,0,0,0|1,0,0]=3 896 B7R1.1 OCC1CCCO1 MCULE-5884880244 [2,0,0,0,0,0|1,0,0]=3 897 B7R1.1 OCC1CCCS1 MCULE-6106081414 [2,0,0,0,0,0|1,0,0]=3 898 B7R1.1 OCC1CCNC1 MCULE-7883947611 [2,0,0,0,0,0|2,0,0]=4 899 B7R1.1 OCC1CCNC1 MCULE-9689521155 [2,0,0,0,0,0|2,0,0]=4 900 B7R1.1 OCC1CCOC1 MCULE-8926405046 [2,0,0,0,0,0|2,0,0]=4 901 B7R1.1 OCC1CCON1 MCULE-1199975481 [2,0,0,0,0,0|1,0,0]=3 902 B7R1.1 OCC1CCON1 MCULE-4772487016 [2,0,0,0,0,0|1,0,0]=3 903 B7R1.1 OCC1CCSC1 MCULE-2226132734 [2,0,0,0,0,0|2,0,0]=4 904 B7R1.1 OCC1COCO1 MCULE-3470022742 [2,0,0,0,0,0|2,0,0]=4 905 B7R1.1 OCC1OCCO1 MCULE-8334027179 [2,0,0,0,0,0|2,0,0]=4 906 B7R1.1 OC[C@@H]1CCCN1 MCULE-1791547752 [2,0,0,0,0,0|0,0,0]=2 907 B7R1.1 OC[C@@H]1CCCN1 MCULE-6448856585 [2,0,0,0,0,0|0,0,0]=2 908 B7R1.1 OC[C@@H]1CCCN1 MCULE-7214801659 [2,0,0,0,0,0|0,0,0]=2 909 B7R1.1 OC[C@@H]1CCCN1 MCULE-7248451975 [2,0,0,0,0,0|0,0,0]=2 910 B7R1.1 OC[C@@H]1CCCO1 MCULE-1788377708 [2,0,0,0,0,0|1,0,0]=3 911 B7R1.1 OC[C@@H]1CCCO1 MCULE-3533553137 [2,0,0,0,0,0|1,0,0]=3 912 B7R1.1 OC[C@@H]1CCNC1 MCULE-3126404140 [2,0,0,0,0,0|2,0,0]=4 913 B7R1.1 OC[C@@H]1CCNC1 MCULE-4876549629 [2,0,0,0,0,0|2,0,0]=4 914 B7R1.1 OC[C@@H]1CCNC1 MCULE-7050415145 [2,0,0,0,0,0|2,0,0]=4 915 B7R1.1 OC[C@@H]1CCNC1 MCULE-8785146407 [2,0,0,0,0,0|2,0,0]=4 916 B7R1.1 OC[C@@H]1CCOC1 MCULE-2004616524 [2,0,0,0,0,0|2,0,0]=4 917 B7R1.1 OC[C@@H]1CCOC1 MCULE-3801423698 [2,0,0,0,0,0|2,0,0]=4 918 B7R1.1 OC[C@H]1CCCN1 MCULE-1266532697 [2,0,0,0,0,0|0,0,0]=2 919 B7R1.1 OC[C@H]1CCCN1 MCULE-1724166794 [2,0,0,0,0,0|0,0,0]=2 920 B7R1.1 OC[C@H]1CCCN1 MCULE-7513431964 [2,0,0,0,0,0|0,0,0]=2 921 B7R1.1 OC[C@H]1CCCN1 MCULE-8398083695 [2,0,0,0,0,0|0,0,0]=2 922 B7R1.1 OC[C@H]1CCCO1 MCULE-3501680239 [2,0,0,0,0,0|1,0,0]=3 923 B7R1.1 OC[C@H]1CCCO1 MCULE-4925106568 [2,0,0,0,0,0|1,0,0]=3 924 B7R1.1 OC[C@H]1CCNC1 MCULE-3909770597 [2,0,0,0,0,0|2,0,0]=4 925 B7R1.1 OC[C@H]1CCNC1 MCULE-5006682123 [2,0,0,0,0,0|2,0,0]=4 926 B7R1.1 OC[C@H]1CCNC1 MCULE-8265382423 [2,0,0,0,0,0|2,0,0]=4 927 B7R1.1 OC[C@H]1CCNC1 MCULE-8371969680 [2,0,0,0,0,0|2,0,0]=4 928 B7R1.1 OC[C@H]1CCOC1 MCULE-4226412289 [2,0,0,0,0,0|2,0,0]=4 929 B7R1.1 OC[C@H]1CCOC1 MCULE-9076004118 [2,0,0,0,0,0|2,0,0]=4 930 B7R1.1 ONC1CCCC1 MCULE-1143510043 [2,0,0,0,0,0|2,0,0]=4 931 B7R1.1 ONC1CCCC1 MCULE-7548854169 [2,0,0,0,0,0|2,0,0]=4 932 B7R1.1 SCC1CCCC1 MCULE-7973872166 [2,0,0,0,0,0|1,1,0]=4 933 B7R1.1 SCC1CCCO1 MCULE-5962232488 [2,0,0,0,0,0|1,1,0]=4 934 B7R1.2 C1(CCN(C1)C)O MCULE-5142099784 [2,0,0,0,0,0|2,0,0]=4 935 B7R1.2 C1(CNC(=O)C1)O MCULE-5557473335 [2,0,0,0,0,0|0,0,2]=4 936 B7R1.2 CC1CC(CN1)F MCULE-5211772527 [2,0,0,0,0,0|1,0,0]=3 937 B7R1.2 CC1CC(CN1)F MCULE-6845898511 [2,0,0,0,0,0|1,0,0]=3 938 B7R1.2 CC1CC(CN1)O MCULE-5630063862 [2,0,0,0,0,0|0,0,0]=2 939 B7R1.2 CC1CC(CN1)O MCULE-7427731937 [2,0,0,0,0,0|0,0,0]=2 940 B7R1.2 CC1CC(CO1)N MCULE-5031195609 [2,0,0,0,0,0|2,0,0]=4 941 B7R1.2 CC1CC(CO1)N MCULE-6627149239 [2,0,0,0,0,0|2,0,0]=4 942 B7R1.2 CC1CC(CO1)O MCULE-1304022283 [2,0,0,0,0,0|1,0,0]=3 943 B7R1.2 CC1CC(CS1)N MCULE-2886562999 [2,0,0,0,0,0|2,0,0]=4 944 B7R1.2 CC1CCC(C1)Br MCULE-3834311364 [2,0,0,0,0,0|2,0,0]=4 945 B7R1.2 CC1CCC(C1)Cl MCULE-7669391571 [2,0,0,0,0,0|2,0,0]=4 946 B7R1.2 CC1CCC(C1)N MCULE-3681457592 [2,0,0,0,0,0|2,0,0]=4 947 B7R1.2 CC1CCC(C1)N MCULE-8238390084 [2,0,0,0,0,0|2,0,0]=4 948 B7R1.2 CC1CCC(C1)O MCULE-7892602703 [2,0,0,0,0,0|1,0,0]=3 949 B7R1.2 CC1CNC(C1)C MCULE-3051496448 [2,0,0,0,0,0|1,0,0]=3 950 B7R1.2 CC1CNC(C1)C MCULE-9324057254 [2,0,0,0,0,0|1,0,0]=3 951 B7R1.2 CN1CCC(C1)O MCULE-7899934177 [2,0,0,0,0,0|2,0,0]=4 952 B7R1.2 CN1CC[C@@H](C1)O MCULE-1236945758 [2,0,0,0,0,0|2,0,0]=4 953 B7R1.2 CN1CC[C@@H](C1)O MCULE-4275527304 [2,0,0,0,0,0|2,0,0]=4 954 B7R1.2 CN1CC[C@H](C1)O MCULE-6665002754 [2,0,0,0,0,0|2,0,0]=4 955 B7R1.2 CN1CC[C@H](C1)O MCULE-8080661086 [2,0,0,0,0,0|2,0,0]=4 956 B7R1.2 C[C@@H]1CC(=O)CN1 MCULE-1621276410 [2,0,0,0,0,0|0,0,2]=4 957 B7R1.2 C[C@@H]1CC(=O)CN1 MCULE-8721208019 [2,0,0,0,0,0|0,0,2]=4 958 B7R1.2 C[C@@H]1CC[C@@H](C1)N MCULE-9471729241 [2,0,0,0,0,0|2,0,0]=4 959 B7R1.2 C[C@@H]1CC[C@H](C1)N MCULE-5368765184 [2,0,0,0,0,0|2,0,0]=4 960 B7R1.2 C[C@@H]1C[C@@H](CN1)F MCULE-1790804170 [2,0,0,0,0,0|1,0,0]=3 961 B7R1.2 C[C@@H]1C[C@@H](CN1)F MCULE-2224321786 [2,0,0,0,0,0|1,0,0]=3 962 B7R1.2 C[C@@H]1C[C@@H](CN1)F MCULE-6164070045 [2,0,0,0,0,0|1,0,0]=3 963 B7R1.2 C[C@@H]1C[C@@H](CN1)F MCULE-6870592338 [2,0,0,0,0,0|1,0,0]=3 964 B7R1.2 C[C@@H]1C[C@@H](CN1)O MCULE-1211015225 [2,0,0,0,0,0|0,0,0]=2 965 B7R1.2 C[C@@H]1C[C@@H](CN1)O MCULE-8025231795 [2,0,0,0,0,0|0,0,0]=2 966 B7R1.2 C[C@@H]1C[C@@H](CN1)O MCULE-8074184383 [2,0,0,0,0,0|0,0,0]=2 967 B7R1.2 C[C@@H]1C[C@@H](CN1)O MCULE-8403784233 [2,0,0,0,0,0|0,0,0]=2 968 B7R1.2 C[C@@H]1C[C@H](CN1)F MCULE-1165785658 [2,0,0,0,0,0|1,0,0]=3 969 B7R1.2 C[C@@H]1C[C@H](CN1)F MCULE-2237025386 [2,0,0,0,0,0|1,0,0]=3 970 B7R1.2 C[C@@H]1C[C@H](CN1)F MCULE-4695463101 [2,0,0,0,0,0|1,0,0]=3 971 B7R1.2 C[C@@H]1C[C@H](CN1)F MCULE-9859386988 [2,0,0,0,0,0|1,0,0]=3 972 B7R1.2 C[C@@H]1C[C@H](CN1)O MCULE-4359200896 [2,0,0,0,0,0|0,0,0]=2 973 B7R1.2 C[C@@H]1C[C@H](CN1)O MCULE-5029850022 [2,0,0,0,0,0|0,0,0]=2 974 B7R1.2 C[C@@H]1C[C@H](CN1)O MCULE-8880723450 [2,0,0,0,0,0|0,0,0]=2 975 B7R1.2 C[C@@H]1C[C@H](CN1)O MCULE-8966000465 [2,0,0,0,0,0|0,0,0]=2 976 B7R1.2 C[C@H]1CC(=O)CN1 MCULE-3272300487 [2,0,0,0,0,0|0,0,2]=4 977 B7R1.2 C[C@H]1CC(=O)CN1 MCULE-4583858198 [2,0,0,0,0,0|0,0,2]=4 978 B7R1.2 C[C@H]1CC(=O)CN1 MCULE-5135895304 [2,0,0,0,0,0|0,0,2]=4 979 B7R1.2 C[C@H]1CC(=O)CN1 MCULE-6058896534 [2,0,0,0,0,0|0,0,2]=4 980 B7R1.2 C[C@H]1CC[C@@H](C1)N MCULE-1080493056 [2,0,0,0,0,0|2,0,0]=4 981 B7R1.2 C[C@H]1CC[C@H](C1)C MCULE-8059507758 [2,0,0,0,0,0|2,0,0]=4 982 B7R1.2 C[C@H]1CC[C@H](C1)N MCULE-7070775136 [2,0,0,0,0,0|2,0,0]=4 983 B7R1.2 C[C@H]1C[C@@H](CN1)F MCULE-1742492020 [2,0,0,0,0,0|1,0,0]=3 984 B7R1.2 C[C@H]1C[C@@H](CN1)F MCULE-4690497151 [2,0,0,0,0,0|1,0,0]=3 985 B7R1.2 C[C@H]1C[C@@H](CN1)F MCULE-7372620241 [2,0,0,0,0,0|1,0,0]=3 986 B7R1.2 C[C@H]1C[C@@H](CN1)F MCULE-8319027426 [2,0,0,0,0,0|1,0,0]=3 987 B7R1.2 C[C@H]1C[C@@H](CN1)O MCULE-1346257695 [2,0,0,0,0,0|0,0,0]=2 988 B7R1.2 C[C@H]1C[C@@H](CN1)O MCULE-3035291598 [2,0,0,0,0,0|0,0,0]=2 989 B7R1.2 C[C@H]1C[C@@H](CN1)O MCULE-8611352921 [2,0,0,0,0,0|0,0,0]=2 990 B7R1.2 C[C@H]1C[C@@H](CN1)O MCULE-9413190353 [2,0,0,0,0,0|0,0,0]=2 991 B7R1.2 C[C@H]1C[C@H](CN1)F MCULE-1099206732 [2,0,0,0,0,0|1,0,0]=3 992 B7R1.2 C[C@H]1C[C@H](CN1)F MCULE-8257992498 [2,0,0,0,0,0|1,0,0]=3 993 B7R1.2 C[C@H]1C[C@H](CN1)F MCULE-8335445065 [2,0,0,0,0,0|1,0,0]=3 994 B7R1.2 C[C@H]1C[C@H](CN1)F MCULE-9395416229 [2,0,0,0,0,0|1,0,0]=3 995 B7R1.2 C[C@H]1C[C@H](CN1)O MCULE-3188785695 [2,0,0,0,0,0|0,0,0]=2 996 B7R1.2 C[C@H]1C[C@H](CN1)O MCULE-4518572489 [2,0,0,0,0,0|0,0,0]=2 997 B7R1.2 C[C@H]1C[C@H](CN1)O MCULE-5322353871 [2,0,0,0,0,0|0,0,0]=2 998 B7R1.2 C[C@H]1C[C@H](CN1)O MCULE-9693826142 [2,0,0,0,0,0|0,0,0]=2 999 B7R1.2 NC1CCC(C1)O MCULE-5821071286 [2,0,0,0,0,0|2,0,0]=4 1000 B7R1.2 NC1CCC(C1)O MCULE-9391783901 [2,0,0,0,0,0|2,0,0]=4 1001 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-2973461190 [2,0,0,0,0,0|2,0,0]=4 1002 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-5462229704 [2,0,0,0,0,0|2,0,0]=4 1003 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-6746606174 [2,0,0,0,0,0|2,0,0]=4 1004 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-7196403409 [2,0,0,0,0,0|2,0,0]=4 1005 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-7511735313 [2,0,0,0,0,0|2,0,0]=4 1006 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-9023897758 [2,0,0,0,0,0|2,0,0]=4 1007 B7R1.2 N[C@@H]1CC[C@H](C1)O MCULE-3286276562 [2,0,0,0,0,0|2,0,0]=4 1008 B7R1.2 N[C@@H]1CC[C@H](C1)O MCULE-5345953109 [2,0,0,0,0,0|2,0,0]=4 1009 B7R1.2 N[C@@H]1CC[C@H](C1)O MCULE-6442703385 [2,0,0,0,0,0|2,0,0]=4 1010 B7R1.2 N[C@@H]1CC[C@H](C1)O MCULE-7457197538 [2,0,0,0,0,0|2,0,0]=4 1011 B7R1.2 N[C@H]1CC[C@@H](C1)O MCULE-2764158583 [2,0,0,0,0,0|2,0,0]=4 1012 B7R1.2 N[C@H]1CC[C@@H](C1)O MCULE-5047569623 [2,0,0,0,0,0|2,0,0]=4 1013 B7R1.2 N[C@H]1CC[C@@H](C1)O MCULE-7674066148 [2,0,0,0,0,0|2,0,0]=4 1014 B7R1.2 N[C@H]1CC[C@@H](C1)O MCULE-8478778872 [2,0,0,0,0,0|2,0,0]=4 1015 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-3786824722 [2,0,0,0,0,0|2,0,0]=4 1016 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-4140170961 [2,0,0,0,0,0|2,0,0]=4 1017 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-5760466174 [2,0,0,0,0,0|2,0,0]=4 1018 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-5995468864 [2,0,0,0,0,0|2,0,0]=4 1019 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-6230469368 [2,0,0,0,0,0|2,0,0]=4 1020 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-9622062244 [2,0,0,0,0,0|2,0,0]=4 1021 B7R1.2 O=C1CC(CN1)O MCULE-8498039777 [2,0,0,0,0,0|0,0,2]=4 1022 B7R1.2 O=C1C[C@@H](CN1)O MCULE-2016792324 [2,0,0,0,0,0|0,0,2]=4 1023 B7R1.2 O=C1C[C@@H](CN1)O MCULE-9756194758 [2,0,0,0,0,0|0,0,2]=4 1024 B7R1.2 O=C1C[C@H](CN1)O MCULE-2017150152 [2,0,0,0,0,0|0,0,2]=4 1025 B7R1.2 O=C1C[C@H](CN1)O MCULE-5168961542 [2,0,0,0,0,0|0,0,2]=4 1026 B7R1.2 OC1C=CC(C1)O MCULE-9792113599 [2,0,0,0,0,0|1,0,1]=4 1027 B7R1.2 OC1CCC(C1)O MCULE-2799846813 [2,0,0,0,0,0|1,0,0]=3 1028 B7R1.2 OC1CCC(O1)O MCULE-8012370358 [2,0,0,0,0,0|2,0,0]=4 1029 B7R1.2 O[C@@H]1C=C[C@@H](C1)O MCULE-7187295032 [2,0,0,0,0,0|1,0,1]=4 1030 B7R1.2 O[C@@H]1CC[C@H](C1)O MCULE-4481324218 [2,0,0,0,0,0|1,0,0]=3 1031 B7R1.2 O[C@@H]1CC[C@H](C1)O MCULE-6560672131 [2,0,0,0,0,0|1,0,0]=3 1032 B7R1.2 O[C@H]1CC[C@H](C1)O MCULE-4640874873 [2,0,0,0,0,0|1,0,0]=3 1033 B7R1.2 [C@@H]1(CC[C@@H](C1)O)N MCULE-3137346382 [2,0,0,0,0,0|2,0,0]=4 1034 B7R1.2 [C@@H]1(CC[C@@H](C1)O)N MCULE-9954737796 [2,0,0,0,0,0|2,0,0]=4 1035 B7R1.2 [C@H]1(CC[C@H](C1)O)O MCULE-4834858159 [2,0,0,0,0,0|1,0,0]=3 1036 B7R1.2 [C@H]1(CN[C@@H](C1)C)O MCULE-1916837136 [2,0,0,0,0,0|0,0,0]=2 1037 B7R1.2 [C@H]1(CN[C@@H](C1)C)O MCULE-8263093896 [2,0,0,0,0,0|0,0,0]=2 1038 B7R1.2 [C@H]1(CN[C@H](C1)C)O MCULE-9065610836 [2,0,0,0,0,0|0,0,0]=2 1039 B7R1.2 [C@H]1(CN[C@H](C1)C)O MCULE-9910248291 [2,0,0,0,0,0|0,0,0]=2 1040 B7R1.4 CC1CCCC1Br MCULE-7816907673 [2,0,0,0,0,0|2,0,0]=4 1041 B7R1.4 CC1CCCC1N MCULE-4318156403 [2,0,0,0,0,0|2,0,0]=4 1042 B7R1.4 CC1CCCC1N MCULE-4434172193 [2,0,0,0,0,0|2,0,0]=4 1043 B7R1.4 CC1CCCC1O MCULE-1288711765 [2,0,0,0,0,0|1,0,0]=3 1044 B7R1.4 CC1CCNC1C MCULE-2184586167 [2,0,0,0,0,0|1,0,0]=3 1045 B7R1.4 CC1CNCC1C MCULE-5821391512 [2,0,0,0,0,0|2,0,0]=4 1046 B7R1.4 CC1CNCC1C MCULE-6626101399 [2,0,0,0,0,0|2,0,0]=4 1047 B7R1.4 CC1CNCC1F MCULE-4834888455 [2,0,0,0,0,0|2,0,0]=4 1048 B7R1.4 CC1CNCC1F MCULE-7766072724 [2,0,0,0,0,0|2,0,0]=4 1049 B7R1.4 CC1CNCC1N MCULE-2314973615 [2,0,0,0,0,0|2,0,0]=4 1050 B7R1.4 CC1CNCC1N MCULE-8542352354 [2,0,0,0,0,0|2,0,0]=4 1051 B7R1.4 CC1CNCC1O MCULE-3308447861 [2,0,0,0,0,0|1,0,0]=3 1052 B7R1.4 CC1CNCC1O MCULE-8526879323 [2,0,0,0,0,0|1,0,0]=3 1053 B7R1.4 CC1COCC1O MCULE-5925280081 [2,0,0,0,0,0|2,0,0]=4 1054 B7R1.4 CC1NCCC1=O MCULE-4206844406 [2,0,0,0,0,0|0,0,2]=4 1055 B7R1.4 CC1NCCC1=O MCULE-7025918222 [2,0,0,0,0,0|0,0,2]=4 1056 B7R1.4 CC1NCCC1O MCULE-7936666458 [2,0,0,0,0,0|0,0,0]=2 1057 B7R1.4 CC1NCCC1O MCULE-8369948926 [2,0,0,0,0,0|0,0,0]=2 1058 B7R1.4 CC1OCCC1N MCULE-4343663724 [2,0,0,0,0,0|2,0,0]=4 1059 B7R1.4 CC1OCCC1N MCULE-9003879039 [2,0,0,0,0,0|2,0,0]=4 1060 B7R1.4 CC1OCCC1O MCULE-6904695721 [2,0,0,0,0,0|1,0,0]=3 1061 B7R1.4 CC1OCCC1S MCULE-9127694888 [2,0,0,0,0,0|1,1,0]=4 1062 B7R1.4 CC1SCCC1N MCULE-5160182865 [2,0,0,0,0,0|2,0,0]=4 1063 B7R1.4 CC1SCCC1N MCULE-8827106279 [2,0,0,0,0,0|2,0,0]=4 1064 B7R1.4 CC1SCCC1O MCULE-4342593310 [2,0,0,0,0,0|1,0,0]=3 1065 B7R1.4 C[C@@H]1CCC[C@@H]1N MCULE-6206070680 [2,0,0,0,0,0|2,0,0]=4 1066 B7R1.4 C[C@@H]1CCC[C@@H]1N MCULE-9964938082 [2,0,0,0,0,0|2,0,0]=4 1067 B7R1.4 C[C@@H]1CCC[C@@H]1O MCULE-2617120620 [2,0,0,0,0,0|1,0,0]=3 1068 B7R1.4 C[C@@H]1CCC[C@H]1N MCULE-8385969474 [2,0,0,0,0,0|2,0,0]=4 1069 B7R1.4 C[C@@H]1CCC[C@H]1O MCULE-3398682980 [2,0,0,0,0,0|1,0,0]=3 1070 B7R1.4 C[C@@H]1CNC[C@@H]1C MCULE-4592161485 [2,0,0,0,0,0|2,0,0]=4 1071 B7R1.4 C[C@@H]1CNC[C@@H]1C MCULE-5506149631 [2,0,0,0,0,0|2,0,0]=4 1072 B7R1.4 C[C@@H]1CNC[C@@H]1F MCULE-4204399527 [2,0,0,0,0,0|2,0,0]=4 1073 B7R1.4 C[C@@H]1CNC[C@@H]1F MCULE-8451199903 [2,0,0,0,0,0|2,0,0]=4 1074 B7R1.4 C[C@@H]1CNC[C@@H]1N MCULE-2290594563 [2,0,0,0,0,0|2,0,0]=4 1075 B7R1.4 C[C@@H]1CNC[C@@H]1N MCULE-2611807697 [2,0,0,0,0,0|2,0,0]=4 1076 B7R1.4 C[C@@H]1CNC[C@@H]1N MCULE-3707409979 [2,0,0,0,0,0|2,0,0]=4 1077 B7R1.4 C[C@@H]1CNC[C@@H]1N MCULE-4317636252 [2,0,0,0,0,0|2,0,0]=4 1078 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-2015388080 [2,0,0,0,0,0|1,0,0]=3 1079 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-3625149028 [2,0,0,0,0,0|1,0,0]=3 1080 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-5773404554 [2,0,0,0,0,0|1,0,0]=3 1081 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-6014391902 [2,0,0,0,0,0|1,0,0]=3 1082 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-6476104556 [2,0,0,0,0,0|1,0,0]=3 1083 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-6537028059 [2,0,0,0,0,0|1,0,0]=3 1084 B7R1.4 C[C@@H]1CNC[C@H]1C MCULE-2567871968 [2,0,0,0,0,0|2,0,0]=4 1085 B7R1.4 C[C@@H]1CNC[C@H]1C MCULE-5626188867 [2,0,0,0,0,0|2,0,0]=4 1086 B7R1.4 C[C@@H]1CNC[C@H]1C MCULE-7438009663 [2,0,0,0,0,0|2,0,0]=4 1087 B7R1.4 C[C@@H]1CNC[C@H]1C MCULE-8649896095 [2,0,0,0,0,0|2,0,0]=4 1088 B7R1.4 C[C@@H]1CNC[C@H]1O MCULE-4207581523 [2,0,0,0,0,0|1,0,0]=3 1089 B7R1.4 C[C@@H]1CNC[C@H]1O MCULE-6158474994 [2,0,0,0,0,0|1,0,0]=3 1090 B7R1.4 C[C@@H]1CNC[C@H]1O MCULE-7380960276 [2,0,0,0,0,0|1,0,0]=3 1091 B7R1.4 C[C@@H]1CNC[C@H]1O MCULE-7589629864 [2,0,0,0,0,0|1,0,0]=3 1092 B7R1.4 C[C@@H]1COC[C@@H]1O MCULE-3198029643 [2,0,0,0,0,0|2,0,0]=4 1093 B7R1.4 C[C@@H]1COC[C@H]1O MCULE-1967963278 [2,0,0,0,0,0|2,0,0]=4 1094 B7R1.4 C[C@@H]1NCC[C@@H]1O MCULE-1705265213 [2,0,0,0,0,0|0,0,0]=2 1095 B7R1.4 C[C@@H]1NCC[C@@H]1O MCULE-3395898129 [2,0,0,0,0,0|0,0,0]=2 1096 B7R1.4 C[C@@H]1NCC[C@@H]1O MCULE-5909894286 [2,0,0,0,0,0|0,0,0]=2 1097 B7R1.4 C[C@@H]1NCC[C@@H]1O MCULE-9998480727 [2,0,0,0,0,0|0,0,0]=2 1098 B7R1.4 C[C@@H]1NCC[C@H]1O MCULE-1101330824 [2,0,0,0,0,0|0,0,0]=2 1099 B7R1.4 C[C@@H]1NCC[C@H]1O MCULE-3326131093 [2,0,0,0,0,0|0,0,0]=2 1100 B7R1.4 C[C@@H]1NCC[C@H]1O MCULE-3941456644 [2,0,0,0,0,0|0,0,0]=2 1101 B7R1.4 C[C@@H]1NCC[C@H]1O MCULE-8944150043 [2,0,0,0,0,0|0,0,0]=2 1102 B7R1.4 C[C@@H]1OCC[C@H]1N MCULE-5910807847 [2,0,0,0,0,0|2,0,0]=4 1103 B7R1.4 C[C@@H]1OCC[C@H]1N MCULE-7586038907 [2,0,0,0,0,0|2,0,0]=4 1104 B7R1.4 C[C@H]1CCC[C@@H]1N MCULE-4150988023 [2,0,0,0,0,0|2,0,0]=4 1105 B7R1.4 C[C@H]1CCC[C@@H]1O MCULE-5212653059 [2,0,0,0,0,0|1,0,0]=3 1106 B7R1.4 C[C@H]1CCC[C@@H]1O MCULE-7997646273 [2,0,0,0,0,0|1,0,0]=3 1107 B7R1.4 C[C@H]1CCC[C@H]1N MCULE-3329868072 [2,0,0,0,0,0|2,0,0]=4 1108 B7R1.4 C[C@H]1CCC[C@H]1N MCULE-4186145172 [2,0,0,0,0,0|2,0,0]=4 1109 B7R1.4 C[C@H]1CCC[C@H]1O MCULE-3291842365 [2,0,0,0,0,0|1,0,0]=3 1110 B7R1.4 C[C@H]1CCC[C@H]1O MCULE-7570125274 [2,0,0,0,0,0|1,0,0]=3 1111 B7R1.4 C[C@H]1CCN[C@@H]1C MCULE-7622265949 [2,0,0,0,0,0|1,0,0]=3 1112 B7R1.4 C[C@H]1CCN[C@@H]1C MCULE-7686056776 [2,0,0,0,0,0|1,0,0]=3 1113 B7R1.4 C[C@H]1CNC[C@@H]1C MCULE-2214344957 [2,0,0,0,0,0|2,0,0]=4 1114 B7R1.4 C[C@H]1CNC[C@@H]1C MCULE-2877312650 [2,0,0,0,0,0|2,0,0]=4 1115 B7R1.4 C[C@H]1CNC[C@@H]1O MCULE-2282810666 [2,0,0,0,0,0|1,0,0]=3 1116 B7R1.4 C[C@H]1CNC[C@@H]1O MCULE-2772361871 [2,0,0,0,0,0|1,0,0]=3 1117 B7R1.4 C[C@H]1CNC[C@@H]1O MCULE-3274154422 [2,0,0,0,0,0|1,0,0]=3 1118 B7R1.4 C[C@H]1CNC[C@@H]1O MCULE-3608199633 [2,0,0,0,0,0|1,0,0]=3 1119 B7R1.4 C[C@H]1CNC[C@H]1N MCULE-6069899229 [2,0,0,0,0,0|2,0,0]=4 1120 B7R1.4 C[C@H]1CNC[C@H]1N MCULE-8539137579 [2,0,0,0,0,0|2,0,0]=4 1121 B7R1.4 C[C@H]1CNC[C@H]1O MCULE-1988679936 [2,0,0,0,0,0|1,0,0]=3 1122 B7R1.4 C[C@H]1CNC[C@H]1O MCULE-3451477960 [2,0,0,0,0,0|1,0,0]=3 1123 B7R1.4 C[C@H]1CNC[C@H]1O MCULE-4396463600 [2,0,0,0,0,0|1,0,0]=3 1124 B7R1.4 C[C@H]1CNC[C@H]1O MCULE-7975653844 [2,0,0,0,0,0|1,0,0]=3 1125 B7R1.4 C[C@H]1COC[C@@H]1O MCULE-3765921602 [2,0,0,0,0,0|2,0,0]=4 1126 B7R1.4 C[C@H]1COC[C@@H]1O MCULE-5201903195 [2,0,0,0,0,0|2,0,0]=4 1127 B7R1.4 C[C@H]1COC[C@H]1O MCULE-2974083166 [2,0,0,0,0,0|2,0,0]=4 1128 B7R1.4 C[C@H]1COC[C@H]1O MCULE-6725207001 [2,0,0,0,0,0|2,0,0]=4 1129 B7R1.4 C[C@H]1NCC[C@@H]1O MCULE-5499798144 [2,0,0,0,0,0|0,0,0]=2 1130 B7R1.4 C[C@H]1NCC[C@@H]1O MCULE-7401004387 [2,0,0,0,0,0|0,0,0]=2 1131 B7R1.4 C[C@H]1NCC[C@H]1O MCULE-7469942077 [2,0,0,0,0,0|0,0,0]=2 1132 B7R1.4 C[C@H]1NCC[C@H]1O MCULE-9976903585 [2,0,0,0,0,0|0,0,0]=2 1133 B7R1.4 C[C@H]1OCC[C@H]1N MCULE-1432785321 [2,0,0,0,0,0|2,0,0]=4 1134 B7R1.4 C[C@H]1OCC[C@H]1N MCULE-3008045787 [2,0,0,0,0,0|2,0,0]=4 1135 B7R1.4 C[C@H]1OCC[C@H]1N MCULE-7656776924 [2,0,0,0,0,0|2,0,0]=4 1136 B7R1.4 C[C@H]1OCC[C@H]1N MCULE-8087379612 [2,0,0,0,0,0|2,0,0]=4 1137 B7R1.4 FC1CNCC1F MCULE-2795759224 [2,0,0,0,0,0|2,0,0]=4 1138 B7R1.4 FC1CNCC1F MCULE-4642260114 [2,0,0,0,0,0|2,0,0]=4 1139 B7R1.4 F[C@@H]1CNC[C@H]1F MCULE-1572445063 [2,0,0,0,0,0|2,0,0]=4 1140 B7R1.4 F[C@@H]1CNC[C@H]1F MCULE-4177562777 [2,0,0,0,0,0|2,0,0]=4 1141 B7R1.4 F[C@@H]1CNC[C@H]1F MCULE-4519639793 [2,0,0,0,0,0|2,0,0]=4 1142 B7R1.4 F[C@@H]1CNC[C@H]1F MCULE-5389552975 [2,0,0,0,0,0|2,0,0]=4 1143 B7R1.4 F[C@@H]1CNC[C@H]1F MCULE-6385794790 [2,0,0,0,0,0|2,0,0]=4 1144 B7R1.4 F[C@@H]1CNC[C@H]1F MCULE-7723721112 [2,0,0,0,0,0|2,0,0]=4 1145 B7R1.4 F[C@H]1CNC[C@@H]1F MCULE-1910510712 [2,0,0,0,0,0|2,0,0]=4 1146 B7R1.4 F[C@H]1CNC[C@@H]1F MCULE-1939514822 [2,0,0,0,0,0|2,0,0]=4 1147 B7R1.4 F[C@H]1CNC[C@@H]1F MCULE-7688312295 [2,0,0,0,0,0|2,0,0]=4 1148 B7R1.4 F[C@H]1CNC[C@@H]1F MCULE-9195313321 [2,0,0,0,0,0|2,0,0]=4 1149 B7R1.4 F[C@H]1CNC[C@H]1F MCULE-1191772323 [2,0,0,0,0,0|2,0,0]=4 1150 B7R1.4 F[C@H]1CNC[C@H]1F MCULE-1441165331 [2,0,0,0,0,0|2,0,0]=4 1151 B7R1.4 F[C@H]1CNC[C@H]1F MCULE-2941635831 [2,0,0,0,0,0|2,0,0]=4 1152 B7R1.4 NC1CCCC1O MCULE-1657591641 [2,0,0,0,0,0|2,0,0]=4 1153 B7R1.4 NC1CCCC1O MCULE-6248992494 [2,0,0,0,0,0|2,0,0]=4 1154 B7R1.4 NC1CNCC1F MCULE-1177091135 [2,0,0,0,0,0|2,0,0]=4 1155 B7R1.4 NC1CNCC1F MCULE-8259596061 [2,0,0,0,0,0|2,0,0]=4 1156 B7R1.4 NC1COCC1O MCULE-3115911209 [2,0,0,0,0,0|2,0,0]=4 1157 B7R1.4 NC1COCC1O MCULE-9837103399 [2,0,0,0,0,0|2,0,0]=4 1158 B7R1.4 NC1CSCC1O MCULE-4474934833 [2,0,0,0,0,0|2,0,0]=4 1159 B7R1.4 NC1CSCC1O MCULE-5059305463 [2,0,0,0,0,0|2,0,0]=4 1160 B7R1.4 NC1CSCC1O MCULE-8633680588 [2,0,0,0,0,0|2,0,0]=4 1161 B7R1.4 N[C@@H]1CCC[C@@H]1O MCULE-3619202671 [2,0,0,0,0,0|2,0,0]=4 1162 B7R1.4 N[C@@H]1CCC[C@@H]1O MCULE-5588562063 [2,0,0,0,0,0|2,0,0]=4 1163 B7R1.4 N[C@@H]1CCC[C@@H]1O MCULE-8937650915 [2,0,0,0,0,0|2,0,0]=4 1164 B7R1.4 N[C@@H]1CCC[C@@H]1O MCULE-9550479411 [2,0,0,0,0,0|2,0,0]=4 1165 B7R1.4 N[C@@H]1CCC[C@@H]1O MCULE-9908988904 [2,0,0,0,0,0|2,0,0]=4 1166 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-2283352070 [2,0,0,0,0,0|2,0,0]=4 1167 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-3279782742 [2,0,0,0,0,0|2,0,0]=4 1168 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-6823698796 [2,0,0,0,0,0|2,0,0]=4 1169 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-7752087047 [2,0,0,0,0,0|2,0,0]=4 1170 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-8823714511 [2,0,0,0,0,0|2,0,0]=4 1171 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-9789739251 [2,0,0,0,0,0|2,0,0]=4 1172 B7R1.4 N[C@@H]1CNC[C@H]1F MCULE-1708344428 [2,0,0,0,0,0|2,0,0]=4 1173 B7R1.4 N[C@@H]1CNC[C@H]1F MCULE-3614628548 [2,0,0,0,0,0|2,0,0]=4 1174 B7R1.4 N[C@@H]1CNC[C@H]1F MCULE-5868430910 [2,0,0,0,0,0|2,0,0]=4 1175 B7R1.4 N[C@@H]1CNC[C@H]1F MCULE-9283549047 [2,0,0,0,0,0|2,0,0]=4 1176 B7R1.4 N[C@@H]1COC[C@@H]1O MCULE-2891920420 [2,0,0,0,0,0|2,0,0]=4 1177 B7R1.4 N[C@@H]1COC[C@@H]1O MCULE-5764643856 [2,0,0,0,0,0|2,0,0]=4 1178 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-1399984261 [2,0,0,0,0,0|2,0,0]=4 1179 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-2321912677 [2,0,0,0,0,0|2,0,0]=4 1180 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-4422404071 [2,0,0,0,0,0|2,0,0]=4 1181 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-7801515292 [2,0,0,0,0,0|2,0,0]=4 1182 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-9112718041 [2,0,0,0,0,0|2,0,0]=4 1183 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-9447703783 [2,0,0,0,0,0|2,0,0]=4 1184 B7R1.4 N[C@@H]1CSC[C@@H]1O MCULE-4507133192 [2,0,0,0,0,0|2,0,0]=4 1185 B7R1.4 N[C@@H]1CSC[C@@H]1O MCULE-9327920188 [2,0,0,0,0,0|2,0,0]=4 1186 B7R1.4 N[C@@H]1CSC[C@H]1O MCULE-5323319055 [2,0,0,0,0,0|2,0,0]=4 1187 B7R1.4 N[C@@H]1CSC[C@H]1O MCULE-8008053411 [2,0,0,0,0,0|2,0,0]=4 1188 B7R1.4 N[C@H]1CCC[C@@H]1O MCULE-6629056296 [2,0,0,0,0,0|2,0,0]=4 1189 B7R1.4 N[C@H]1CCC[C@@H]1O MCULE-7682114350 [2,0,0,0,0,0|2,0,0]=4 1190 B7R1.4 N[C@H]1CCC[C@@H]1O MCULE-8554796061 [2,0,0,0,0,0|2,0,0]=4 1191 B7R1.4 N[C@H]1CCC[C@@H]1O MCULE-9329258920 [2,0,0,0,0,0|2,0,0]=4 1192 B7R1.4 N[C@H]1CCC[C@H]1O MCULE-1156997833 [2,0,0,0,0,0|2,0,0]=4 1193 B7R1.4 N[C@H]1CCC[C@H]1O MCULE-2524879699 [2,0,0,0,0,0|2,0,0]=4 1194 B7R1.4 N[C@H]1CCC[C@H]1O MCULE-7034968971 [2,0,0,0,0,0|2,0,0]=4 1195 B7R1.4 N[C@H]1CCC[C@H]1O MCULE-9262461574 [2,0,0,0,0,0|2,0,0]=4 1196 B7R1.4 N[C@H]1CCC[C@H]1O MCULE-9904485750 [2,0,0,0,0,0|2,0,0]=4 1197 B7R1.4 N[C@H]1COC[C@@H]1O MCULE-1604156911 [2,0,0,0,0,0|2,0,0]=4 1198 B7R1.4 N[C@H]1COC[C@@H]1O MCULE-3157811195 [2,0,0,0,0,0|2,0,0]=4 1199 B7R1.4 N[C@H]1COC[C@@H]1O MCULE-4377495223 [2,0,0,0,0,0|2,0,0]=4 1200 B7R1.4 N[C@H]1COC[C@@H]1O MCULE-8412403655 [2,0,0,0,0,0|2,0,0]=4 1201 B7R1.4 N[C@H]1COC[C@H]1O MCULE-5907972681 [2,0,0,0,0,0|2,0,0]=4 1202 B7R1.4 N[C@H]1COC[C@H]1O MCULE-7502895716 [2,0,0,0,0,0|2,0,0]=4 1203 B7R1.4 N[C@H]1COC[C@H]1O MCULE-8985833831 [2,0,0,0,0,0|2,0,0]=4 1204 B7R1.4 N[C@H]1COC[C@H]1O MCULE-9971794275 [2,0,0,0,0,0|2,0,0]=4 1205 B7R1.4 O=C1NCCC1O MCULE-8818841339 [2,0,0,0,0,0|0,0,2]=4 1206 B7R1.4 O=C1NCCC1O MCULE-9662824811 [2,0,0,0,0,0|0,0,2]=4 1207 B7R1.4 O=C1NCC[C@@H]1O MCULE-3212474164 [2,0,0,0,0,0|0,0,2]=4 1208 B7R1.4 O=C1NCC[C@@H]1O MCULE-7816291255 [2,0,0,0,0,0|0,0,2]=4 1209 B7R1.4 O=C1NCC[C@H]1O MCULE-1281835510 [2,0,0,0,0,0|0,0,2]=4 1210 B7R1.4 O=C1NCC[C@H]1O MCULE-6809356348 [2,0,0,0,0,0|0,0,2]=4 1211 B7R1.4 OC1CCCC1Br MCULE-9027030471 [2,0,0,0,0,0|2,0,0]=4 1212 B7R1.4 OC1CCCC1Cl MCULE-5561130140 [2,0,0,0,0,0|2,0,0]=4 1213 B7R1.4 OC1CCCC1F MCULE-9111039481 [2,0,0,0,0,0|2,0,0]=4 1214 B7R1.4 OC1CCCC1O MCULE-2003945768 [2,0,0,0,0,0|1,0,0]=3 1215 B7R1.4 OC1CNCC1Br MCULE-1241091506 [2,0,0,0,0,0|1,0,0]=3 1216 B7R1.4 OC1CNCC1Br MCULE-4889737174 [2,0,0,0,0,0|1,0,0]=3 1217 B7R1.4 OC1CNCC1F MCULE-3412240528 [2,0,0,0,0,0|1,0,0]=3 1218 B7R1.4 OC1CNCC1F MCULE-7214807363 [2,0,0,0,0,0|1,0,0]=3 1219 B7R1.4 OC1CNCC1O MCULE-4416566731 [2,0,0,0,0,0|0,0,0]=2 1220 B7R1.4 OC1CNCC1O MCULE-7287658845 [2,0,0,0,0,0|0,0,0]=2 1221 B7R1.4 OC1COCC1Br MCULE-8642236751 [2,0,0,0,0,0|2,0,0]=4 1222 B7R1.4 OC1COCC1F MCULE-3255803142 [2,0,0,0,0,0|2,0,0]=4 1223 B7R1.4 OC1COCC1O MCULE-2982401803 [2,0,0,0,0,0|1,0,0]=3 1224 B7R1.4 O[C@@H]1CCC[C@H]1Cl MCULE-5851051143 [2,0,0,0,0,0|2,0,0]=4 1225 B7R1.4 O[C@@H]1CCC[C@H]1Cl MCULE-6816188915 [2,0,0,0,0,0|2,0,0]=4 1226 B7R1.4 O[C@@H]1CCC[C@H]1F MCULE-6825738824 [2,0,0,0,0,0|2,0,0]=4 1227 B7R1.4 O[C@@H]1CCC[C@H]1O MCULE-3171045763 [2,0,0,0,0,0|1,0,0]=3 1228 B7R1.4 O[C@@H]1CCC[C@H]1O MCULE-4369287998 [2,0,0,0,0,0|1,0,0]=3 1229 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-4544085940 [2,0,0,0,0,0|1,0,0]=3 1230 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-6356393045 [2,0,0,0,0,0|1,0,0]=3 1231 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-7332143154 [2,0,0,0,0,0|1,0,0]=3 1232 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-8032995983 [2,0,0,0,0,0|1,0,0]=3 1233 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-8052505932 [2,0,0,0,0,0|1,0,0]=3 1234 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-8564653401 [2,0,0,0,0,0|1,0,0]=3 1235 B7R1.4 O[C@@H]1CNC[C@H]1F MCULE-2691246784 [2,0,0,0,0,0|1,0,0]=3 1236 B7R1.4 O[C@@H]1CNC[C@H]1F MCULE-7250968554 [2,0,0,0,0,0|1,0,0]=3 1237 B7R1.4 O[C@@H]1CNC[C@H]1F MCULE-8439784112 [2,0,0,0,0,0|1,0,0]=3 1238 B7R1.4 O[C@@H]1CNC[C@H]1F MCULE-8682802807 [2,0,0,0,0,0|1,0,0]=3 1239 B7R1.4 O[C@@H]1CNC[C@H]1O MCULE-2199886254 [2,0,0,0,0,0|0,0,0]=2 1240 B7R1.4 O[C@@H]1CNC[C@H]1O MCULE-3341203076 [2,0,0,0,0,0|0,0,0]=2 1241 B7R1.4 O[C@@H]1CNC[C@H]1O MCULE-5521619072 [2,0,0,0,0,0|0,0,0]=2 1242 B7R1.4 O[C@@H]1COC[C@H]1F MCULE-2460253154 [2,0,0,0,0,0|2,0,0]=4 1243 B7R1.4 O[C@@H]1COC[C@H]1F MCULE-3624406213 [2,0,0,0,0,0|2,0,0]=4 1244 B7R1.4 O[C@@H]1COC[C@H]1O MCULE-5846282762 [2,0,0,0,0,0|1,0,0]=3 1245 B7R1.4 O[C@H]1CCC[C@@H]1F MCULE-5487297072 [2,0,0,0,0,0|2,0,0]=4 1246 B7R1.4 O[C@H]1CCC[C@@H]1O MCULE-4051443060 [2,0,0,0,0,0|1,0,0]=3 1247 B7R1.4 O[C@H]1CCC[C@@H]1O MCULE-4644231649 [2,0,0,0,0,0|1,0,0]=3 1248 B7R1.4 O[C@H]1CCC[C@@H]1O MCULE-6847877597 [2,0,0,0,0,0|1,0,0]=3 1249 B7R1.4 O[C@H]1CCC[C@H]1Br MCULE-2758354858 [2,0,0,0,0,0|2,0,0]=4 1250 B7R1.4 O[C@H]1CCC[C@H]1Cl MCULE-6157730443 [2,0,0,0,0,0|2,0,0]=4 1251 B7R1.4 O[C@H]1CCC[C@H]1Cl MCULE-8785327416 [2,0,0,0,0,0|2,0,0]=4 1252 B7R1.4 O[C@H]1CCC[C@H]1O MCULE-7305350842 [2,0,0,0,0,0|1,0,0]=3 1253 B7R1.4 O[C@H]1CNC[C@@H]1F MCULE-3839318633 [2,0,0,0,0,0|1,0,0]=3 1254 B7R1.4 O[C@H]1CNC[C@@H]1F MCULE-4218821429 [2,0,0,0,0,0|1,0,0]=3 1255 B7R1.4 O[C@H]1CNC[C@@H]1F MCULE-7845583982 [2,0,0,0,0,0|1,0,0]=3 1256 B7R1.4 O[C@H]1CNC[C@@H]1F MCULE-9325791348 [2,0,0,0,0,0|1,0,0]=3 1257 B7R1.4 O[C@H]1CNC[C@@H]1O MCULE-5585016580 [2,0,0,0,0,0|0,0,0]=2 1258 B7R1.4 O[C@H]1CNC[C@@H]1O MCULE-6252837981 [2,0,0,0,0,0|0,0,0]=2 1259 B7R1.4 O[C@H]1CNC[C@@H]1O MCULE-7474807017 [2,0,0,0,0,0|0,0,0]=2 1260 B7R1.4 O[C@H]1CNC[C@@H]1O MCULE-8814174366 [2,0,0,0,0,0|0,0,0]=2 1261 B7R1.4 O[C@H]1CNC[C@@H]1O MCULE-9936814184 [2,0,0,0,0,0|0,0,0]=2 1262 B7R1.4 O[C@H]1CNC[C@H]1F MCULE-2104048645 [2,0,0,0,0,0|1,0,0]=3 1263 B7R1.4 O[C@H]1CNC[C@H]1F MCULE-5086480017 [2,0,0,0,0,0|1,0,0]=3 1264 B7R1.4 O[C@H]1CNC[C@H]1F MCULE-5328004683 [2,0,0,0,0,0|1,0,0]=3 1265 B7R1.4 O[C@H]1CNC[C@H]1F MCULE-5990996560 [2,0,0,0,0,0|1,0,0]=3 1266 B7R1.4 O[C@H]1CNC[C@H]1O MCULE-8087937166 [2,0,0,0,0,0|0,0,0]=2 1267 B7R1.4 O[C@H]1CNC[C@H]1O MCULE-9522092804 [2,0,0,0,0,0|0,0,0]=2 1268 B7R1.4 O[C@H]1COC[C@@H]1F MCULE-7724910066 [2,0,0,0,0,0|2,0,0]=4 1269 B7R1.4 O[C@H]1COC[C@@H]1O MCULE-2140544466 [2,0,0,0,0,0|1,0,0]=3 1270 B7R1.4 O[C@H]1COC[C@@H]1O MCULE-9526811966 [2,0,0,0,0,0|1,0,0]=3 1271 B7R1.4 O[C@H]1COC[C@H]1O MCULE-2862505352 [2,0,0,0,0,0|1,0,0]=3 1272 B7R1.4 [C@@H]1(CCC[C@H]1N)C MCULE-2430440513 [2,0,0,0,0,0|2,0,0]=4 1273 B7R1.4 [C@@H]1(CCC[C@H]1N)C MCULE-8503171996 [2,0,0,0,0,0|2,0,0]=4 1274 B7R1.4 [C@@H]1(CNC[C@@H]1O)O MCULE-2661544949 [2,0,0,0,0,0|0,0,0]=2 1275 B7R1.4 [C@H]1(CNC[C@H]1F)O MCULE-1484680203 [2,0,0,0,0,0|1,0,0]=3 1276 B7R1.4 [C@H]1(CNC[C@H]1F)O MCULE-7754900549 [2,0,0,0,0,0|1,0,0]=3 1277 B7R1.4 [NH3+][C@@H]1CSC[C@@H]1O MCULE-5747970201 [2,0,0,0,0,0|2,0,0]=4 1278 B7R1.4 [NH3+][C@@H]1CSC[C@H]1O MCULE-4897701746 [2,0,0,0,0,0|2,0,0]=4 1279 B9R0.6 C[C@H](O)[C@@H](O)[C@@H](O)CC=O MCULE-2872306796 [0,1,1,0,0,0|1,0,1]=4 1280 B9R0.6 C[C@H](O)[C@H](O)[C@@H](N)CC=O MCULE-2681463079 [0,1,1,0,0,0|0,0,1]=3 1281 B9R0.6 C[C@H](O)[C@H](O)[C@@H](N)CC=O MCULE-3703407559 [0,1,1,0,0,0|0,0,1]=3 1282 B9R0.25 CC(CO)C(O)C(C)(C)C MCULE-9367736640 [0,1,1,0,0,0|2,0,0]=4 1283 B9R0.27 O=C(CO)C(O)C(O)CO MCULE-8935556784 [0,1,1,0,0,0|1,0,1]=4 1284 B9R0.27 O=C(CO)[C@@H](O)[C@@H](O)CO MCULE-2725905076 [0,1,1,0,0,0|1,0,1]=4 1285 B9R0.27 O=C(CO)[C@@H](O)[C@@H](O)CO MCULE-9876605173 [0,1,1,0,0,0|1,0,1]=4 1286 B9R0.27 O=C(CO)[C@@H](O)[C@H](O)CO MCULE-7865729102 [0,1,1,0,0,0|1,0,1]=4 1287 B9R0.27 O=C(CO)[C@@H](O)[C@H](O)CO MCULE-9552269577 [0,1,1,0,0,0|1,0,1]=4 1288 B9R0.27 O=C(CO)[C@H](O)[C@@H](O)CO MCULE-2032052659 [0,1,1,0,0,0|1,0,1]=4 1289 B9R0.27 O=C(CO)[C@H](O)[C@H](O)CO MCULE-5136624528 [0,1,1,0,0,0|1,0,1]=4 1290 B9R0.27 O=CC(O)C(O)C(O)CO MCULE-9562771067 [0,1,1,0,0,0|1,0,1]=4 1291 B9R0.27 O=C[C@@H](O)[C@@H](O)[C@@H](O)CO MCULE-1120126008 [0,1,1,0,0,0|1,0,1]=4 1292 B9R0.27 O=C[C@@H](O)[C@@H](O)[C@@H](O)CO MCULE-2723797968 [0,1,1,0,0,0|1,0,1]=4 1293 B9R0.27 O=C[C@@H](O)[C@@H](O)[C@H](O)CO MCULE-1190384749 [0,1,1,0,0,0|1,0,1]=4 1294 B9R0.27 O=C[C@@H](O)[C@@H](O)[C@H](O)CO MCULE-2266732421 [0,1,1,0,0,0|1,0,1]=4 1295 B9R0.27 O=C[C@@H](O)[C@H](O)[C@@H](O)CO MCULE-1097497548 [0,1,1,0,0,0|1,0,1]=4 1296 B9R0.27 O=C[C@@H](O)[C@H](O)[C@@H](O)CO MCULE-7909984167 [0,1,1,0,0,0|1,0,1]=4 1297 B9R0.27 O=C[C@@H](O)[C@H](O)[C@H](O)CO MCULE-1895838145 [0,1,1,0,0,0|1,0,1]=4 1298 B9R0.27 O=C[C@@H](O)[C@H](O)[C@H](O)CO MCULE-7112552451 [0,1,1,0,0,0|1,0,1]=4 1299 B9R0.27 O=C[C@H](O)[C@@H](O)[C@@H](O)CO MCULE-2590073916 [0,1,1,0,0,0|1,0,1]=4 1300 B9R0.27 O=C[C@H](O)[C@@H](O)[C@@H](O)CO MCULE-9133960721 [0,1,1,0,0,0|1,0,1]=4 1301 B9R0.27 O=C[C@H](O)[C@@H](O)[C@H](O)CO MCULE-2277980048 [0,1,1,0,0,0|1,0,1]=4 1302 B9R0.27 O=C[C@H](O)[C@@H](O)[C@H](O)CO MCULE-2928575905 [0,1,1,0,0,0|1,0,1]=4 1303 B9R0.27 O=C[C@H](O)[C@H](O)[C@@H](O)CO MCULE-4972279660 [0,1,1,0,0,0|1,0,1]=4 1304 B9R0.27 O=C[C@H](O)[C@H](O)[C@@H](O)CO MCULE-6692095263 [0,1,1,0,0,0|1,0,1]=4 1305 B9R0.27 O=C[C@H](O)[C@H](O)[C@H](O)CO MCULE-7503149757 [0,1,1,0,0,0|1,0,1]=4 1306 B9R0.27 O=C[C@H](O)[C@H](O)[C@H](O)CO MCULE-9189507099 [0,1,1,0,0,0|1,0,1]=4 1307 B9R0.27 O=C[C@H](O)[C@H](O)[C@H](O)CO MCULE-9734013313 [0,1,1,0,0,0|1,0,1]=4 1308 B9R0.27 OCC(O)C(O)C(O)CO MCULE-9129572486 [0,1,1,0,0,0|1,0,0]=3 1309 B9R0.27 OC[C@@H](O)C(O)[C@H](O)CO MCULE-8306941933 [0,1,1,0,0,0|1,0,0]=3 1310 B9R0.27 OC[C@@H](O)C(O)[C@H](O)CO MCULE-9668936414 [0,1,1,0,0,0|1,0,0]=3 1311 B9R0.27 OC[C@H](O)C(O)[C@@H](O)CO MCULE-6137228639 [0,1,1,0,0,0|1,0,0]=3 1312 B9R0.27 OC[C@H](O)C(O)[C@@H](O)CO MCULE-9731864914 [0,1,1,0,0,0|1,0,0]=3 1313 B9R0.27 OC[C@H](O)[C@@H](O)[C@H](O)CO MCULE-6476329373 [0,1,1,0,0,0|1,0,0]=3 1314 B9R0.27 OC[C@H](O)[C@H](O)[C@H](O)CO MCULE-5168116503 [0,1,1,0,0,0|1,0,0]=3 1315 B9R0.32 CC(C)C(O)C(C)(C)CO MCULE-3777364262 [0,1,1,0,0,0|2,0,0]=4 1316 B9R0.32 CC(C)C(O)C(C)(C)CO MCULE-8458650598 [0,1,1,0,0,0|2,0,0]=4 1317 B9R0.79 CC(C)C(O)C(N)C(=O)O MCULE-8766263714 [0,1,1,0,0,0|1,0,1]=4 1318 B9R0.79 CC(C)C(O)[C@H](N)C(=O)O MCULE-5332720895 [0,1,1,0,0,0|1,0,1]=4 1319 B9R0.79 CC(C)[C@@H](O)[C@@H](N)C(=O)O MCULE-2425417830 [0,1,1,0,0,0|1,0,1]=4 1320 B9R0.79 CC(C)[C@@H](O)[C@H](N)C(=O)O MCULE-5438285037 [0,1,1,0,0,0|1,0,1]=4 1321 B9R0.79 CC(C)[C@@H](O)[C@H](N)C(=O)O MCULE-6278820254 [0,1,1,0,0,0|1,0,1]=4 1322 B9R0.79 CC(C)[C@@H](O)[C@H](N)C(=O)O MCULE-7542741263 [0,1,1,0,0,0|1,0,1]=4 1323 B9R0.79 CC(C)[C@@H](O)[C@H](N)C(=O)O MCULE-8101644962 [0,1,1,0,0,0|1,0,1]=4 1324 B9R0.79 CC(C)[C@H](O)[C@@H](N)C(=O)O MCULE-6429723072 [0,1,1,0,0,0|1,0,1]=4 1325 B9R0.79 CC(C)[C@H](O)[C@@H](N)C(=O)O MCULE-8455636907 [0,1,1,0,0,0|1,0,1]=4 1326 B9R0.79 CC(C)[C@H](O)[C@H](N)C(=O)O MCULE-9657202987 [0,1,1,0,0,0|1,0,1]=4 1327 B9R0.79 CC(C)[C@H](O)[C@H](N)C(=O)O MCULE-9762128000 [0,1,1,0,0,0|1,0,1]=4 1328 B9R0.79 CC(O)C(C)C(N)C(=O)O MCULE-2897656809 [0,1,1,0,0,0|1,0,1]=4 1329 B9R0.79 CC(O)[C@H](C)[C@H](N)C(=O)O MCULE-6535308910 [0,1,1,0,0,0|1,0,1]=4 1330 B9R0.79 CC(O)[C@H](C)[C@H](N)C(=O)O MCULE-8450789997 [0,1,1,0,0,0|1,0,1]=4 1331 B9R0.79 C[C@H](O)[C@H](C)[C@H](N)C(=O)O MCULE-1376333194 [0,1,1,0,0,0|1,0,1]=4 1332 B9R0.79 C[C@H](O)[C@H](C)[C@H](N)C(=O)O MCULE-4005119004 [0,1,1,0,0,0|1,0,1]=4 1333 B9R0.79 [C@@H](N)(C(=O)O)[C@@H](C)C(C)O MCULE-7488780154 [0,1,1,0,0,0|1,0,1]=4 1334 B9R0.8 COCCC(O)C(O)CO MCULE-8755237951 [0,1,1,0,0,0|1,0,0]=3 1335 B9R0.8 COCC[C@H](O)[C@H](O)CO MCULE-6552589711 [0,1,1,0,0,0|1,0,0]=3 1336 B9R0.23 O=C(O)C[C@@H](O)[C@@H](O)CO MCULE-5394522095 [0,1,1,0,0,0|1,0,1]=4 1337 B9R0.23 O=C(O)C[C@H](O)[C@H](O)CO MCULE-2704229472 [0,1,1,0,0,0|1,0,1]=4 1338 B9R0.37 CCCC(O)C(CC)CO MCULE-4462593004 [0,1,1,0,0,0|2,0,0]=4 1339 B9R0.1 CC(C)COCC(O)CO MCULE-6665926443 [0,1,1,0,0,0|2,0,0]=4 1340 B9R0.1 O=C(O)CCCC(O)CO MCULE-8338266320 [0,1,1,0,0,0|1,0,1]=4 1341 B9R0.5 CCCCCC(O)CCO MCULE-7307683143 [0,1,1,0,0,0|2,0,0]=4 1342 B9R0.24 O=C(CCl)NCC(O)CO MCULE-8204242344 [0,1,1,0,0,0|1,0,1]=4 1343 B9R0.46 C=CCCCCC(O)CO MCULE-9731075660 [0,1,1,0,0,0|2,0,0]=4 1344 B9R0.46 CCCCCCC(O)CO MCULE-7396593748 [0,1,1,0,0,0|2,0,0]=4 1345 B9R0.46 CCCCCC[C@@H](O)CO MCULE-9540453574 [0,1,1,0,0,0|2,0,0]=4 1346 B9R0.46 CCCCCC[C@H](O)CO MCULE-8481484883 [0,1,1,0,0,0|2,0,0]=4 1347 B9R0.46 CCCCOCC(O)CO MCULE-8662748140 [0,1,1,0,0,0|2,0,0]=4 1348 B9R0.46 CCCCSCC(O)CO MCULE-8665487683 [0,1,1,0,0,0|2,0,0]=4 1349 B9R0.46 COCCOCC(O)CCl MCULE-7963737892 [0,1,1,0,0,0|2,0,0]=4 1350 B9R0.46 OCCCCCC(O)CO MCULE-1241763539 [0,1,1,0,0,0|1,0,0]=3 1351 B9R0.50 CCCCCC(CO)CO MCULE-5254181477 [0,1,1,0,0,0|2,0,0]=4 1352 B9R0.50 COC(CNCCO)OC MCULE-9307979744 [0,1,1,0,0,0|2,0,0]=4 1353 B9R0.50 NCCCCC(CO)CO MCULE-9856529758 [0,1,1,0,0,0|2,0,0]=4 1354 B9R0.40 CCCC(CC)NCCO MCULE-5041998971 [0,1,1,0,0,0|2,0,0]=4 1355 B9R0.43 CCC(CO)CCC(C)O MCULE-3799427279 [0,1,1,0,0,0|2,0,0]=4 1356 B9R1.7 COCC1CC(CN1)O MCULE-1719796553 [1,1,0,0,0,0|0,0,0]=2 1357 B9R1.7 COCC1CC(CN1)O MCULE-2828004706 [1,1,0,0,0,0|0,0,0]=2 1358 B9R1.7 COC[C@@H]1C[C@@H](CN1)O MCULE-4903855773 [1,1,0,0,0,0|0,0,0]=2 1359 B9R1.7 COC[C@@H]1C[C@@H](CN1)O MCULE-5035930973 [1,1,0,0,0,0|0,0,0]=2 1360 B9R1.7 COC[C@@H]1C[C@H](CN1)O MCULE-1656210028 [1,1,0,0,0,0|0,0,0]=2 1361 B9R1.7 COC[C@@H]1C[C@H](CN1)O MCULE-8717772588 [1,1,0,0,0,0|0,0,0]=2 1362 B9R1.7 COC[C@H]1C[C@H](CN1)O MCULE-7483280166 [1,1,0,0,0,0|0,0,0]=2 1363 B9R1.7 COC[C@H]1C[C@H](CN1)O MCULE-7672691308 [1,1,0,0,0,0|0,0,0]=2 1364 B9R1.7 NCCC1CC[C@H](C1)O MCULE-3758609813 [1,1,0,0,0,0|2,0,0]=4 1365 B9R1.7 NCC[C@H]1CC[C@H](C1)O MCULE-7245034683 [1,1,0,0,0,0|2,0,0]=4 1366 B9R1.21 C#CC1CCC(C1)CO MCULE-1991499886 [1,1,0,0,0,0|2,0,0]=4 1367 B9R1.21 CO[C@H]1CN[C@@H](C1)CO MCULE-2365069332 [1,1,0,0,0,0|0,0,0]=2 1368 B9R1.21 OCC1CCC(N1)CO MCULE-1103775354 [1,1,0,0,0,0|2,0,0]=4 1369 B9R1.21 OCC1CCC(O1)CO MCULE-3334782559 [1,1,0,0,0,0|2,0,0]=4 1370 B9R1.21 OCC1CNC(C1)CO MCULE-7672485489 [1,1,0,0,0,0|0,0,0]=2 1371 B9R1.21 OCC1CNC(C1)CO MCULE-7965706550 [1,1,0,0,0,0|0,0,0]=2 1372 B9R1.21 OC[C@@H]1CC[C@@H](O1)CO MCULE-5217154467 [1,1,0,0,0,0|2,0,0]=4 1373 B9R1.22 CN1CC(CC1CN)O MCULE-7600471860 [1,1,0,0,0,0|1,0,0]=3 1374 B9R1.22 CN1CC(CC1CO)N MCULE-1845795343 [1,1,0,0,0,0|1,0,0]=3 1375 B9R1.22 CN1CC(CC1CO)O MCULE-2631177865 [1,1,0,0,0,0|0,0,0]=2 1376 B9R1.22 CN1CC(CC1CO)O MCULE-7941036683 [1,1,0,0,0,0|0,0,0]=2 1377 B9R1.22 CN1C[C@@H](C[C@H]1CO)F MCULE-3142904022 [1,1,0,0,0,0|1,0,0]=3 1378 B9R1.22 CN1C[C@@H](C[C@H]1CO)F MCULE-4168126464 [1,1,0,0,0,0|1,0,0]=3 1379 B9R1.22 CN1C[C@@H](C[C@H]1CO)N MCULE-6364925454 [1,1,0,0,0,0|1,0,0]=3 1380 B9R1.22 CN1C[C@@H](C[C@H]1CO)N MCULE-7340998334 [1,1,0,0,0,0|1,0,0]=3 1381 B9R1.22 CN1C[C@@H](C[C@H]1CO)O MCULE-6835957451 [1,1,0,0,0,0|0,0,0]=2 1382 B9R1.22 CN1C[C@@H](C[C@H]1CO)O MCULE-6937864936 [1,1,0,0,0,0|0,0,0]=2 1383 B9R1.22 CN1C[C@@H](C[C@H]1CO)O MCULE-7885385401 [1,1,0,0,0,0|0,0,0]=2 1384 B9R1.22 CN1C[C@@H](C[C@H]1CO)O MCULE-9581024864 [1,1,0,0,0,0|0,0,0]=2 1385 B9R1.22 CN1C[C@H](C[C@H]1CO)F MCULE-4625607347 [1,1,0,0,0,0|1,0,0]=3 1386 B9R1.22 CN1C[C@H](C[C@H]1CO)F MCULE-8259673538 [1,1,0,0,0,0|1,0,0]=3 1387 B9R1.22 CN1C[C@H](C[C@H]1CO)N MCULE-1031920182 [1,1,0,0,0,0|1,0,0]=3 1388 B9R1.22 CN1C[C@H](C[C@H]1CO)N MCULE-5184140250 [1,1,0,0,0,0|1,0,0]=3 1389 B9R1.22 CN1C[C@H](C[C@H]1CO)O MCULE-6254507858 [1,1,0,0,0,0|0,0,0]=2 1390 B9R1.22 NC1CC(C(C1)CO)O MCULE-6483016480 [1,1,0,0,0,0|2,0,0]=4 1391 B9R1.22 NC1CC(C(C1)CO)O MCULE-7351789396 [1,1,0,0,0,0|2,0,0]=4 1392 B9R1.22 N[C@H]1C[C@@H]([C@@H](C1)CO)O MCULE-1625502283 [1,1,0,0,0,0|2,0,0]=4 1393 B9R1.22 N[C@H]1C[C@@H]([C@@H](C1)CO)O MCULE-2916623249 [1,1,0,0,0,0|2,0,0]=4 1394 B9R1.22 N[C@H]1C[C@@H]([C@@H](C1)CO)O MCULE-3265275024 [1,1,0,0,0,0|2,0,0]=4 1395 B9R1.22 N[C@H]1C[C@@H]([C@@H](C1)CO)O MCULE-5953198671 [1,1,0,0,0,0|2,0,0]=4 1396 B9R1.22 N[C@H]1C[C@@H]([C@@H](C1)CO)O MCULE-6935436356 [1,1,0,0,0,0|2,0,0]=4 1397 B9R1.22 N[C@H]1C[C@@H]([C@@H](C1)CO)O MCULE-8122722811 [1,1,0,0,0,0|2,0,0]=4 1398 B9R1.22 OCC1OC(CC1O)O MCULE-1321369472 [1,1,0,0,0,0|2,0,0]=4 1399 B9R1.22 OC[C@@H]1OC(C[C@H]1O)O MCULE-2396008864 [1,1,0,0,0,0|2,0,0]=4 1400 B9R1.22 OC[C@@H]1OC(C[C@H]1O)O MCULE-3186725991 [1,1,0,0,0,0|2,0,0]=4 1401 B9R1.22 OC[C@@H]1OC(C[C@H]1O)O MCULE-8127322430 [1,1,0,0,0,0|2,0,0]=4 1402 B9R1.22 OC[C@H]1OC(C[C@@H]1O)O MCULE-5678157789 [1,1,0,0,0,0|2,0,0]=4 1403 B9R1.23 OCC1CC(C(O1)O)O MCULE-1894937679 [1,1,0,0,0,0|1,0,0]=3 1404 B9R1.35 CC1CNC(C1)C(=O)O MCULE-5999128275 [1,1,0,0,0,0|1,0,1]=4 1405 B9R1.35 CC1CNC(C1)C(=O)O MCULE-9035040660 [1,1,0,0,0,0|1,0,1]=4 1406 B9R1.35 C[C@@H]1CN[C@@H](C1)C(=O)O MCULE-1541572989 [1,1,0,0,0,0|1,0,1]=4 1407 B9R1.35 C[C@@H]1CN[C@@H](C1)C(=O)O MCULE-1821254522 [1,1,0,0,0,0|1,0,1]=4 1408 B9R1.35 C[C@@H]1CN[C@@H](C1)C(=O)O MCULE-7426280517 [1,1,0,0,0,0|1,0,1]=4 1409 B9R1.35 C[C@@H]1CN[C@@H](C1)C(=O)O MCULE-8599307960 [1,1,0,0,0,0|1,0,1]=4 1410 B9R1.35 C[C@H]1CN[C@@H](C1)C(=O)O MCULE-2036600768 [1,1,0,0,0,0|1,0,1]=4 1411 B9R1.35 C[C@H]1CN[C@@H](C1)C(=O)O MCULE-4646350445 [1,1,0,0,0,0|1,0,1]=4 1412 B9R1.35 C[C@H]1CN[C@H](C1)C(=O)O MCULE-2974063836 [1,1,0,0,0,0|1,0,1]=4 1413 B9R1.35 C[C@H]1CN[C@H](C1)C(=O)O MCULE-7564386283 [1,1,0,0,0,0|1,0,1]=4 1414 B9R1.35 NC(=O)C1CC(CN1)O MCULE-8628888959 [1,1,0,0,0,0|0,0,2]=4 1415 B9R1.35 NC(=O)C1CC(CN1)O MCULE-9327040437 [1,1,0,0,0,0|0,0,2]=4 1416 B9R1.35 NC(=O)[C@@H]1C[C@@H](CN1)O MCULE-1506534259 [1,1,0,0,0,0|0,0,2]=4 1417 B9R1.35 NC(=O)[C@@H]1C[C@@H](CN1)O MCULE-4335155413 [1,1,0,0,0,0|0,0,2]=4 1418 B9R1.35 NC(=O)[C@@H]1C[C@H](CN1)O MCULE-1442980635 [1,1,0,0,0,0|0,0,2]=4 1419 B9R1.35 NC(=O)[C@@H]1C[C@H](CN1)O MCULE-4854132547 [1,1,0,0,0,0|0,0,2]=4 1420 B9R1.35 NC(=O)[C@@H]1C[C@H](CN1)O MCULE-8175631848 [1,1,0,0,0,0|0,0,2]=4 1421 B9R1.35 NC(=O)[C@@H]1C[C@H](CN1)O MCULE-9092665787 [1,1,0,0,0,0|0,0,2]=4 1422 B9R1.35 NC(=O)[C@H]1C[C@H](CN1)O MCULE-1212665796 [1,1,0,0,0,0|0,0,2]=4 1423 B9R1.35 NC(=O)[C@H]1C[C@H](CN1)O MCULE-2172080185 [1,1,0,0,0,0|0,0,2]=4 1424 B9R1.35 NC(=O)[C@H]1C[C@H](CN1)O MCULE-2463066874 [1,1,0,0,0,0|0,0,2]=4 1425 B9R1.35 NC(=O)[C@H]1C[C@H](CN1)O MCULE-7245012102 [1,1,0,0,0,0|0,0,2]=4 1426 B9R1.35 NC1CNC(C1)C(=O)O MCULE-1416144501 [1,1,0,0,0,0|1,0,1]=4 1427 B9R1.35 NC1CNC(C1)C(=O)O MCULE-4706388278 [1,1,0,0,0,0|1,0,1]=4 1428 B9R1.35 N[C@@H]1CN[C@@H](C1)C(=O)O MCULE-4990800122 [1,1,0,0,0,0|1,0,1]=4 1429 B9R1.35 N[C@@H]1CN[C@@H](C1)C(=O)O MCULE-5172267597 [1,1,0,0,0,0|1,0,1]=4 1430 B9R1.35 N[C@@H]1CN[C@@H](C1)C(=O)O MCULE-7010431429 [1,1,0,0,0,0|1,0,1]=4 1431 B9R1.35 N[C@@H]1CN[C@@H](C1)C(=O)O MCULE-8754522437 [1,1,0,0,0,0|1,0,1]=4 1432 B9R1.35 N[C@@H]1CN[C@H](C1)C(=O)O MCULE-4906071490 [1,1,0,0,0,0|1,0,1]=4 1433 B9R1.35 N[C@@H]1CN[C@H](C1)C(=O)O MCULE-7656739611 [1,1,0,0,0,0|1,0,1]=4 1434 B9R1.35 N[C@@H]1CN[C@H](C1)C(=O)O MCULE-8732136397 [1,1,0,0,0,0|1,0,1]=4 1435 B9R1.35 N[C@@H]1CN[C@H](C1)C(=O)O MCULE-9871023526 [1,1,0,0,0,0|1,0,1]=4 1436 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-1698400731 [1,1,0,0,0,0|1,0,1]=4 1437 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-1983861108 [1,1,0,0,0,0|1,0,1]=4 1438 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-2838978471 [1,1,0,0,0,0|1,0,1]=4 1439 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-5103662767 [1,1,0,0,0,0|1,0,1]=4 1440 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-5299594489 [1,1,0,0,0,0|1,0,1]=4 1441 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-6235136925 [1,1,0,0,0,0|1,0,1]=4 1442 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-8629641721 [1,1,0,0,0,0|1,0,1]=4 1443 B9R1.35 N[C@H]1CN[C@H](C1)C(=O)O MCULE-2973551231 [1,1,0,0,0,0|1,0,1]=4 1444 B9R1.35 N[C@H]1CN[C@H](C1)C(=O)O MCULE-3190600485 [1,1,0,0,0,0|1,0,1]=4 1445 B9R1.35 O=C(O)C1CC(CN1)Br MCULE-3420644560 [1,1,0,0,0,0|1,0,1]=4 1446 B9R1.35 O=C(O)C1CC(CN1)F MCULE-1909829604 [1,1,0,0,0,0|1,0,1]=4 1447 B9R1.35 O=C(O)C1CC(CN1)F MCULE-4908563055 [1,1,0,0,0,0|1,0,1]=4 1448 B9R1.35 O=C(O)C1CC(CN1)O MCULE-3129945874 [1,1,0,0,0,0|0,0,1]=3 1449 B9R1.35 O=C(O)C1CC(CN1)O MCULE-5090896550 [1,1,0,0,0,0|0,0,1]=3 1450 B9R1.35 O=C(O)C1CC(CN1)S MCULE-3928449068 [1,1,0,0,0,0|0,1,1]=4 1451 B9R1.35 O=C(O)C1CC(CN1)S MCULE-7523385510 [1,1,0,0,0,0|0,1,1]=4 1452 B9R1.35 O=C(O)C1CCC(C1)O MCULE-3301759971 [1,1,0,0,0,0|1,0,1]=4 1453 B9R1.35 O=C(O)[C@@H]1CC(CN1)O MCULE-9602889253 [1,1,0,0,0,0|0,0,1]=3 1454 B9R1.35 O=C(O)[C@@H]1CC(CN1)S MCULE-6078892837 [1,1,0,0,0,0|0,1,1]=4 1455 B9R1.35 O=C(O)[C@@H]1CC(CN1)S MCULE-6607761456 [1,1,0,0,0,0|0,1,1]=4 1456 B9R1.35 O=C(O)[C@@H]1CC[C@@H](C1)O MCULE-2017780821 [1,1,0,0,0,0|1,0,1]=4 1457 B9R1.35 O=C(O)[C@@H]1CC[C@@H](C1)O MCULE-8789755356 [1,1,0,0,0,0|1,0,1]=4 1458 B9R1.35 O=C(O)[C@@H]1CC[C@H](C1)O MCULE-6133795580 [1,1,0,0,0,0|1,0,1]=4 1459 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)Br MCULE-2600938020 [1,1,0,0,0,0|1,0,1]=4 1460 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)Br MCULE-3945615781 [1,1,0,0,0,0|1,0,1]=4 1461 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)F MCULE-2626475344 [1,1,0,0,0,0|1,0,1]=4 1462 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)F MCULE-4367319835 [1,1,0,0,0,0|1,0,1]=4 1463 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)F MCULE-9011373659 [1,1,0,0,0,0|1,0,1]=4 1464 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)F MCULE-9484602400 [1,1,0,0,0,0|1,0,1]=4 1465 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)O MCULE-2778155463 [1,1,0,0,0,0|0,0,1]=3 1466 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)O MCULE-3005368457 [1,1,0,0,0,0|0,0,1]=3 1467 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)O MCULE-3510440810 [1,1,0,0,0,0|0,0,1]=3 1468 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)O MCULE-6982589556 [1,1,0,0,0,0|0,0,1]=3 1469 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)O MCULE-8797295826 [1,1,0,0,0,0|0,0,1]=3 1470 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)S MCULE-5195240463 [1,1,0,0,0,0|0,1,1]=4 1471 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)S MCULE-6442187313 [1,1,0,0,0,0|0,1,1]=4 1472 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)S MCULE-6472004515 [1,1,0,0,0,0|0,1,1]=4 1473 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)S MCULE-8668690351 [1,1,0,0,0,0|0,1,1]=4 1474 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)F MCULE-2784186920 [1,1,0,0,0,0|1,0,1]=4 1475 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)F MCULE-5745425542 [1,1,0,0,0,0|1,0,1]=4 1476 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)F MCULE-9253930917 [1,1,0,0,0,0|1,0,1]=4 1477 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)F MCULE-9892414269 [1,1,0,0,0,0|1,0,1]=4 1478 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)O MCULE-4157512603 [1,1,0,0,0,0|0,0,1]=3 1479 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)O MCULE-5389747201 [1,1,0,0,0,0|0,0,1]=3 1480 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)O MCULE-6465399562 [1,1,0,0,0,0|0,0,1]=3 1481 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)O MCULE-7830616263 [1,1,0,0,0,0|0,0,1]=3 1482 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)S MCULE-1140594774 [1,1,0,0,0,0|0,1,1]=4 1483 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)S MCULE-2383846785 [1,1,0,0,0,0|0,1,1]=4 1484 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)S MCULE-2747224270 [1,1,0,0,0,0|0,1,1]=4 1485 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)S MCULE-5598470577 [1,1,0,0,0,0|0,1,1]=4 1486 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)S MCULE-7268471922 [1,1,0,0,0,0|0,1,1]=4 1487 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)S MCULE-9896850390 [1,1,0,0,0,0|0,1,1]=4 1488 B9R1.35 O=C(O)[C@H]1CC[C@@H](C1)O MCULE-3061487094 [1,1,0,0,0,0|1,0,1]=4 1489 B9R1.35 O=C(O)[C@H]1CC[C@@H](C1)O MCULE-8079944181 [1,1,0,0,0,0|1,0,1]=4 1490 B9R1.35 O=C(O)[C@H]1CC[C@H](C1)O MCULE-2713143734 [1,1,0,0,0,0|1,0,1]=4 1491 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)F MCULE-1499004749 [1,1,0,0,0,0|1,0,1]=4 1492 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)F MCULE-4961028667 [1,1,0,0,0,0|1,0,1]=4 1493 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)F MCULE-9323854334 [1,1,0,0,0,0|1,0,1]=4 1494 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)O MCULE-1222229718 [1,1,0,0,0,0|0,0,1]=3 1495 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)O MCULE-1998693022 [1,1,0,0,0,0|0,0,1]=3 1496 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)O MCULE-3836053642 [1,1,0,0,0,0|0,0,1]=3 1497 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)O MCULE-4545441904 [1,1,0,0,0,0|0,0,1]=3 1498 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)O MCULE-8358409700 [1,1,0,0,0,0|0,0,1]=3 1499 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)F MCULE-1326882154 [1,1,0,0,0,0|1,0,1]=4 1500 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)F MCULE-4409765623 [1,1,0,0,0,0|1,0,1]=4 1501 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)F MCULE-5169579313 [1,1,0,0,0,0|1,0,1]=4 1502 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)F MCULE-8834390438 [1,1,0,0,0,0|1,0,1]=4 1503 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)O MCULE-3080568728 [1,1,0,0,0,0|0,0,1]=3 1504 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)O MCULE-4521316626 [1,1,0,0,0,0|0,0,1]=3 1505 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)O MCULE-5972935636 [1,1,0,0,0,0|0,0,1]=3 1506 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)O MCULE-7908625938 [1,1,0,0,0,0|0,0,1]=3 1507 B9R1.35 [C@@H]1(CN[C@H](C1)C(=O)O)O MCULE-3075663401 [1,1,0,0,0,0|0,0,1]=3 1508 B9R1.35 [C@H]1(CN[C@@H](C1)C(=O)O)F MCULE-1784559931 [1,1,0,0,0,0|1,0,1]=4 1509 B9R1.35 [C@H]1(CN[C@@H](C1)C(=O)O)F MCULE-8392302309 [1,1,0,0,0,0|1,0,1]=4 1510 B9R1.35 [C@H]1(CN[C@@H](C1)C(=O)O)S MCULE-7662717521 [1,1,0,0,0,0|0,1,1]=4 1511 B9R1.35 [C@H]1(CN[C@H](C1)C(=O)O)F MCULE-2026019561 [1,1,0,0,0,0|1,0,1]=4 1512 B9R1.35 [C@H]1(CN[C@H](C1)C(=O)O)F MCULE-8023038198 [1,1,0,0,0,0|1,0,1]=4 1513 B9R1.35 [C@H]1(C[C@H](CN1)O)C(=O)O MCULE-3462627258 [1,1,0,0,0,0|0,0,1]=3 1514 B9R1.125 CC1(CC(CN1)O)CO MCULE-2899118253 [1,1,0,0,0,0|0,0,0]=2 1515 B9R1.125 CC1(CC(CN1)O)CO MCULE-8954323319 [1,1,0,0,0,0|0,0,0]=2 1516 B9R1.133 C1(CC(CN1)(F)F)CO MCULE-4519700340 [1,1,0,0,0,0|1,0,0]=3 1517 B9R1.133 C1(CC(CN1)(F)F)CO MCULE-8208172101 [1,1,0,0,0,0|1,0,0]=3 1518 B9R1.133 C1(CCC(C1)(F)F)CO MCULE-3059311962 [1,1,0,0,0,0|2,0,0]=4 1519 B9R1.133 CC1(CNC(C1)CO)C MCULE-2739458307 [1,1,0,0,0,0|1,0,0]=3 1520 B9R1.133 CC1(CNC(C1)CO)C MCULE-7568309276 [1,1,0,0,0,0|1,0,0]=3 1521 B9R1.133 CC1(CNC(C1)CO)C MCULE-9200652792 [1,1,0,0,0,0|1,0,0]=3 1522 B9R1.133 CC1(CN[C@@H](C1)CO)C MCULE-4354389531 [1,1,0,0,0,0|1,0,0]=3 1523 B9R1.133 CC1(CN[C@@H](C1)CO)C MCULE-5413661873 [1,1,0,0,0,0|1,0,0]=3 1524 B9R1.133 CC1(CN[C@@H](C1)CO)C MCULE-6122345231 [1,1,0,0,0,0|1,0,0]=3 1525 B9R1.133 CC1(CN[C@@H](C1)CO)C MCULE-6219822782 [1,1,0,0,0,0|1,0,0]=3 1526 B9R1.133 CC1(CN[C@H](C1)CO)C MCULE-5894469523 [1,1,0,0,0,0|1,0,0]=3 1527 B9R1.133 CC1(CN[C@H](C1)CO)C MCULE-8665542622 [1,1,0,0,0,0|1,0,0]=3 1528 B9R1.133 CC1(COC(C1)CO)C MCULE-6114837538 [1,1,0,0,0,0|2,0,0]=4 1529 B9R1.133 FCC1CC(CN1)(F)F MCULE-5362608324 [1,1,0,0,0,0|2,0,0]=4 1530 B9R1.133 FCC1CC(CN1)(F)F MCULE-8649106177 [1,1,0,0,0,0|2,0,0]=4 1531 B9R1.133 FC[C@@H]1CC(CN1)(F)F MCULE-6994980386 [1,1,0,0,0,0|2,0,0]=4 1532 B9R1.133 FC[C@@H]1CC(CN1)(F)F MCULE-7795441349 [1,1,0,0,0,0|2,0,0]=4 1533 B9R1.133 OCC1CC(CN1)(F)F MCULE-2428727626 [1,1,0,0,0,0|1,0,0]=3 1534 B9R1.133 OCC1CC(CN1)(F)F MCULE-3661500291 [1,1,0,0,0,0|1,0,0]=3 1535 B9R1.133 OCC1CCC(C1)(F)F MCULE-8781082263 [1,1,0,0,0,0|2,0,0]=4 1536 B9R1.133 OC[C@@H]1CC(CN1)(F)F MCULE-1065687078 [1,1,0,0,0,0|1,0,0]=3 1537 B9R1.133 OC[C@@H]1CC(CN1)(F)F MCULE-1385870482 [1,1,0,0,0,0|1,0,0]=3 1538 B9R1.133 OC[C@@H]1CC(CN1)(F)F MCULE-2384042076 [1,1,0,0,0,0|1,0,0]=3 1539 B9R1.133 OC[C@@H]1CC(CN1)(F)F MCULE-6283288203 [1,1,0,0,0,0|1,0,0]=3 1540 B9R1.133 OC[C@@H]1CCC(C1)(F)F MCULE-7426418890 [1,1,0,0,0,0|2,0,0]=4 1541 B9R1.133 OC[C@@H]1CCC(C1)(F)F MCULE-8900624650 [1,1,0,0,0,0|2,0,0]=4 1542 B9R1.133 OC[C@H]1CC(CN1)(F)F MCULE-5851362765 [1,1,0,0,0,0|1,0,0]=3 1543 B9R1.133 OC[C@H]1CC(CN1)(F)F MCULE-7938627949 [1,1,0,0,0,0|1,0,0]=3 1544 B9R1.133 OC[C@H]1CC(CN1)(F)F MCULE-8789515582 [1,1,0,0,0,0|1,0,0]=3 1545 B9R1.133 OC[C@H]1CC(CN1)(F)F MCULE-8852053847 [1,1,0,0,0,0|1,0,0]=3 1546 B9R1.133 OC[C@H]1CCC(C1)(F)F MCULE-3509868652 [1,1,0,0,0,0|2,0,0]=4 1547 B9R1.133 OC[C@H]1CCC(C1)(F)F MCULE-8973296049 [1,1,0,0,0,0|2,0,0]=4 1548 B9R1.133 [C@H]1(CC(CN1)(F)F)CF MCULE-4593084232 [1,1,0,0,0,0|2,0,0]=4 1549 B9R1.133 [C@H]1(CC(CN1)(F)F)CF MCULE-8516100707 [1,1,0,0,0,0|2,0,0]=4 1550 B9R1.14 CCC1NCCC1CO MCULE-7281322099 [1,1,0,0,0,0|1,0,0]=3 1551 B9R1.14 COC1CCCC1CN MCULE-9251673750 [1,1,0,0,0,0|2,0,0]=4 1552 B9R1.14 OCC1CNCC1CO MCULE-3216303466 [1,1,0,0,0,0|2,0,0]=4 1553 B9R1.14 OCC1CNCC1CO MCULE-8556792970 [1,1,0,0,0,0|2,0,0]=4 1554 B9R1.14 OC[C@@H]1CNC[C@@H]1CO MCULE-5441133280 [1,1,0,0,0,0|2,0,0]=4 1555 B9R1.14 OC[C@@H]1CNC[C@@H]1CO MCULE-8785740812 [1,1,0,0,0,0|2,0,0]=4 1556 B9R1.14 OC[C@@H]1CNC[C@H]1CO MCULE-1923940000 [1,1,0,0,0,0|2,0,0]=4 1557 B9R1.14 OC[C@@H]1CNC[C@H]1CO MCULE-8086146822 [1,1,0,0,0,0|2,0,0]=4 1558 B9R1.14 OC[C@H]1CNC[C@@H]1CO MCULE-3807624796 [1,1,0,0,0,0|2,0,0]=4 1559 B9R1.14 OC[C@H]1CNC[C@@H]1CO MCULE-7784303809 [1,1,0,0,0,0|2,0,0]=4 1560 B9R1.24 CC1(CCCC1CO)C MCULE-4941414251 [1,1,0,0,0,0|2,0,0]=4 1561 B9R1.24 CC1(CCCC1CO)N MCULE-2343642043 [1,1,0,0,0,0|2,0,0]=4 1562 B9R1.24 CC1(CCCC1CO)N MCULE-9579192803 [1,1,0,0,0,0|2,0,0]=4 1563 B9R1.24 OCC1CCCC1(F)F MCULE-7160393856 [1,1,0,0,0,0|2,0,0]=4 1564 B9R1.24 OCC1NCCC1(F)F MCULE-2512971507 [1,1,0,0,0,0|1,0,0]=3 1565 B9R1.24 OCC1NCCC1(F)F MCULE-8015196659 [1,1,0,0,0,0|1,0,0]=3 1566 B9R1.33 CC1CCCC1CCO MCULE-1752596263 [1,1,0,0,0,0|2,0,0]=4 1567 B9R1.33 CNCC1CCCC1O MCULE-1707127587 [1,1,0,0,0,0|2,0,0]=4 1568 B9R1.33 COCC1CCCC1N MCULE-2339282845 [1,1,0,0,0,0|2,0,0]=4 1569 B9R1.33 COC[C@@H]1CCC[C@@H]1N MCULE-2489009816 [1,1,0,0,0,0|2,0,0]=4 1570 B9R1.33 COC[C@@H]1CCC[C@@H]1N MCULE-5278260852 [1,1,0,0,0,0|2,0,0]=4 1571 B9R1.33 COC[C@H]1CCC[C@H]1N MCULE-1111361143 [1,1,0,0,0,0|2,0,0]=4 1572 B9R1.33 COC[C@H]1CCC[C@H]1N MCULE-2193207837 [1,1,0,0,0,0|2,0,0]=4 1573 B9R1.33 NC1CCCC1CCO MCULE-4115683269 [1,1,0,0,0,0|2,0,0]=4 1574 B9R1.33 OCCC1CCCC1O MCULE-2038693822 [1,1,0,0,0,0|1,0,0]=3 1575 B9R1.41 CC(C)C1NCCC1O MCULE-2008023517 [1,1,0,0,0,0|1,0,0]=3 1576 B9R1.41 CC(C)C1NCCC1O MCULE-7805481946 [1,1,0,0,0,0|1,0,0]=3 1577 B9R1.41 CC1CCNC1C(=O)O MCULE-3835684911 [1,1,0,0,0,0|1,0,1]=4 1578 B9R1.41 CC1CCNC1C(=O)O MCULE-8361777649 [1,1,0,0,0,0|1,0,1]=4 1579 B9R1.41 C[C@@H]1CCN[C@@H]1C(=O)O MCULE-6239309390 [1,1,0,0,0,0|1,0,1]=4 1580 B9R1.41 C[C@@H]1CCN[C@H]1C(=O)O MCULE-1608471752 [1,1,0,0,0,0|1,0,1]=4 1581 B9R1.41 C[C@@H]1CCN[C@H]1C(=O)O MCULE-2896759092 [1,1,0,0,0,0|1,0,1]=4 1582 B9R1.41 C[C@H]1CCN[C@@H]1C(=O)O MCULE-1694933393 [1,1,0,0,0,0|1,0,1]=4 1583 B9R1.41 C[C@H]1CCN[C@@H]1C(=O)O MCULE-9088637113 [1,1,0,0,0,0|1,0,1]=4 1584 B9R1.41 C[C@H]1CCN[C@H]1C(=O)O MCULE-1449988566 [1,1,0,0,0,0|1,0,1]=4 1585 B9R1.41 NC(=O)C1NCCC1O MCULE-1947851170 [1,1,0,0,0,0|0,0,2]=4 1586 B9R1.41 NC(=O)C1NCCC1O MCULE-8983481897 [1,1,0,0,0,0|0,0,2]=4 1587 B9R1.41 NC(=O)[C@H]1NCC[C@@H]1O MCULE-1119399523 [1,1,0,0,0,0|0,0,2]=4 1588 B9R1.41 NC(=O)[C@H]1NCC[C@@H]1O MCULE-4733398267 [1,1,0,0,0,0|0,0,2]=4 1589 B9R1.41 NC(=O)[C@H]1NCC[C@H]1O MCULE-8085547151 [1,1,0,0,0,0|0,0,2]=4 1590 B9R1.41 NC(=O)[C@H]1NCC[C@H]1O MCULE-8491779714 [1,1,0,0,0,0|0,0,2]=4 1591 B9R1.41 NC1CCNC1C(=O)O MCULE-3789976956 [1,1,0,0,0,0|1,0,1]=4 1592 B9R1.41 NC1CCNC1C(=O)O MCULE-5356536056 [1,1,0,0,0,0|1,0,1]=4 1593 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O MCULE-1080605796 [1,1,0,0,0,0|1,0,1]=4 1594 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O MCULE-5666272526 [1,1,0,0,0,0|1,0,1]=4 1595 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O MCULE-5723263979 [1,1,0,0,0,0|1,0,1]=4 1596 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O MCULE-6574312344 [1,1,0,0,0,0|1,0,1]=4 1597 B9R1.41 O=C(O)C1CCCC1O MCULE-5519958446 [1,1,0,0,0,0|1,0,1]=4 1598 B9R1.41 O=C(O)C1NCCC1F MCULE-2108063646 [1,1,0,0,0,0|1,0,1]=4 1599 B9R1.41 O=C(O)C1NCCC1F MCULE-6901343291 [1,1,0,0,0,0|1,0,1]=4 1600 B9R1.41 O=C(O)C1NCCC1O MCULE-3415911467 [1,1,0,0,0,0|0,0,1]=3 1601 B9R1.41 O=C(O)C1NCCC1O MCULE-3678949962 [1,1,0,0,0,0|0,0,1]=3 1602 B9R1.41 O=C(O)C1NCCC1O MCULE-6594922763 [1,1,0,0,0,0|0,0,1]=3 1603 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1F MCULE-3174474393 [1,1,0,0,0,0|1,0,1]=4 1604 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1F MCULE-5151888407 [1,1,0,0,0,0|1,0,1]=4 1605 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O MCULE-1216340314 [1,1,0,0,0,0|0,0,1]=3 1606 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O MCULE-1564327038 [1,1,0,0,0,0|0,0,1]=3 1607 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O MCULE-8208546333 [1,1,0,0,0,0|0,0,1]=3 1608 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O MCULE-9489383113 [1,1,0,0,0,0|0,0,1]=3 1609 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O MCULE-9999937302 [1,1,0,0,0,0|0,0,1]=3 1610 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1F MCULE-7001095632 [1,1,0,0,0,0|1,0,1]=4 1611 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1F MCULE-7931619369 [1,1,0,0,0,0|1,0,1]=4 1612 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O MCULE-1637514285 [1,1,0,0,0,0|0,0,1]=3 1613 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O MCULE-7041138309 [1,1,0,0,0,0|0,0,1]=3 1614 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O MCULE-9174140225 [1,1,0,0,0,0|0,0,1]=3 1615 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O MCULE-9867563873 [1,1,0,0,0,0|0,0,1]=3 1616 B9R1.41 O=C(O)[C@@H]1[NH2+]CC[C@@H]1O MCULE-4350473030 [1,1,0,0,0,0|0,0,2]=4 1617 B9R1.41 O=C(O)[C@H]1CCC[C@H]1O MCULE-7220456005 [1,1,0,0,0,0|1,0,1]=4 1618 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1F MCULE-1175817797 [1,1,0,0,0,0|1,0,1]=4 1619 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1F MCULE-5823079222 [1,1,0,0,0,0|1,0,1]=4 1620 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1F MCULE-6437141041 [1,1,0,0,0,0|1,0,1]=4 1621 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1F MCULE-8496599400 [1,1,0,0,0,0|1,0,1]=4 1622 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O MCULE-1891620706 [1,1,0,0,0,0|0,0,1]=3 1623 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O MCULE-2757873569 [1,1,0,0,0,0|0,0,1]=3 1624 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O MCULE-2760733859 [1,1,0,0,0,0|0,0,1]=3 1625 B9R1.41 O=C(O)[C@H]1NCC[C@H]1F MCULE-8117073613 [1,1,0,0,0,0|1,0,1]=4 1626 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-2253713572 [1,1,0,0,0,0|0,0,1]=3 1627 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-4523708371 [1,1,0,0,0,0|0,0,1]=3 1628 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-6240521801 [1,1,0,0,0,0|0,0,1]=3 1629 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-6709232399 [1,1,0,0,0,0|0,0,1]=3 1630 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-6746975985 [1,1,0,0,0,0|0,0,1]=3 1631 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-8268334758 [1,1,0,0,0,0|0,0,1]=3 1632 B9R1.41 [C@@H]1(CCN[C@H]1C(=O)O)O MCULE-2060265421 [1,1,0,0,0,0|0,0,1]=3 1633 B9R1.41 [C@@H]1(NCC[C@H]1O)C(=O)O MCULE-1208236317 [1,1,0,0,0,0|0,0,1]=3 1634 B9R1.41 [C@H]1(CCN[C@H]1C(=O)O)O MCULE-3906438921 [1,1,0,0,0,0|0,0,1]=3 1635 B9R1.37 CC1OC(=O)C(C1O)O MCULE-1862325809 [1,1,0,0,0,0|1,0,1]=4 1636 B9R1.37 CC1OC(C(C1O)O)O MCULE-7774087123 [1,1,0,0,0,0|1,0,0]=3 1637 B9R1.37 C[C@@H]1OC(=O)[C@@H]([C@H]1O)O MCULE-3554272195 [1,1,0,0,0,0|1,0,1]=4 1638 B9R1.37 N[C@@H]1C[C@@H]([C@H]([C@H]1O)O)O MCULE-7192019909 [1,1,0,0,0,0|1,0,0]=3 1639 B9R1.37 N[C@@H]1C[C@@H]([C@H]([C@H]1O)O)O MCULE-9128030642 [1,1,0,0,0,0|1,0,0]=3 1640 B11R1.8 OCC1CC(CC(C1O)Cl)Cl MCULE-3853525351 [0,1,0,0,0,1|2,0,0]=4 1641 B11R1.8 OCC1OC(CC(C1O)O)O MCULE-7274763429 [0,1,0,0,0,1|1,0,0]=3 1642 B11R1.8 OC[C@H]1OC(C[C@H]([C@@H]1O)O)O MCULE-5781268479 [0,1,0,0,0,1|1,0,0]=3 1643 B11R1.8 OC[C@H]1OC(C[C@H]([C@@H]1O)O)O MCULE-6452818005 [0,1,0,0,0,1|1,0,0]=3 1644 B11R1.8 OC[C@H]1OC(C[C@H]([C@H]1O)O)O MCULE-2042257317 [0,1,0,0,0,1|1,0,0]=3 1645 B11R1.8 OC[C@H]1OC(C[C@H]([C@H]1O)O)O MCULE-7003907088 [0,1,0,0,0,1|1,0,0]=3 1646 B11R1.278 OCC1NCC(C(C1O)O)O MCULE-8095897922 [0,1,0,0,0,1|0,0,0]=2 1647 B11R1.278 OCC1NCC(C(C1O)O)O MCULE-8945870725 [0,1,0,0,0,1|0,0,0]=2 1648 B11R1.278 OCC1OCC(C(C1O)O)O MCULE-4403765571 [0,1,0,0,0,1|1,0,0]=3 1649 B11R1.278 OCC1OCC([C@H]([C@@H]1O)O)O MCULE-1426082665 [0,1,0,0,0,1|1,0,0]=3 1650 B11R1.278 OC[C@@H]1NC[C@@H]([C@H]([C@@H]1O)O)O MCULE-6816426610 [0,1,0,0,0,1|0,0,0]=2 1651 B11R1.278 OC[C@H]1NC[C@@H]([C@H]([C@@H]1O)O)O MCULE-7821502238 [0,1,0,0,0,1|0,0,0]=2 1652 B11R1.278 OC[C@H]1NC[C@@H]([C@H]([C@@H]1O)O)O MCULE-7929596923 [0,1,0,0,0,1|0,0,0]=2 1653 B11R1.278 OC[C@H]1NC[C@@H]([C@H]([C@@H]1O)O)O MCULE-7935101104 [0,1,0,0,0,1|0,0,0]=2 1654 B11R1.278 OC[C@H]1NC[C@@H]([C@H]([C@@H]1O)O)O MCULE-8897116077 [0,1,0,0,0,1|0,0,0]=2 1655 B11R1.278 OC[C@H]1NC[C@@H]([C@H]([C@H]1O)O)O MCULE-3687609653 [0,1,0,0,0,1|0,0,0]=2 1656 B11R1.278 OC[C@H]1NC[C@@H]([C@H]([C@H]1O)O)O MCULE-3759351391 [0,1,0,0,0,1|0,0,0]=2 1657 B11R1.278 OC[C@H]1NC[C@@H]([C@H]([C@H]1O)O)O MCULE-6717850596 [0,1,0,0,0,1|0,0,0]=2 1658 B11R1.278 OC[C@H]1NC[C@@H]([C@H]([C@H]1O)O)O MCULE-9908232709 [0,1,0,0,0,1|0,0,0]=2 1659 B11R1.278 OC[C@H]1NC[C@H]([C@H]([C@@H]1O)O)O MCULE-1549794897 [0,1,0,0,0,1|0,0,0]=2 1660 B11R1.278 OC[C@H]1NC[C@H]([C@H]([C@@H]1O)O)O MCULE-3347277528 [0,1,0,0,0,1|0,0,0]=2 1661 B11R1.278 OC[C@H]1NC[C@H]([C@H]([C@@H]1O)O)O MCULE-3572681892 [0,1,0,0,0,1|0,0,0]=2 1662 B11R1.278 OC[C@H]1NC[C@H]([C@H]([C@@H]1O)O)O MCULE-4809870237 [0,1,0,0,0,1|0,0,0]=2 1663 B11R1.278 OC[C@H]1OC[C@@H]([C@H]([C@@H]1O)O)O MCULE-1084535328 [0,1,0,0,0,1|1,0,0]=3 1664 B11R1.278 OC[C@H]1OC[C@@H]([C@H]([C@@H]1O)O)O MCULE-3911794509 [0,1,0,0,0,1|1,0,0]=3 1665 B11R1.278 OC[C@H]1OC[C@H]([C@H]([C@@H]1O)O)O MCULE-5628459668 [0,1,0,0,0,1|1,0,0]=3 1666 B11R1.278 OC[C@H]1OC[C@H]([C@H]([C@@H]1O)O)O MCULE-8354002491 [0,1,0,0,0,1|1,0,0]=3 1667 B11R1.278 [C@@H]1(CO[C@@H]([C@@H]([C@@H]1O)O)CO)O MCULE-6342457653 [0,1,0,0,0,1|1,0,0]=3 1668 B11R1.277 OCC1OC(C(CC1O)O)O MCULE-4817281530 [0,1,0,0,0,1|1,0,0]=3 1669 B11R1.14 OCC1CC(C(C(O1)O)O)O MCULE-1020108481 [0,1,0,0,0,1|1,0,0]=3 1670 B11R1.374 OC[C@H]1OC([C@H]([C@@H]1O)O)(O)O MCULE-2068211832 [0,2,0,0,0,0|1,0,0]=3 1671 B11R1.374 OC[C@H]1OC([C@H]([C@@H]1O)O)(O)O MCULE-4843625718 [0,2,0,0,0,0|1,0,0]=3 1672 B11R1.374 OC[C@H]1OC([C@H]([C@@H]1O)O)(O)O MCULE-5796022075 [0,2,0,0,0,0|1,0,0]=3 1673 B11R1.374 OC[C@H]1OC([C@H]([C@@H]1O)O)(O)O MCULE-5902930606 [0,2,0,0,0,0|1,0,0]=3 1674 B11R1.672 C[C@H](O)[C@H]1OC(=O)[C@H]([C@@H]1O)O MCULE-7572552589 [0,2,0,0,0,0|1,0,1]=4 1675 B11R1.977 COC1OC(C(C1O)O)CO MCULE-2753096250 [0,2,0,0,0,0|1,0,0]=3 1676 B11R1.977 COC1O[C@@H]([C@@H]([C@H]1O)O)CO MCULE-2286926787 [0,2,0,0,0,0|1,0,0]=3 1677 B11R1.977 COC1O[C@@H]([C@H]([C@@H]1O)O)CO MCULE-4578176785 [0,2,0,0,0,0|1,0,0]=3 1678 B11R1.977 COC1O[C@@H]([C@H]([C@H]1O)O)CO MCULE-5066848626 [0,2,0,0,0,0|1,0,0]=3 1679 B11R1.977 COC1O[C@@H]([C@H]([C@H]1O)O)CO MCULE-8324557957 [0,2,0,0,0,0|1,0,0]=3 1680 B11R1.977 COC1O[C@@H]([C@H]([C@H]1O)O)CO MCULE-9081727627 [0,2,0,0,0,0|1,0,0]=3 1681 B11R1.977 CO[C@@H]1O[C@@H]([C@H]([C@H]1O)O)CO MCULE-2950267880 [0,2,0,0,0,0|1,0,0]=3 1682 B11R1.977 CO[C@@H]1O[C@@H]([C@H]([C@H]1O)O)CO MCULE-4571648763 [0,2,0,0,0,0|1,0,0]=3 1683 B11R1.977 CO[C@@H]1O[C@@H]([C@H]([C@H]1O)O)CO MCULE-6498089172 [0,2,0,0,0,0|1,0,0]=3 1684 B11R1.977 CO[C@H]1O[C@@H]([C@H]([C@@H]1O)O)CO MCULE-1882555001 [0,2,0,0,0,0|1,0,0]=3 1685 B11R1.977 CO[C@H]1O[C@@H]([C@H]([C@@H]1O)O)CO MCULE-3710523607 [0,2,0,0,0,0|1,0,0]=3 1686 B11R1.977 CO[C@H]1O[C@@H]([C@H]([C@H]1O)O)CO MCULE-4781856514 [0,2,0,0,0,0|1,0,0]=3 1687 B11R1.977 CO[C@H]1O[C@@H]([C@H]([C@H]1O)O)CO MCULE-7078318027 [0,2,0,0,0,0|1,0,0]=3 1688 B11R1.977 NCC1OC(C(C1O)O)CO MCULE-1499136645 [0,2,0,0,0,0|1,0,0]=3 1689 B11R1.977 NC[C@H]1O[C@@H]([C@H]([C@@H]1O)O)CO MCULE-4062398173 [0,2,0,0,0,0|1,0,0]=3 1690 B11R1.977 O=CC1OC(C(C1O)O)CO MCULE-6166072959 [0,2,0,0,0,0|1,0,0]=3 1691 B11R1.977 OCC1NC(C(C1O)O)CO MCULE-6280494326 [0,2,0,0,0,0|0,0,0]=2 1692 B11R1.977 OCC1NC(C(C1O)O)CO MCULE-8000772222 [0,2,0,0,0,0|0,0,0]=2 1693 B11R1.977 OCC1OC(C(C1O)O)CO MCULE-5241214494 [0,2,0,0,0,0|1,0,0]=3 1694 B11R1.977 OC[C@@H]1N[C@H]([C@H]([C@@H]1O)O)CO MCULE-3380888874 [0,2,0,0,0,0|0,0,0]=2 1695 B11R1.977 OC[C@@H]1O[C@@H]([C@H]([C@@H]1O)O)CO MCULE-1141652344 [0,2,0,0,0,0|1,0,0]=3 1696 B11R1.977 OC[C@H]1N[C@@H]([C@H]([C@@H]1O)O)CO MCULE-3467511001 [0,2,0,0,0,0|0,0,0]=2 1697 B11R1.977 OC[C@H]1N[C@@H]([C@H]([C@@H]1O)O)CO MCULE-5775238740 [0,2,0,0,0,0|0,0,0]=2 1698 B11R1.977 OC[C@H]1O[C@@H]([C@H]([C@@H]1O)O)CO MCULE-5497148156 [0,2,0,0,0,0|1,0,0]=3 1699 B11R1.977 OC[C@H]1O[C@@H]([C@H]([C@@H]1O)O)CO MCULE-8446951266 [0,2,0,0,0,0|1,0,0]=3 1700 B11R1.979 CC1(C(=O)OC(C1O)CO)O MCULE-3033847021 [0,2,0,0,0,0|1,0,1]=4 1701 B11R1.979 C[C@@]1(C(=O)O[C@@H]([C@H]1O)CO)O MCULE-5264367717 [0,2,0,0,0,0|1,0,1]=4 1702 B11R1.979 C[C@@]1(C(=O)O[C@@H]([C@H]1O)CO)O MCULE-5312483598 [0,2,0,0,0,0|1,0,1]=4 1703 B11R1.979 C[C@@]1(C(=O)O[C@@H]([C@H]1O)CO)O MCULE-5392062635 [0,2,0,0,0,0|1,0,1]=4 1704 B11R1.865 C1(NCC(C1O)O)C(O)CO MCULE-8182773216 [0,2,0,0,0,0|0,0,0]=2 1705 B11R1.865 C1(NCC(C1O)O)C(O)CO MCULE-9438696630 [0,2,0,0,0,0|0,0,0]=2 1706 B11R1.865 O=CC(O)C1OCC(C1O)O MCULE-3736817186 [0,2,0,0,0,0|1,0,0]=3 1707 B11R1.865 O=C[C@H](O)[C@H]1OC[C@H]([C@H]1O)O MCULE-7499541573 [0,2,0,0,0,0|1,0,0]=3 1708 B11R1.865 OC[C@@H](O)[C@H]1OC[C@@H]([C@H]1O)O MCULE-9196823700 [0,2,0,0,0,0|1,0,0]=3 1709 B11R1.865 [C@@H]1(NC[C@H]([C@H]1O)O)[C@H](O)CO MCULE-6385831394 [0,2,0,0,0,0|0,0,0]=2 1710 B11R1.865 [C@@H]1(NC[C@H]([C@H]1O)O)[C@H](O)CO MCULE-7164777003 [0,2,0,0,0,0|0,0,0]=2 1711 B9R1.3 CC1OCCC(C1O)O MCULE-6494583965 [0,0,1,1,0,0|2,0,0]=4 1712 B9R1.3 C[C@@H]1CNC[C@@H]([C@@H]1O)O MCULE-4065345114 [0,0,1,1,0,0|2,0,0]=4 1713 B9R1.3 C[C@@H]1CNC[C@@H]([C@@H]1O)O MCULE-5732596905 [0,0,1,1,0,0|2,0,0]=4 1714 B9R1.3 C[C@H]1CNC[C@@H]([C@@H]1O)O MCULE-3640440568 [0,0,1,1,0,0|2,0,0]=4 1715 B9R1.3 C[C@H]1CNC[C@@H]([C@@H]1O)O MCULE-9501528896 [0,0,1,1,0,0|2,0,0]=4 1716 B9R1.3 N[C@@H]1CCC[C@H]([C@@H]1O)O MCULE-7294484287 [0,0,1,1,0,0|1,0,0]=3 1717 B9R1.3 N[C@H]1CCC[C@@H]([C@@H]1O)O MCULE-4901407173 [0,0,1,1,0,0|1,0,0]=3 1718 B9R1.3 N[C@H]1CCC[C@H]([C@@H]1O)O MCULE-2706489441 [0,0,1,1,0,0|1,0,0]=3 1719 B9R1.3 OC1CCCC(C1O)O MCULE-2835511427 [0,0,1,1,0,0|2,0,0]=4 1720 B9R1.5 CC1CNCCCC1O MCULE-7042298511 [0,0,1,1,0,0|2,0,0]=4 1721 B9R1.5 CC1CNCCCC1O MCULE-8658161534 [0,0,1,1,0,0|2,0,0]=4 1722 B9R1.5 OC1CCCCCC1O MCULE-7682077273 [0,0,1,1,0,0|2,0,0]=4 1723 B9R1.5 OC1CNCCCC1F MCULE-3253307740 [0,0,1,1,0,0|2,0,0]=4 1724 B9R1.5 OC1CNCCCC1F MCULE-9432299615 [0,0,1,1,0,0|2,0,0]=4 1725 B9R1.5 O[C@H]1CCCCC[C@@H]1O MCULE-9651607332 [0,0,1,1,0,0|2,0,0]=4 1726 B9R1.11 NCC(O)C1CCCC1 MCULE-1826088467 [0,0,1,1,0,0|2,0,0]=4 1727 B9R1.11 NCC(O)C1CCCC1 MCULE-5186127631 [0,0,1,1,0,0|2,0,0]=4 1728 B9R1.11 NCC(O)C1CCCO1 MCULE-1674634827 [0,0,1,1,0,0|1,0,0]=3 1729 B9R1.11 NCC(O)C1CCOC1 MCULE-2353712692 [0,0,1,1,0,0|1,0,0]=3 1730 B9R1.11 NCC(O)C1CCOC1 MCULE-2647033518 [0,0,1,1,0,0|1,0,0]=3 1731 B9R1.15 CCC1COCCC1O MCULE-9521346817 [0,0,1,1,0,0|2,0,0]=4 1732 B9R1.15 NCC1CCCCC1O MCULE-3106014100 [0,0,1,1,0,0|2,0,0]=4 1733 B9R1.15 NC[C@H]1CCCC[C@@H]1O MCULE-1443897301 [0,0,1,1,0,0|2,0,0]=4 1734 B9R1.15 NC[C@H]1CCCC[C@@H]1O MCULE-4382665718 [0,0,1,1,0,0|2,0,0]=4 1735 B9R1.69 CC1CC(C(CN1)C)O MCULE-4236165208 [0,0,1,1,0,0|2,0,0]=4 1736 B9R1.69 CC1CC(C(CN1)C)O MCULE-4276808995 [0,0,1,1,0,0|2,0,0]=4 1737 B9R1.69 CC1CC(C(CN1)C)O MCULE-7662096159 [0,0,1,1,0,0|2,0,0]=4 1738 B9R1.69 OC1CC(C(CO1)O)O MCULE-3654762746 [0,0,1,1,0,0|1,0,0]=3 1739 B9R1.69 OC1C[C@@H]([C@@H](CO1)O)O MCULE-2084054051 [0,0,1,1,0,0|1,0,0]=3 1740 B9R1.69 OC1C[C@@H]([C@@H](CO1)O)O MCULE-9105480679 [0,0,1,1,0,0|1,0,0]=3 1741 B9R1.69 OC1C[C@H]([C@H](CO1)O)O MCULE-7375065985 [0,0,1,1,0,0|1,0,0]=3 1742 B9R1.1 CC1CCC(NC1)CO MCULE-3943626768 [0,0,1,1,0,0|2,0,0]=4 1743 B9R1.1 CC1CCC(NC1)CO MCULE-6105965267 [0,0,1,1,0,0|2,0,0]=4 1744 B9R1.1 NC1CCC(OC1)CO MCULE-4245301257 [0,0,1,1,0,0|2,0,0]=4 1745 B9R1.1 NC1CCC(OC1)CO MCULE-4483575448 [0,0,1,1,0,0|2,0,0]=4 1746 B9R1.1 NCC1CCC(CO1)O MCULE-3286854000 [0,0,1,1,0,0|2,0,0]=4 1747 B9R1.1 N[C@@H]1CC[C@H](OC1)CO MCULE-5075594203 [0,0,1,1,0,0|2,0,0]=4 1748 B9R1.1 N[C@@H]1CC[C@H](OC1)CO MCULE-6987959950 [0,0,1,1,0,0|2,0,0]=4 1749 B9R1.1 N[C@H]1CC[C@H](OC1)CO MCULE-2411909324 [0,0,1,1,0,0|2,0,0]=4 1750 B9R1.1 OCC1CCC(CC1)O MCULE-2821884453 [0,0,1,1,0,0|2,0,0]=4 1751 B9R1.1 OCC1CCC(CO1)O MCULE-4333559257 [0,0,1,1,0,0|1,0,0]=3 1752 B9R1.1 OC[C@H]1CC[C@@H](CC1)O MCULE-4903112146 [0,0,1,1,0,0|2,0,0]=4 1753 B9R1.1 OC[C@H]1CC[C@H](CC1)O MCULE-5364161264 [0,0,1,1,0,0|2,0,0]=4 1754 B9R1.2 CC1CNCC(C1)CO MCULE-1604083581 [0,0,1,1,0,0|2,0,0]=4 1755 B9R1.2 CC1CNCC(O1)CO MCULE-6915504187 [0,0,1,1,0,0|1,0,0]=3 1756 B9R1.2 CCC1CNCC(O1)C MCULE-6402129304 [0,0,1,1,0,0|2,0,0]=4 1757 B9R1.2 CC[C@H]1CNC[C@H](O1)C MCULE-1726802726 [0,0,1,1,0,0|2,0,0]=4 1758 B9R1.2 C[C@@H]1CNC[C@H](O1)CO MCULE-4030187082 [0,0,1,1,0,0|1,0,0]=3 1759 B9R1.2 C[C@@H]1CNC[C@H](O1)CO MCULE-8521542499 [0,0,1,1,0,0|1,0,0]=3 1760 B9R1.2 C[C@H]1CNC[C@H](O1)CO MCULE-6331587635 [0,0,1,1,0,0|1,0,0]=3 1761 B9R1.2 C[C@H]1CNC[C@H](O1)CO MCULE-6791243811 [0,0,1,1,0,0|1,0,0]=3 1762 B9R1.2 OCC1CNCC(C1)F MCULE-4143657441 [0,0,1,1,0,0|2,0,0]=4 1763 B9R1.2 OCC1CNCC(C1)F MCULE-8277902234 [0,0,1,1,0,0|2,0,0]=4 1764 B9R1.2 [C@H]1(CNC[C@@H](O1)CO)C MCULE-4259776230 [0,0,1,1,0,0|1,0,0]=3 1765 B9R1.17 OCCNCC1CCC1 MCULE-4723097347 [0,0,1,1,0,0|2,0,0]=4 1766 B9R1.50 OC1CNCCCNC1 MCULE-3177425947 [0,0,1,1,0,0|2,0,0]=4 1767 B9R1.50 OC1CNCCCNC1 MCULE-5698562435 [0,0,1,1,0,0|2,0,0]=4 1768 B9R1.58 OCCN1CC(C1)CF MCULE-8189121911 [0,0,1,1,0,0|2,0,0]=4 1769 B9R1.58 OCCN1CC(C1)CF MCULE-9544141900 [0,0,1,1,0,0|2,0,0]=4 1770 B9R1.89 CCC1CNCCCO1 MCULE-5736441757 [0,0,1,1,0,0|2,0,0]=4 1771 B9R1.89 CCC1CNCCOC1 MCULE-8196044665 [0,0,1,1,0,0|2,0,0]=4 1772 B9R1.89 FCC1CNCCCO1 MCULE-4304507356 [0,0,1,1,0,0|2,0,0]=4 1773 B9R1.89 FCC1CNCCCO1 MCULE-5204425397 [0,0,1,1,0,0|2,0,0]=4 1774 B9R1.89 OCC1CCCCNC1 MCULE-1649629703 [0,0,1,1,0,0|2,0,0]=4 1775 B9R1.89 OCC1CCCCNC1 MCULE-6297064506 [0,0,1,1,0,0|2,0,0]=4 1776 B9R1.89 OCC1CNCCCO1 MCULE-7903525804 [0,0,1,1,0,0|1,0,0]=3 1777 B9R1.89 OCC1CNCCCO1 MCULE-9908272497 [0,0,1,1,0,0|1,0,0]=3 1778 B9R1.89 OCC1CNCCOC1 MCULE-9049672869 [0,0,1,1,0,0|1,0,0]=3 1779 B9R1.89 OCC1COCCOC1 MCULE-3330785002 [0,0,1,1,0,0|2,0,0]=4 1780 B9R1.89 OC[C@@H]1CNCCCO1 MCULE-3544932007 [0,0,1,1,0,0|1,0,0]=3 1781 B9R1.89 OC[C@@H]1CNCCCO1 MCULE-4726628241 [0,0,1,1,0,0|1,0,0]=3 1782 B9R1.89 OC[C@@H]1CNCCCO1 MCULE-5225680882 [0,0,1,1,0,0|1,0,0]=3 1783 B9R1.89 OC[C@@H]1CNCCCO1 MCULE-5475510815 [0,0,1,1,0,0|1,0,0]=3 1784 B9R1.89 OC[C@H]1CNCCCO1 MCULE-2922219127 [0,0,1,1,0,0|1,0,0]=3 1785 B9R1.89 OC[C@H]1CNCCCO1 MCULE-3177968218 [0,0,1,1,0,0|1,0,0]=3 1786 B9R1.89 OC[C@H]1CNCCCO1 MCULE-3793527665 [0,0,1,1,0,0|1,0,0]=3 1787 B9R1.89 OC[C@H]1CNCCCO1 MCULE-7260252629 [0,0,1,1,0,0|1,0,0]=3 1788 B9R1.118 CC1(CCCCO1)CO MCULE-1474953219 [0,0,1,1,0,0|2,0,0]=4 1789 B9R1.118 CC1(CCCNC1)CO MCULE-7859652987 [0,0,1,1,0,0|2,0,0]=4 1790 B9R1.118 CC1(CCCNC1)CO MCULE-9138617665 [0,0,1,1,0,0|2,0,0]=4 1791 B9R1.118 CC1(CNCCN1)CO MCULE-1439368478 [0,0,1,1,0,0|2,0,0]=4 1792 B9R1.118 CC1(COCCO1)CO MCULE-2402682578 [0,0,1,1,0,0|2,0,0]=4 1793 B9R1.118 CCC1(CCCNC1)O MCULE-2359766186 [0,0,1,1,0,0|2,0,0]=4 1794 B9R1.118 CCC1(CCCNC1)O MCULE-4654641315 [0,0,1,1,0,0|2,0,0]=4 1795 B9R1.118 CCC1(CNCCO1)C MCULE-8570332066 [0,0,1,1,0,0|2,0,0]=4 1796 B9R1.118 C[C@@]1(CCCNC1)CO MCULE-2002234086 [0,0,1,1,0,0|2,0,0]=4 1797 B9R1.118 C[C@@]1(CCCNC1)CO MCULE-7671897310 [0,0,1,1,0,0|2,0,0]=4 1798 B9R1.118 OC1(CCCNC1)CF MCULE-8890034237 [0,0,1,1,0,0|2,0,0]=4 1799 B9R1.118 OC1(CCCNC1)CF MCULE-9294734195 [0,0,1,1,0,0|2,0,0]=4 1800 B9R1.118 OCC1(CCCCC1)O MCULE-4401054903 [0,0,1,1,0,0|2,0,0]=4 1801 B9R1.118 OCC1(CCCNC1)F MCULE-1604953146 [0,0,1,1,0,0|2,0,0]=4 1802 B9R1.118 OCC1(CCCNC1)F MCULE-2701254971 [0,0,1,1,0,0|2,0,0]=4 1803 B9R1.118 OCC1(CCCNC1)O MCULE-2181561679 [0,0,1,1,0,0|1,0,0]=3 1804 B9R1.118 OCC1(CCCNC1)O MCULE-5468132031 [0,0,1,1,0,0|1,0,0]=3 1805 B9R1.118 OC[C@@]1(CCCNC1)F MCULE-1828463699 [0,0,1,1,0,0|2,0,0]=4 1806 B9R1.118 OC[C@]1(CCCNC1)F MCULE-1994723738 [0,0,1,1,0,0|2,0,0]=4 1807 B9R1.118 OC[C@]1(CCCNC1)F MCULE-5822647493 [0,0,1,1,0,0|2,0,0]=4 1808 B9R1.118 OC[C@]1(CCCNC1)F MCULE-6498345493 [0,0,1,1,0,0|2,0,0]=4 1809 B9R1.118 OC[C@]1(CCCNC1)F MCULE-7704795376 [0,0,1,1,0,0|2,0,0]=4 1810 B9R1.12 OCCNC1CCCC1 MCULE-3464126624 [0,0,1,1,0,0|2,0,0]=4 1811 B9R1.12 OCCNC1CCCC1 MCULE-4344653097 [0,0,1,1,0,0|2,0,0]=4 1812 B9R1.12 OCCOC1CCOC1 MCULE-6665065123 [0,0,1,1,0,0|2,0,0]=4 1813 B9R1.70 OCC(CO)C1CCC1 MCULE-1317295718 [0,0,1,1,0,0|2,0,0]=4 1814 B9R1.72 NCC(CO)NC1CC1 MCULE-4464199502 [0,0,1,1,0,0|2,0,0]=4 1815 B9R1.120 CC1CCC1(CO)CO MCULE-7776828217 [0,0,1,1,0,0|2,0,0]=4 1816 B9R1.204 CCC1(CCCN1)CO MCULE-2291730213 [0,0,1,1,0,0|2,0,0]=4 1817 B9R1.204 OCC1(CCCC1)CO MCULE-6896331863 [0,0,1,1,0,0|2,0,0]=4 1818 B9R1.204 OCC1(CCCN1)CO MCULE-8513711939 [0,0,1,1,0,0|1,0,0]=3 1819 B9R1.204 OCC1(CCCO1)CO MCULE-2056655928 [0,0,1,1,0,0|1,0,0]=3 1820 B9R2.39 C12CNC(C1)C(=O)O2 MCULE-4651135224 [1,0,0,1,0,0|0,0,2]=4 1821 B9R2.39 FC1CC2CNC1C2 MCULE-2062286181 [1,0,0,1,0,0|2,0,0]=4 1822 B9R2.39 FC1CC2CNC1C2 MCULE-8803906562 [1,0,0,1,0,0|2,0,0]=4 1823 B9R2.39 O=C1OC2CNC1C2 MCULE-1081203973 [1,0,0,1,0,0|0,0,2]=4 1824 B9R2.39 O=C1OC2CNC1C2 MCULE-4715019258 [1,0,0,1,0,0|0,0,2]=4 1825 B9R2.39 O=C1O[C@@H]2CN[C@H]1C2 MCULE-1020161730 [1,0,0,1,0,0|0,0,2]=4 1826 B9R2.39 O=C1O[C@@H]2CN[C@H]1C2 MCULE-3837738406 [1,0,0,1,0,0|0,0,2]=4 1827 B9R2.39 O=C1O[C@@H]2CN[C@H]1C2 MCULE-6980885310 [1,0,0,1,0,0|0,0,2]=4 1828 B9R2.39 OC1CC2CCC1C2 MCULE-6414891759 [1,0,0,1,0,0|2,0,0]=4 1829 B9R2.39 OC1CC2CCC1N2 MCULE-1605436075 [1,0,0,1,0,0|1,0,0]=3 1830 B9R2.39 OC1CC2CCC1N2 MCULE-1761281414 [1,0,0,1,0,0|1,0,0]=3 1831 B9R2.39 OC1CC2CCC1O2 MCULE-3124193235 [1,0,0,1,0,0|2,0,0]=4 1832 B9R2.39 OC1CC2CNC1C2 MCULE-2749316886 [1,0,0,1,0,0|1,0,0]=3 1833 B9R2.39 OC1CC2CNC1C2 MCULE-4966948452 [1,0,0,1,0,0|1,0,0]=3 1834 B9R2.39 OC1C[C@@H]2CC[C@H]1C2 MCULE-9639323400 [1,0,0,1,0,0|2,0,0]=4 1835 B9R2.39 O[C@@H]1C[C@@H]2CC[C@H]1C2 MCULE-4979276205 [1,0,0,1,0,0|2,0,0]=4 1836 B9R2.39 O[C@@H]1C[C@@H]2CC[C@H]1N2 MCULE-3144398733 [1,0,0,1,0,0|1,0,0]=3 1837 B9R2.39 O[C@@H]1C[C@@H]2CC[C@H]1N2 MCULE-7894832313 [1,0,0,1,0,0|1,0,0]=3 1838 B9R2.39 O[C@@H]1C[C@H]2CC[C@@H]1C2 MCULE-6071426979 [1,0,0,1,0,0|2,0,0]=4 1839 B9R2.39 O[C@H]1C[C@@H]2CC[C@H]1N2 MCULE-1633391346 [1,0,0,1,0,0|1,0,0]=3 1840 B9R2.39 O[C@H]1C[C@@H]2CC[C@H]1N2 MCULE-9461548760 [1,0,0,1,0,0|1,0,0]=3 1841 B9R2.39 O[C@H]1C[C@@H]2CN[C@H]1C2 MCULE-1159886921 [1,0,0,1,0,0|1,0,0]=3 1842 B9R2.39 O[C@H]1C[C@@H]2CN[C@H]1C2 MCULE-6982071164 [1,0,0,1,0,0|1,0,0]=3 1843 B9R2.39 O[C@H]1C[C@H]2CN[C@@H]1C2 MCULE-4495352435 [1,0,0,1,0,0|1,0,0]=3 1844 B9R2.39 O[C@H]1C[C@H]2CN[C@@H]1C2 MCULE-6073992216 [1,0,0,1,0,0|1,0,0]=3 1845 B9R2.39 [C@@H]1(C[C@@H]2CC[C@H]1C2)O MCULE-6218681459 [1,0,0,1,0,0|2,0,0]=4 1846 B9R2.39 [C@@H]12CC[C@@H](N1)[C@@H](C2)O MCULE-3428651950 [1,0,0,1,0,0|1,0,0]=3 1847 B9R2.39 [C@@H]12CC[C@@H](N1)[C@@H](C2)O MCULE-5974580174 [1,0,0,1,0,0|1,0,0]=3 1848 B9R2.39 [C@@H]12CC[C@@H](N1)[C@@H](C2)O MCULE-6305413134 [1,0,0,1,0,0|1,0,0]=3 1849 B9R2.39 [C@@H]12CC[C@@H](N1)[C@@H](C2)O MCULE-7062654568 [1,0,0,1,0,0|1,0,0]=3 1850 B9R2.39 [C@@H]12CC[C@@H](N1)[C@H](C2)O MCULE-4291985781 [1,0,0,1,0,0|1,0,0]=3 1851 B9R2.39 [C@@H]12CC[C@@H](N1)[C@H](C2)O MCULE-8663774893 [1,0,0,1,0,0|1,0,0]=3 1852 B9R2.39 [C@@H]12CC[C@@H](O1)[C@H](C2)O MCULE-2630669259 [1,0,0,1,0,0|2,0,0]=4 1853 B9R2.39 [C@@H]12CN[C@@H](C1)C(=O)O2 MCULE-4857421267 [1,0,0,1,0,0|0,0,2]=4 1854 B9R2.39 [C@@H]12CN[C@@H](C1)C(=O)O2 MCULE-5314520254 [1,0,0,1,0,0|0,0,2]=4 1855 B9R2.39 [C@@H]12CN[C@@H](C1)C(=O)O2 MCULE-8592680797 [1,0,0,1,0,0|0,0,2]=4 1856 B9R2.39 [C@H]12CC[C@H](C1)CC2O MCULE-7175651186 [1,0,0,1,0,0|2,0,0]=4 1857 B9R2.39 [C@H]12CC[C@H](C1)[C@@H](C2)O MCULE-4118507960 [1,0,0,1,0,0|2,0,0]=4 1858 B9R2.39 [C@H]12CC[C@H](C1)[C@@H](C2)O MCULE-9141970579 [1,0,0,1,0,0|2,0,0]=4 1859 B9R2.39 [C@H]12CC[C@H](C1)[C@H](C2)O MCULE-4746309717 [1,0,0,1,0,0|2,0,0]=4 1860 B9R2.39 [C@H]12CC[C@H](C1)[C@H](C2)O MCULE-5454625797 [1,0,0,1,0,0|2,0,0]=4 1861 B9R2.61 FCC12CC(C1)CN2 MCULE-5007284802 [1,0,0,1,0,0|2,0,0]=4 1862 B9R2.61 FCC12CC(C1)CN2 MCULE-9602230215 [1,0,0,1,0,0|2,0,0]=4 1863 B9R2.61 OCC12CC(C1)CN2 MCULE-5338704221 [1,0,0,1,0,0|1,0,0]=3 1864 B9R2.61 OCC12CC(C1)CN2 MCULE-9335953299 [1,0,0,1,0,0|1,0,0]=3 1865 B9R2.61 OCC12CC(C1)CO2 MCULE-8012284802 [1,0,0,1,0,0|2,0,0]=4 1866 B9R2.61 OCC12CCC(C1)C2 MCULE-9561970787 [1,0,0,1,0,0|2,0,0]=4 1867 B9R2.68 C1CC2CC(O1)CN2 MCULE-3865024029 [1,0,0,1,0,0|1,0,0]=3 1868 B9R2.68 C1CC2CC(O1)CN2 MCULE-8660013017 [1,0,0,1,0,0|1,0,0]=3 1869 B9R2.68 C1CC2CNC(C1)C2 MCULE-9303917223 [1,0,0,1,0,0|2,0,0]=4 1870 B9R2.68 [C@H]12CCC[C@H](C1)NC2 MCULE-1467331283 [1,0,0,1,0,0|2,0,0]=4 1871 B9R2.68 [C@H]12CCC[C@H](C1)NC2 MCULE-2418052547 [1,0,0,1,0,0|2,0,0]=4 1872 B9R2.68 [C@H]12CCC[C@H](C1)NC2 MCULE-6209165116 [1,0,0,1,0,0|2,0,0]=4 1873 B9R2.68 [C@H]12CCC[C@H](C1)NC2 MCULE-8532594937 [1,0,0,1,0,0|2,0,0]=4 1874 B9R2.70 C12CNC(C1C2)CO MCULE-4394798761 [1,0,0,1,0,0|1,0,0]=3 1875 B9R2.70 C12CNC(C1C2)CO MCULE-8368311568 [1,0,0,1,0,0|1,0,0]=3 1876 B9R2.70 [C@@H]1(NC[C@H]2[C@@H]1C2)CO MCULE-3868037858 [1,0,0,1,0,0|1,0,0]=3 1877 B9R2.70 [C@@H]1(NC[C@H]2[C@@H]1C2)CO MCULE-9214226537 [1,0,0,1,0,0|1,0,0]=3 1878 B9R2.70 [C@@H]12CN[C@@H]([C@@H]1C2)CO MCULE-1920097396 [1,0,0,1,0,0|1,0,0]=3 1879 B9R2.70 [C@@H]12CN[C@@H]([C@@H]1C2)CO MCULE-2926228582 [1,0,0,1,0,0|1,0,0]=3 1880 B9R2.70 [C@@H]12CN[C@@H]([C@@H]1C2)CO MCULE-4595239988 [1,0,0,1,0,0|1,0,0]=3 1881 B9R2.70 [C@@H]12CN[C@@H]([C@@H]1C2)CO MCULE-7784163101 [1,0,0,1,0,0|1,0,0]=3 1882 B9R2.70 [C@@H]12CN[C@@H]([C@@H]1C2)CO MCULE-8164622872 [1,0,0,1,0,0|1,0,0]=3 1883 B9R2.70 [C@@H]12CN[C@@H]([C@@H]1C2)CO MCULE-9132252654 [1,0,0,1,0,0|1,0,0]=3 1884 B9R2.70 [C@H]12C[C@H]1CN[C@@H]2CO MCULE-2610856714 [1,0,0,1,0,0|1,0,0]=3 1885 B9R2.70 [C@H]12C[C@H]1CN[C@@H]2CO MCULE-5772132528 [1,0,0,1,0,0|1,0,0]=3 1886 B9R2.70 [C@H]12C[C@H]1CN[C@@H]2CO MCULE-8152584888 [1,0,0,1,0,0|1,0,0]=3 1887 B9R2.70 [C@H]12C[C@H]1CN[C@@H]2CO MCULE-8708552456 [1,0,0,1,0,0|1,0,0]=3 1888 B9R2.110 CC12CNC(C1)CO2 MCULE-8579051024 [1,0,0,1,0,0|1,0,0]=3 1889 B9R2.110 OC12CCC(C1)CC2 MCULE-6779700955 [1,0,0,1,0,0|2,0,0]=4 1890 B9R2.139 CC1CNC2(C1)CC2 MCULE-4569176091 [1,0,0,1,0,0|2,0,0]=4 1891 B9R2.139 CC1CNC2(C1)CC2 MCULE-7509060734 [1,0,0,1,0,0|2,0,0]=4 1892 B9R2.139 OC1CCC2(C1)CC2 MCULE-7469775678 [1,0,0,1,0,0|2,0,0]=4 1893 B9R2.139 OC1COC2(C1)CC2 MCULE-8380013040 [1,0,0,1,0,0|2,0,0]=4 1894 B9R2.3 C1CC2CCNC2C1 MCULE-5515150209 [1,0,0,1,0,0|2,0,0]=4 1895 B9R2.3 C1CC2CCNC2C1 MCULE-5871309108 [1,0,0,1,0,0|2,0,0]=4 1896 B9R2.3 C1CC2CNCC2N1 MCULE-7220770542 [1,0,0,1,0,0|2,0,0]=4 1897 B9R2.3 C1CC2COCC2N1 MCULE-6156066041 [1,0,0,1,0,0|1,0,0]=3 1898 B9R2.3 C1CC2OCCC2N1 MCULE-1492502644 [1,0,0,1,0,0|1,0,0]=3 1899 B9R2.3 C1CC2OCCC2N1 MCULE-9779786474 [1,0,0,1,0,0|1,0,0]=3 1900 B9R2.3 C1C[C@H]2OCC[C@H]2N1 MCULE-5641293819 [1,0,0,1,0,0|1,0,0]=3 1901 B9R2.3 C1C[C@H]2OCC[C@H]2N1 MCULE-6165603726 [1,0,0,1,0,0|1,0,0]=3 1902 B9R2.3 [C@H]12CCC[C@H]1NCC2 MCULE-5749214212 [1,0,0,1,0,0|2,0,0]=4 1903 B9R2.3 [C@H]12CCC[C@H]1NCC2 MCULE-5820731225 [1,0,0,1,0,0|2,0,0]=4 1904 B9R2.3 [C@H]12CCO[C@H]1CCN2 MCULE-1007174974 [1,0,0,1,0,0|1,0,0]=3 1905 B9R2.3 [C@H]12CCO[C@H]1CCN2 MCULE-2255998498 [1,0,0,1,0,0|1,0,0]=3 1906 B9R2.3 [C@H]12CCO[C@H]1CCN2 MCULE-2522179254 [1,0,0,1,0,0|1,0,0]=3 1907 B9R2.3 [C@H]12CCO[C@H]1CCN2 MCULE-5902487069 [1,0,0,1,0,0|1,0,0]=3 1908 B9R2.5 OC1CCCC12CC2 MCULE-8792740966 [1,0,0,1,0,0|2,0,0]=4 1909 B9R2.5 O[C@@H]1CCCC12CC2 MCULE-4216021733 [1,0,0,1,0,0|2,0,0]=4 1910 B9R2.5 O[C@@H]1CCCC12CC2 MCULE-5811995546 [1,0,0,1,0,0|2,0,0]=4 1911 B9R2.7 OC1CC2C1NCC2 MCULE-1724056091 [1,0,0,1,0,0|1,0,0]=3 1912 B9R2.7 OC1CC2C1NCC2 MCULE-4088023944 [1,0,0,1,0,0|1,0,0]=3 1913 B9R2.24 BrC1C2CCC1NC2 MCULE-9633334883 [1,0,0,1,0,0|2,0,0]=4 1914 B9R2.24 OC1C2CCC1NC2 MCULE-3410343986 [1,0,0,1,0,0|1,0,0]=3 1915 B9R2.24 OC1C2CCC1NC2 MCULE-7793208491 [1,0,0,1,0,0|1,0,0]=3 1916 B9R2.53 OC1C2CNCC1C2 MCULE-3720434836 [0,0,0,1,1,0|2,0,0]=4 1917 B9R2.53 OC1C2CNCC1C2 MCULE-9173593961 [0,0,0,1,1,0|2,0,0]=4 1918 B9R2.53 O[C@@H]1[C@@H]2CNC[C@H]1C2 MCULE-4636094600 [0,0,0,1,1,0|2,0,0]=4 1919 B9R2.53 O[C@@H]1[C@@H]2CNC[C@H]1C2 MCULE-5175095450 [0,0,0,1,1,0|2,0,0]=4 1920 B11R2.106 OC1CCNC2C1CCC2 MCULE-2210743282 [0,0,0,1,0,1|2,0,0]=4 1921 B11R2.130 CC1C(CC2CCC1N2)O MCULE-1968753278 [0,0,0,1,0,1|2,0,0]=4 1922 B11R2.130 CC1C(CC2CCC1N2)O MCULE-7983254108 [0,0,0,1,0,1|2,0,0]=4 1923 B11R2.367 OC1C2CCC(C1O)CC2 MCULE-9910867655 [0,0,0,1,0,1|2,0,0]=4 1924 B11R2.367 OC1C2CCC(C1O)NC2 MCULE-3801140254 [0,0,0,1,0,1|1,0,0]=3 1925 B11R2.367 OC1C2CCC(C1O)NC2 MCULE-9126858644 [0,0,0,1,0,1|1,0,0]=3 1926 B11R2.565 OC1C2CCCC1CNC2 MCULE-6228232431 [0,0,0,1,0,1|2,0,0]=4 1927 B11R2.565 OC1C2CNCC1COC2 MCULE-4421145572 [0,0,0,1,0,1|1,0,0]=3 1928 B11R2.565 OC1C2CNCC1COC2 MCULE-6041986613 [0,0,0,1,0,1|1,0,0]=3 1929 B11R2.68 O[C@@H]1CC[C@@H]2N[C@H]1C[C@H]2O MCULE-9168113282 [0,0,0,1,0,1|2,0,0]=4 1930 B11R2.368 OC1C2CCCC(N2)C1O MCULE-4052923781 [0,1,0,1,0,0|1,0,0]=3 1931 B11R2.60 C12OCC(C1OCC2O)O MCULE-8180886770 [0,1,0,1,0,0|1,0,0]=3 1932 B11R2.60 N[C@@H]1CO[C@H]2[C@@H]1OC[C@H]2O MCULE-2538830532 [0,1,0,1,0,0|2,0,0]=4 1933 B11R2.60 N[C@@H]1CO[C@H]2[C@@H]1OC[C@H]2O MCULE-3797735300 [0,1,0,1,0,0|2,0,0]=4 1934 B11R2.60 N[C@@H]1CO[C@H]2[C@@H]1OC[C@H]2O MCULE-8341128703 [0,1,0,1,0,0|2,0,0]=4 1935 B11R2.60 N[C@@H]1CO[C@H]2[C@@H]1OC[C@H]2O MCULE-9421126086 [0,1,0,1,0,0|2,0,0]=4 1936 B11R2.60 N[C@H]1CO[C@H]2[C@@H]1OC[C@@H]2O MCULE-1593152930 [0,1,0,1,0,0|2,0,0]=4 1937 B11R2.60 N[C@H]1CO[C@H]2[C@@H]1OC[C@@H]2O MCULE-9619265856 [0,1,0,1,0,0|2,0,0]=4 1938 B11R2.60 N[C@H]1CO[C@H]2[C@@H]1OC[C@H]2O MCULE-6708410013 [0,1,0,1,0,0|2,0,0]=4 1939 B11R2.60 N[C@H]1CO[C@H]2[C@@H]1OC[C@H]2O MCULE-8966591020 [0,1,0,1,0,0|2,0,0]=4 1940 B11R2.60 OC1CCC2C1CCC2O MCULE-2763749805 [0,1,0,1,0,0|2,0,0]=4 1941 B11R2.60 O[C@@H]1CO[C@H]2[C@@H]1OC[C@H]2O MCULE-4584434320 [0,1,0,1,0,0|1,0,0]=3 1942 B11R2.60 O[C@H]1COC2C1OC[C@@H]2O MCULE-6428879199 [0,1,0,1,0,0|1,0,0]=3 1943 B11R2.60 [C@H]12OC[C@@H](C1OC[C@@H]2O)O MCULE-7605188398 [0,1,0,1,0,0|1,0,0]=3 1944 B11R2.60 [C@H]12OC[C@@H]([C@H]1OC[C@@H]2O)O MCULE-1718087553 [0,1,0,1,0,0|1,0,0]=3 1945 B11R2.60 [C@H]12OC[C@H]([C@H]1OC[C@@H]2N)O MCULE-6619834345 [0,1,0,1,0,0|2,0,0]=4 1946 B11R2.60 [C@H]12OC[C@H]([C@H]1OC[C@@H]2O)O MCULE-2567091829 [0,1,0,1,0,0|1,0,0]=3 1947 B11R2.60 [C@H]12OC[C@H]([C@H]1OC[C@@H]2O)O MCULE-5663561305 [0,1,0,1,0,0|1,0,0]=3 1948 B11R2.60 [C@H]12OC[C@H]([C@H]1OC[C@H]2O)O MCULE-9330761848 [0,1,0,1,0,0|1,0,0]=3 1949 B11R2.392 CC1(CN[C@H]2[C@@H]1COC2)C MCULE-9097318820 [0,1,0,1,0,0|2,0,0]=4 1950 B11R2.191 OCC1NCC2C1CNC2 MCULE-1618510665 [0,1,0,1,0,0|2,0,0]=4 1951 B11R2.191 OCC1NCC2C1CNC2 MCULE-5001639390 [0,1,0,1,0,0|2,0,0]=4 1952 B11R2.232 OCC1C2CCCC1NC2 MCULE-7840712144 [0,1,0,1,0,0|2,0,0]=4 1953 B11R3.449 OC1C2CC3C1C3C2O MCULE-4925115124 [0,0,0,2,0,0|2,0,0]=4 1954 B7R1.8 CC1CCC1CO MCULE-4677269341 [1,0,0,0,1,0|2,0,0]=4 1955 B7R1.8 OCC1CCC1F MCULE-2481035584 [1,0,0,0,1,0|2,0,0]=4 1956 B7R1.8 OCC1CCC1O MCULE-9764745395 [1,0,0,0,1,0|1,0,0]=3 1957 B7R1.8 OC[C@@H]1CC[C@H]1O MCULE-5043281368 [1,0,0,0,1,0|1,0,0]=3 1958 B7R1.8 OC[C@H]1CC[C@H]1O MCULE-1536326248 [1,0,0,0,1,0|1,0,0]=3 1959 B7R1.10 C#CC1CC(C1)O MCULE-6127254681 [1,0,0,0,1,0|1,0,1]=4 1960 B7R1.10 C=C1CC(C1)CO MCULE-6295731045 [1,0,0,0,1,0|1,0,1]=4 1961 B7R1.10 CC1CC(C1)CBr MCULE-3814375250 [1,0,0,0,1,0|2,0,0]=4 1962 B7R1.10 CC1CC(C1)CN MCULE-4821587591 [1,0,0,0,1,0|2,0,0]=4 1963 B7R1.10 CC1CC(C1)CN MCULE-8372628495 [1,0,0,0,1,0|2,0,0]=4 1964 B7R1.10 CC1CC(C1)CO MCULE-5730978355 [1,0,0,0,1,0|1,0,0]=3 1965 B7R1.10 CCN1CC(C1)O MCULE-6471655695 [1,0,0,0,1,0|2,0,0]=4 1966 B7R1.10 CCN1CC(C1)O MCULE-9317904836 [1,0,0,0,1,0|2,0,0]=4 1967 B7R1.10 CN1CC(C1)CO MCULE-7263385340 [1,0,0,0,1,0|2,0,0]=4 1968 B7R1.10 CN1CC(C1)CO MCULE-8892079014 [1,0,0,0,1,0|2,0,0]=4 1969 B7R1.10 CNC1CC(C1)O MCULE-1360972312 [1,0,0,0,1,0|2,0,0]=4 1970 B7R1.10 CNC1CC(C1)O MCULE-1798280109 [1,0,0,0,1,0|2,0,0]=4 1971 B7R1.10 CN[C@H]1C[C@@H](C1)O MCULE-2573139583 [1,0,0,0,1,0|2,0,0]=4 1972 B7R1.10 CN[C@H]1C[C@@H](C1)O MCULE-8240672064 [1,0,0,0,1,0|2,0,0]=4 1973 B7R1.10 CN[C@H]1C[C@H](C1)O MCULE-1676114682 [1,0,0,0,1,0|2,0,0]=4 1974 B7R1.10 CN[C@H]1C[C@H](C1)O MCULE-5219886186 [1,0,0,0,1,0|2,0,0]=4 1975 B7R1.10 COC1CC(C1)O MCULE-6762585493 [1,0,0,0,1,0|2,0,0]=4 1976 B7R1.10 CO[C@H]1C[C@@H](C1)O MCULE-8355585959 [1,0,0,0,1,0|2,0,0]=4 1977 B7R1.10 CO[C@H]1C[C@H](C1)O MCULE-4960775262 [1,0,0,0,1,0|2,0,0]=4 1978 B7R1.10 CSC1CC(C1)O MCULE-1605912153 [1,0,0,0,1,0|2,0,0]=4 1979 B7R1.10 N#CC1CC(C1)O MCULE-4680091192 [1,0,0,0,1,0|1,0,1]=4 1980 B7R1.10 N#C[C@H]1C[C@@H](C1)O MCULE-1011646509 [1,0,0,0,1,0|1,0,1]=4 1981 B7R1.10 N#C[C@H]1C[C@H](C1)O MCULE-9751568094 [1,0,0,0,1,0|1,0,1]=4 1982 B7R1.10 NC1CC(C1)CO MCULE-4549811698 [1,0,0,0,1,0|1,0,0]=3 1983 B7R1.10 NC1CC(C1)CO MCULE-9310533439 [1,0,0,0,1,0|1,0,0]=3 1984 B7R1.10 NCC1CC(C1)F MCULE-8395280530 [1,0,0,0,1,0|2,0,0]=4 1985 B7R1.10 NCC1CC(C1)F MCULE-9102367552 [1,0,0,0,1,0|2,0,0]=4 1986 B7R1.10 NCC1CC(C1)O MCULE-1448807479 [1,0,0,0,1,0|1,0,0]=3 1987 B7R1.10 NCC1CC(C1)O MCULE-5095960848 [1,0,0,0,1,0|1,0,0]=3 1988 B7R1.10 NC[C@H]1C[C@@H](C1)F MCULE-5013421604 [1,0,0,0,1,0|2,0,0]=4 1989 B7R1.10 NC[C@H]1C[C@@H](C1)F MCULE-9543558044 [1,0,0,0,1,0|2,0,0]=4 1990 B7R1.10 NC[C@H]1C[C@@H](C1)O MCULE-2155101378 [1,0,0,0,1,0|1,0,0]=3 1991 B7R1.10 NC[C@H]1C[C@@H](C1)O MCULE-3237212031 [1,0,0,0,1,0|1,0,0]=3 1992 B7R1.10 NC[C@H]1C[C@H](C1)O MCULE-3137766844 [1,0,0,0,1,0|1,0,0]=3 1993 B7R1.10 NC[C@H]1C[C@H](C1)O MCULE-6173771659 [1,0,0,0,1,0|1,0,0]=3 1994 B7R1.10 NNC1CC(C1)O MCULE-5994485672 [1,0,0,0,1,0|2,0,0]=4 1995 B7R1.10 NN[C@H]1C[C@@H](C1)O MCULE-7299068166 [1,0,0,0,1,0|2,0,0]=4 1996 B7R1.10 NN[C@H]1C[C@H](C1)O MCULE-6067864594 [1,0,0,0,1,0|2,0,0]=4 1997 B7R1.10 NN[C@H]1C[C@H](C1)O MCULE-8225790345 [1,0,0,0,1,0|2,0,0]=4 1998 B7R1.10 N[C@H]1C[C@@H](C1)CO MCULE-1976271596 [1,0,0,0,1,0|1,0,0]=3 1999 B7R1.10 N[C@H]1C[C@@H](C1)CO MCULE-2004610084 [1,0,0,0,1,0|1,0,0]=3 2000 B7R1.10 N[C@H]1C[C@H](C1)CO MCULE-3406959231 [1,0,0,0,1,0|1,0,0]=3 2001 B7R1.10 N[C@H]1C[C@H](C1)CO MCULE-9771399616 [1,0,0,0,1,0|1,0,0]=3 2002 B7R1.10 O=C1CC(C1)CO MCULE-6785243243 [1,0,0,0,1,0|0,0,2]=4 2003 B7R1.10 O=C1CC(N1)CO MCULE-5966757004 [1,0,0,0,1,0|0,0,2]=4 2004 B7R1.10 O=C1CC(N1)CO MCULE-7672639952 [1,0,0,0,1,0|0,0,2]=4 2005 B7R1.10 O=C1C[C@@H](N1)CO MCULE-7235908958 [1,0,0,0,1,0|0,0,2]=4 2006 B7R1.10 O=C1C[C@@H](N1)CO MCULE-9940834935 [1,0,0,0,1,0|0,0,2]=4 2007 B7R1.10 O=C1C[C@H](N1)CO MCULE-1643787736 [1,0,0,0,1,0|0,0,2]=4 2008 B7R1.10 OC1CC(C1)CBr MCULE-8641406432 [1,0,0,0,1,0|1,0,0]=3 2009 B7R1.10 OC1CC(C1)CF MCULE-9152872996 [1,0,0,0,1,0|1,0,0]=3 2010 B7R1.10 OCC1CC(C1)Br MCULE-6426656913 [1,0,0,0,1,0|1,0,0]=3 2011 B7R1.10 OCC1CC(C1)Cl MCULE-8102550006 [1,0,0,0,1,0|1,0,0]=3 2012 B7R1.10 OCC1CC(C1)F MCULE-8343173774 [1,0,0,0,1,0|1,0,0]=3 2013 B7R1.10 OCC1CC(C1)O MCULE-3885216336 [1,0,0,0,1,0|0,0,0]=2 2014 B7R1.10 OC[C@H]1C[C@H](C1)O MCULE-2350233032 [1,0,0,0,1,0|0,0,0]=2 2015 B7R1.10 O[C@H]1C[C@H](C1)CF MCULE-2417083162 [1,0,0,0,1,0|1,0,0]=3 2016 B7R1.10 [C@@H]1(C[C@H](C1)CN)F MCULE-1449288209 [1,0,0,0,1,0|2,0,0]=4 2017 B7R1.10 [C@@H]1(C[C@H](C1)CN)F MCULE-2879792720 [1,0,0,0,1,0|2,0,0]=4