0 B6R0.3 C#CC(N)C(C)C MCULE-3430729891 [0,0,0,0,0,0|2,0,1]=3 1 B6R0.3 C#CC(N)C(C)C MCULE-7604887558 [0,0,0,0,0,0|2,0,1]=3 2 B6R0.3 C#CC(O)C(C)C MCULE-6729964061 [0,0,0,0,0,0|3,0,1]=4 3 B6R0.3 C#C[C@@H](O)C(C)C MCULE-2957798079 [0,0,0,0,0,0|3,0,1]=4 4 B6R0.3 C#C[C@H](O)C(C)C MCULE-7477457472 [0,0,0,0,0,0|3,0,1]=4 5 B6R0.3 C(N)(CO)C(=O)N MCULE-5512645571 [0,0,0,0,0,0|1,0,2]=3 6 B6R0.3 C(N)(CO)C(=O)N MCULE-5852943337 [0,0,0,0,0,0|1,0,2]=3 7 B6R0.3 C=C(C)C(C)CC MCULE-3736079313 [0,0,0,0,0,0|3,0,1]=4 8 B6R0.3 C=C(CO)C(=O)O MCULE-9731648602 [0,0,0,0,0,0|2,0,2]=4 9 B6R0.3 C=CC(C)C(C)C MCULE-4461669612 [0,0,0,0,0,0|3,0,1]=4 10 B6R0.3 C=CC(C)C(C)O MCULE-5639096655 [0,0,0,0,0,0|2,0,1]=3 11 B6R0.3 C=CC(N)C(=O)O MCULE-2000511750 [0,0,0,0,0,0|2,0,2]=4 12 B6R0.3 C=CC(N)C(=O)O MCULE-7504415267 [0,0,0,0,0,0|2,0,2]=4 13 B6R0.3 C=CC(N)C(=O)O MCULE-9012490000 [0,0,0,0,0,0|2,0,2]=4 14 B6R0.3 C=CC(N)C(=O)O MCULE-9978294266 [0,0,0,0,0,0|2,0,2]=4 15 B6R0.3 C=CC(O)C(C)C MCULE-2504249276 [0,0,0,0,0,0|3,0,1]=4 16 B6R0.3 C=C[C@@H](C)[C@@H](C)O MCULE-1946110265 [0,0,0,0,0,0|2,0,1]=3 17 B6R0.3 C=C[C@@H](C)[C@@H](C)O MCULE-2042493608 [0,0,0,0,0,0|2,0,1]=3 18 B6R0.3 C=C[C@@H](C)[C@H](C)O MCULE-1482556738 [0,0,0,0,0,0|2,0,1]=3 19 B6R0.3 C=C[C@@H](N)C(=O)O MCULE-3678761806 [0,0,0,0,0,0|2,0,2]=4 20 B6R0.3 C=C[C@@H](N)C(=O)O MCULE-6682447306 [0,0,0,0,0,0|2,0,2]=4 21 B6R0.3 C=C[C@@H](N)C(=O)O MCULE-6779191781 [0,0,0,0,0,0|2,0,2]=4 22 B6R0.3 C=C[C@H](C)[C@@H](C)O MCULE-4591189626 [0,0,0,0,0,0|2,0,1]=3 23 B6R0.3 C=C[C@H](C)[C@H](C)O MCULE-2180884086 [0,0,0,0,0,0|2,0,1]=3 24 B6R0.3 C=C[C@H](C)[C@H](C)O MCULE-2347920403 [0,0,0,0,0,0|2,0,1]=3 25 B6R0.3 C=C[C@H](N)C(=O)O MCULE-2657488498 [0,0,0,0,0,0|2,0,2]=4 26 B6R0.3 C=C[C@H](N)C(=O)O MCULE-5103456570 [0,0,0,0,0,0|2,0,2]=4 27 B6R0.3 C=C[C@H](N)C(=O)O MCULE-5936124947 [0,0,0,0,0,0|2,0,2]=4 28 B6R0.3 C=C[C@H](N)C(=O)O MCULE-9631686254 [0,0,0,0,0,0|2,0,2]=4 29 B6R0.3 CC(=C(C)CO)C MCULE-2852322197 [0,0,0,0,0,0|2,0,2]=4 30 B6R0.3 CC(=C(F)CO)C MCULE-3552996593 [0,0,0,0,0,0|2,0,2]=4 31 B6R0.3 CC(=O)C(C)CO MCULE-9026658672 [0,0,0,0,0,0|1,0,2]=3 32 B6R0.3 CC(=O)C(N)CO MCULE-4063057020 [0,0,0,0,0,0|0,0,2]=2 33 B6R0.3 CC(=O)[C@@H](N)CO MCULE-9046372356 [0,0,0,0,0,0|0,0,2]=2 34 B6R0.3 CC(Br)C(O)C#N MCULE-5520123598 [0,0,0,0,0,0|3,0,1]=4 35 B6R0.3 CC(C)/C(=N/O)/Cl MCULE-8655360746 [0,0,0,0,0,0|3,0,1]=4 36 B6R0.3 CC(C)/C(=N/O)/N MCULE-4474697690 [0,0,0,0,0,0|2,0,1]=3 37 B6R0.3 CC(C)C(=N)NO MCULE-9934498877 [0,0,0,0,0,0|2,0,2]=4 38 B6R0.3 CC(C)C(=O)CBr MCULE-5913227185 [0,0,0,0,0,0|3,0,1]=4 39 B6R0.3 CC(C)C(=O)CCl MCULE-4093256141 [0,0,0,0,0,0|3,0,1]=4 40 B6R0.3 CC(C)C(=O)CN MCULE-6091425997 [0,0,0,0,0,0|3,0,1]=4 41 B6R0.3 CC(C)C(=O)CN MCULE-7368122425 [0,0,0,0,0,0|3,0,1]=4 42 B6R0.3 CC(C)C(=O)CO MCULE-8746789873 [0,0,0,0,0,0|2,0,1]=3 43 B6R0.3 CC(C)C(Br)C#N MCULE-3045325666 [0,0,0,0,0,0|3,0,1]=4 44 B6R0.3 CC(C)C(Br)C=O MCULE-2054791376 [0,0,0,0,0,0|2,0,2]=4 45 B6R0.3 CC(C)C(C)CBr MCULE-4323135623 [0,0,0,0,0,0|3,0,0]=3 46 B6R0.3 CC(C)C(C)CN MCULE-1011041652 [0,0,0,0,0,0|3,0,0]=3 47 B6R0.3 CC(C)C(C)CN MCULE-5682817467 [0,0,0,0,0,0|3,0,0]=3 48 B6R0.3 CC(C)C(C)CO MCULE-7008552664 [0,0,0,0,0,0|2,0,0]=2 49 B6R0.3 CC(C)C(C)NN MCULE-3145633578 [0,0,0,0,0,0|4,0,0]=4 50 B6R0.3 CC(C)C(C)NN MCULE-5160672778 [0,0,0,0,0,0|4,0,0]=4 51 B6R0.3 CC(C)C(C)NN MCULE-7702836838 [0,0,0,0,0,0|4,0,0]=4 52 B6R0.3 CC(C)C(Cl)C#N MCULE-5102063658 [0,0,0,0,0,0|3,0,1]=4 53 B6R0.3 CC(C)C(N)C#N MCULE-5486541909 [0,0,0,0,0,0|2,0,1]=3 54 B6R0.3 CC(C)C(N)C#N MCULE-6250354053 [0,0,0,0,0,0|2,0,1]=3 55 B6R0.3 CC(C)C(N)CF MCULE-4101575579 [0,0,0,0,0,0|2,0,0]=2 56 B6R0.3 CC(C)C(N)CF MCULE-4888178244 [0,0,0,0,0,0|2,0,0]=2 57 B6R0.3 CC(C)C(N)CN MCULE-3414430422 [0,0,0,0,0,0|2,0,0]=2 58 B6R0.3 CC(C)C(N)CN MCULE-5279153780 [0,0,0,0,0,0|2,0,0]=2 59 B6R0.3 CC(C)C(N)CO MCULE-2361921763 [0,0,0,0,0,0|1,0,0]=1 60 B6R0.3 CC(C)C(N)CO MCULE-2989454077 [0,0,0,0,0,0|1,0,0]=1 61 B6R0.3 CC(C)C(N)CO MCULE-9793548365 [0,0,0,0,0,0|1,0,0]=1 62 B6R0.3 CC(C)C(O)C#N MCULE-1764798154 [0,0,0,0,0,0|3,0,1]=4 63 B6R0.3 CC(C)C(O)CBr MCULE-1921145212 [0,0,0,0,0,0|3,0,0]=3 64 B6R0.3 CC(C)C(O)CCl MCULE-7270676495 [0,0,0,0,0,0|3,0,0]=3 65 B6R0.3 CC(C)C(O)CN MCULE-3560246402 [0,0,0,0,0,0|3,0,0]=3 66 B6R0.3 CC(C)C(O)CN MCULE-9420842607 [0,0,0,0,0,0|3,0,0]=3 67 B6R0.3 CC(C)C(O)CO MCULE-6069815474 [0,0,0,0,0,0|2,0,0]=2 68 B6R0.3 CC(C)C(S)CO MCULE-1903780493 [0,0,0,0,0,0|2,0,0]=2 69 B6R0.3 CC(C)[C@@H](C)CO MCULE-4943691177 [0,0,0,0,0,0|2,0,0]=2 70 B6R0.3 CC(C)[C@@H](C)CO MCULE-6583781047 [0,0,0,0,0,0|2,0,0]=2 71 B6R0.3 CC(C)[C@@H](N)C#N MCULE-3710740145 [0,0,0,0,0,0|2,0,1]=3 72 B6R0.3 CC(C)[C@@H](N)C#N MCULE-6831295533 [0,0,0,0,0,0|2,0,1]=3 73 B6R0.3 CC(C)[C@@H](N)CF MCULE-7429178470 [0,0,0,0,0,0|2,0,0]=2 74 B6R0.3 CC(C)[C@@H](N)CF MCULE-7951488806 [0,0,0,0,0,0|2,0,0]=2 75 B6R0.3 CC(C)[C@@H](N)CO MCULE-1135743088 [0,0,0,0,0,0|1,0,0]=1 76 B6R0.3 CC(C)[C@@H](N)CO MCULE-3994511291 [0,0,0,0,0,0|1,0,0]=1 77 B6R0.3 CC(C)[C@H](C)CO MCULE-9527582465 [0,0,0,0,0,0|2,0,0]=2 78 B6R0.3 CC(C)[C@H](N)C#N MCULE-6519039369 [0,0,0,0,0,0|2,0,1]=3 79 B6R0.3 CC(C)[C@H](N)C#N MCULE-8475611484 [0,0,0,0,0,0|2,0,1]=3 80 B6R0.3 CC(C)[C@H](N)C=O MCULE-6686967175 [0,0,0,0,0,0|1,0,2]=3 81 B6R0.3 CC(C)[C@H](N)CF MCULE-2978082368 [0,0,0,0,0,0|2,0,0]=2 82 B6R0.3 CC(C)[C@H](N)CF MCULE-4609473233 [0,0,0,0,0,0|2,0,0]=2 83 B6R0.3 CC(C)[C@H](N)CN MCULE-2884084983 [0,0,0,0,0,0|2,0,0]=2 84 B6R0.3 CC(C)[C@H](N)CO MCULE-2625936994 [0,0,0,0,0,0|1,0,0]=1 85 B6R0.3 CC(C)[C@H](N)CO MCULE-3229973889 [0,0,0,0,0,0|1,0,0]=1 86 B6R0.3 CC(C)[C@H](N)CO MCULE-6090001117 [0,0,0,0,0,0|1,0,0]=1 87 B6R0.3 CC(C)[C@H](N)CO MCULE-8284816696 [0,0,0,0,0,0|1,0,0]=1 88 B6R0.3 CC(CBr)C(=O)O MCULE-1430003780 [0,0,0,0,0,0|3,0,1]=4 89 B6R0.3 CC(CCl)N(C)C MCULE-1058476958 [0,0,0,0,0,0|4,0,0]=4 90 B6R0.3 CC(CCl)N(C)C MCULE-3515287037 [0,0,0,0,0,0|4,0,0]=4 91 B6R0.3 CC(CF)C(=O)O MCULE-7390028409 [0,0,0,0,0,0|3,0,1]=4 92 B6R0.3 CC(CN)C(=O)O MCULE-5485986433 [0,0,0,0,0,0|3,0,1]=4 93 B6R0.3 CC(CN)C(=O)O MCULE-5638884438 [0,0,0,0,0,0|3,0,1]=4 94 B6R0.3 CC(CN)C(F)F MCULE-3764511329 [0,0,0,0,0,0|4,0,0]=4 95 B6R0.3 CC(CN)C(F)F MCULE-3885392808 [0,0,0,0,0,0|4,0,0]=4 96 B6R0.3 CC(CN)N(C)C MCULE-1383449400 [0,0,0,0,0,0|4,0,0]=4 97 B6R0.3 CC(CN)N(C)C MCULE-9891789912 [0,0,0,0,0,0|4,0,0]=4 98 B6R0.3 CC(CN)S(=O)C MCULE-9048112625 [0,0,0,0,0,0|3,0,1]=4 99 B6R0.3 CC(CO)C(=O)O MCULE-2772009804 [0,0,0,0,0,0|2,0,1]=3 100 B6R0.3 CC(CO)C(=O)[O-] MCULE-6956620176 [0,0,0,0,0,0|2,0,2]=4 101 B6R0.3 CC(CO)N(=O)=O MCULE-5856696728 [0,0,0,0,0,0|3,0,1]=4 102 B6R0.3 CC(CO)N(C)C MCULE-7300076854 [0,0,0,0,0,0|3,0,0]=3 103 B6R0.3 CC(CO)N(C)N MCULE-8306784573 [0,0,0,0,0,0|3,0,0]=3 104 B6R0.3 CC(CS)C(=O)O MCULE-9982386135 [0,0,0,0,0,0|2,1,1]=4 105 B6R0.3 CC(Cl)C(O)CCl MCULE-5399761987 [0,0,0,0,0,0|3,0,0]=3 106 B6R0.3 CC(N)C(C)CO MCULE-8179225289 [0,0,0,0,0,0|2,0,0]=2 107 B6R0.3 CC(N)C(O)CO MCULE-8191126136 [0,0,0,0,0,0|2,0,0]=2 108 B6R0.3 CC(O)/C(=N/O)/N MCULE-6135321689 [0,0,0,0,0,0|1,0,1]=2 109 B6R0.3 CC(O)C(=O)NN MCULE-4510079670 [0,0,0,0,0,0|3,0,1]=4 110 B6R0.3 CC(O)C(C)C#N MCULE-2580244921 [0,0,0,0,0,0|2,0,1]=3 111 B6R0.3 CC(O)C(C)CN MCULE-5251700993 [0,0,0,0,0,0|2,0,0]=2 112 B6R0.3 CC(O)C(C)CO MCULE-4061946423 [0,0,0,0,0,0|1,0,0]=1 113 B6R0.3 CC(O)C(N)CN MCULE-2787573482 [0,0,0,0,0,0|1,0,0]=1 114 B6R0.3 CC(O)C(N)CN MCULE-5330950433 [0,0,0,0,0,0|1,0,0]=1 115 B6R0.3 CC(O)C(N)CO MCULE-7733336449 [0,0,0,0,0,0|0,0,0]=0 116 B6R0.3 CC(O)C(O)CN MCULE-6591390331 [0,0,0,0,0,0|2,0,0]=2 117 B6R0.3 CC(O)C(O)CO MCULE-1795053551 [0,0,0,0,0,0|1,0,0]=1 118 B6R0.3 CC(S)C(C)CO MCULE-5435813701 [0,0,0,0,0,0|1,1,0]=2 119 B6R0.3 CCC(=O)C(C)Br MCULE-2803556971 [0,0,0,0,0,0|3,0,1]=4 120 B6R0.3 CCC(=O)C(C)C MCULE-9576230007 [0,0,0,0,0,0|3,0,1]=4 121 B6R0.3 CCC(=O)C(C)Cl MCULE-8346980404 [0,0,0,0,0,0|3,0,1]=4 122 B6R0.3 CCC(=O)C(C)N MCULE-5434634349 [0,0,0,0,0,0|3,0,1]=4 123 B6R0.3 CCC(=O)C(C)N MCULE-8408562669 [0,0,0,0,0,0|3,0,1]=4 124 B6R0.3 CCC(=O)C(C)O MCULE-4144791660 [0,0,0,0,0,0|2,0,1]=3 125 B6R0.3 CCC(=O)C(C)S MCULE-3934356624 [0,0,0,0,0,0|2,1,1]=4 126 B6R0.3 CCC(Br)C(=O)C MCULE-7759811805 [0,0,0,0,0,0|2,0,2]=4 127 B6R0.3 CCC(Br)C(=O)O MCULE-4214463814 [0,0,0,0,0,0|3,0,1]=4 128 B6R0.3 CCC(C)B(O)O MCULE-7544159454 [0,0,0,0,0,0|4,0,0]=4 129 B6R0.3 CCC(C)C(=O)C MCULE-5294244024 [0,0,0,0,0,0|2,0,2]=4 130 B6R0.3 CCC(C)C(=O)O MCULE-5615925204 [0,0,0,0,0,0|3,0,1]=4 131 B6R0.3 CCC(C)C(=O)O MCULE-7434436828 [0,0,0,0,0,0|3,0,1]=4 132 B6R0.3 CCC(C)C(C)Br MCULE-5368409335 [0,0,0,0,0,0|3,0,0]=3 133 B6R0.3 CCC(C)C(C)C MCULE-9189749509 [0,0,0,0,0,0|3,0,0]=3 134 B6R0.3 CCC(C)C(C)Cl MCULE-2663176330 [0,0,0,0,0,0|3,0,0]=3 135 B6R0.3 CCC(C)C(C)N MCULE-1056466337 [0,0,0,0,0,0|3,0,0]=3 136 B6R0.3 CCC(C)C(C)N MCULE-1503543126 [0,0,0,0,0,0|3,0,0]=3 137 B6R0.3 CCC(C)C(C)O MCULE-8290655999 [0,0,0,0,0,0|2,0,0]=2 138 B6R0.3 CCC(Cl)C(=O)O MCULE-6325944516 [0,0,0,0,0,0|3,0,1]=4 139 B6R0.3 CCC(F)C(=O)O MCULE-3947852767 [0,0,0,0,0,0|3,0,1]=4 140 B6R0.3 CCC(N)C(=O)N MCULE-2662930657 [0,0,0,0,0,0|2,0,2]=4 141 B6R0.3 CCC(N)C(=O)N MCULE-5136248706 [0,0,0,0,0,0|2,0,2]=4 142 B6R0.3 CCC(N)C(=O)N MCULE-8876361903 [0,0,0,0,0,0|2,0,2]=4 143 B6R0.3 CCC(N)C(=O)N MCULE-9704177556 [0,0,0,0,0,0|2,0,2]=4 144 B6R0.3 CCC(N)C(=O)O MCULE-2132009026 [0,0,0,0,0,0|2,0,1]=3 145 B6R0.3 CCC(N)C(=O)O MCULE-7397078475 [0,0,0,0,0,0|2,0,1]=3 146 B6R0.3 CCC(N)C(=O)O MCULE-8052711911 [0,0,0,0,0,0|2,0,1]=3 147 B6R0.3 CCC(N)C(=O)O MCULE-9815187967 [0,0,0,0,0,0|2,0,1]=3 148 B6R0.3 CCC(N)C(C)C MCULE-3624338196 [0,0,0,0,0,0|2,0,0]=2 149 B6R0.3 CCC(N)C(C)C MCULE-4491326477 [0,0,0,0,0,0|2,0,0]=2 150 B6R0.3 CCC(N)C(C)O MCULE-2752432664 [0,0,0,0,0,0|1,0,0]=1 151 B6R0.3 CCC(N)C(C)O MCULE-6087590428 [0,0,0,0,0,0|1,0,0]=1 152 B6R0.3 CCC(N)C(F)F MCULE-3079670807 [0,0,0,0,0,0|3,0,0]=3 153 B6R0.3 CCC(N)C(F)F MCULE-4157824434 [0,0,0,0,0,0|3,0,0]=3 154 B6R0.3 CCC(O)C(=O)O MCULE-1958918710 [0,0,0,0,0,0|3,0,1]=4 155 B6R0.3 CCC(O)C(=O)O MCULE-2006594131 [0,0,0,0,0,0|3,0,1]=4 156 B6R0.3 CCC(O)C(C)C MCULE-1130775455 [0,0,0,0,0,0|3,0,0]=3 157 B6R0.3 CCC(O)C(C)N MCULE-4027170059 [0,0,0,0,0,0|3,0,0]=3 158 B6R0.3 CCC(O)C(C)O MCULE-1468922095 [0,0,0,0,0,0|2,0,0]=2 159 B6R0.3 CCC(S)C(=O)C MCULE-4243782106 [0,0,0,0,0,0|2,0,2]=4 160 B6R0.3 CCC(S)C(=O)O MCULE-9887370695 [0,0,0,0,0,0|3,0,1]=4 161 B6R0.3 CC[C@@H](Br)C(=O)O MCULE-3890418201 [0,0,0,0,0,0|3,0,1]=4 162 B6R0.3 CC[C@@H](Br)C(=O)O MCULE-5910145154 [0,0,0,0,0,0|3,0,1]=4 163 B6R0.3 CC[C@@H](C)C(=O)O MCULE-4225604875 [0,0,0,0,0,0|3,0,1]=4 164 B6R0.3 CC[C@@H](C)C(=O)O MCULE-6581991788 [0,0,0,0,0,0|3,0,1]=4 165 B6R0.3 CC[C@@H](Cl)C(=O)O MCULE-2496023102 [0,0,0,0,0,0|3,0,1]=4 166 B6R0.3 CC[C@@H](Cl)C(=O)O MCULE-9719915588 [0,0,0,0,0,0|3,0,1]=4 167 B6R0.3 CC[C@@H](N)C(=O)N MCULE-2790345262 [0,0,0,0,0,0|2,0,2]=4 168 B6R0.3 CC[C@@H](N)C(=O)N MCULE-3501293124 [0,0,0,0,0,0|2,0,2]=4 169 B6R0.3 CC[C@@H](N)C(=O)N MCULE-4913204798 [0,0,0,0,0,0|2,0,2]=4 170 B6R0.3 CC[C@@H](N)C(=O)N MCULE-5005994513 [0,0,0,0,0,0|2,0,2]=4 171 B6R0.3 CC[C@@H](N)C(=O)O MCULE-3824768448 [0,0,0,0,0,0|2,0,1]=3 172 B6R0.3 CC[C@@H](N)C(=O)O MCULE-7078248621 [0,0,0,0,0,0|2,0,1]=3 173 B6R0.3 CC[C@@H](N)C(=O)O MCULE-8856363896 [0,0,0,0,0,0|2,0,1]=3 174 B6R0.3 CC[C@@H](N)C(=O)O MCULE-9662763952 [0,0,0,0,0,0|2,0,1]=3 175 B6R0.3 CC[C@@H](N)[C@H](C)O MCULE-8294520512 [0,0,0,0,0,0|1,0,0]=1 176 B6R0.3 CC[C@@H](N)[C@H](C)O MCULE-9521001934 [0,0,0,0,0,0|1,0,0]=1 177 B6R0.3 CC[C@@H](O)C(=O)O MCULE-8118182602 [0,0,0,0,0,0|3,0,1]=4 178 B6R0.3 CC[C@@H](O)C(=O)O MCULE-9744322272 [0,0,0,0,0,0|3,0,1]=4 179 B6R0.3 CC[C@@H](O)C(C)C MCULE-3684327261 [0,0,0,0,0,0|3,0,0]=3 180 B6R0.3 CC[C@H](Br)C(=O)O MCULE-2859668715 [0,0,0,0,0,0|3,0,1]=4 181 B6R0.3 CC[C@H](Br)C(=O)O MCULE-9989821197 [0,0,0,0,0,0|3,0,1]=4 182 B6R0.3 CC[C@H](C)C(=O)O MCULE-5170193492 [0,0,0,0,0,0|3,0,1]=4 183 B6R0.3 CC[C@H](C)C(=O)O MCULE-6595467867 [0,0,0,0,0,0|3,0,1]=4 184 B6R0.3 CC[C@H](Cl)C(=O)O MCULE-8870390851 [0,0,0,0,0,0|3,0,1]=4 185 B6R0.3 CC[C@H](N)C(=O)N MCULE-1934671300 [0,0,0,0,0,0|2,0,2]=4 186 B6R0.3 CC[C@H](N)C(=O)N MCULE-3034729287 [0,0,0,0,0,0|2,0,2]=4 187 B6R0.3 CC[C@H](N)C(=O)N MCULE-6902117665 [0,0,0,0,0,0|2,0,2]=4 188 B6R0.3 CC[C@H](N)C(=O)N MCULE-9419812665 [0,0,0,0,0,0|2,0,2]=4 189 B6R0.3 CC[C@H](N)C(=O)O MCULE-3597025691 [0,0,0,0,0,0|2,0,1]=3 190 B6R0.3 CC[C@H](N)C(=O)O MCULE-5445914617 [0,0,0,0,0,0|2,0,1]=3 191 B6R0.3 CC[C@H](N)C(=O)O MCULE-7781302707 [0,0,0,0,0,0|2,0,1]=3 192 B6R0.3 CC[C@H](N)C(=O)O MCULE-8446392822 [0,0,0,0,0,0|2,0,1]=3 193 B6R0.3 CC[C@H](N)C(=[Se])O MCULE-2161876558 [0,0,0,0,0,0|2,0,1]=3 194 B6R0.3 CC[C@H](N)C(=[Se])O MCULE-6045953433 [0,0,0,0,0,0|2,0,1]=3 195 B6R0.3 CC[C@H](N)C(C)C MCULE-3200638239 [0,0,0,0,0,0|2,0,0]=2 196 B6R0.3 CC[C@H](N)C(C)C MCULE-4973720203 [0,0,0,0,0,0|2,0,0]=2 197 B6R0.3 CC[C@H](N)[C@@H](C)O MCULE-1930738992 [0,0,0,0,0,0|1,0,0]=1 198 B6R0.3 CC[C@H](N)[C@@H](C)O MCULE-4226147180 [0,0,0,0,0,0|1,0,0]=1 199 B6R0.3 CC[C@H](N)[C@@H](C)O MCULE-7445496718 [0,0,0,0,0,0|1,0,0]=1 200 B6R0.3 CC[C@H](N)[C@@H](C)O MCULE-9770959398 [0,0,0,0,0,0|1,0,0]=1 201 B6R0.3 CC[C@H](N)[C@H](C)O MCULE-3878355824 [0,0,0,0,0,0|1,0,0]=1 202 B6R0.3 CC[C@H](N)[C@H](C)O MCULE-4791160457 [0,0,0,0,0,0|1,0,0]=1 203 B6R0.3 CC[C@H](O)C(=O)O MCULE-4284991317 [0,0,0,0,0,0|3,0,1]=4 204 B6R0.3 CC[C@H](O)C(=O)O MCULE-6782147427 [0,0,0,0,0,0|3,0,1]=4 205 B6R0.3 CC[C@H](O)C(C)C MCULE-9659963395 [0,0,0,0,0,0|3,0,0]=3 206 B6R0.3 CN(C)/C(=N/O)/N MCULE-3547286812 [0,0,0,0,0,0|3,0,1]=4 207 B6R0.3 CN(C)/C(=N\O)/N MCULE-4834817007 [0,0,0,0,0,0|3,0,1]=4 208 B6R0.3 CN(C)C(=O)CO MCULE-8470749078 [0,0,0,0,0,0|3,0,1]=4 209 B6R0.3 CN(O)C(=O)CN MCULE-6904940710 [0,0,0,0,0,0|3,0,1]=4 210 B6R0.3 CN(O)C(=O)CN MCULE-7352809793 [0,0,0,0,0,0|3,0,1]=4 211 B6R0.3 CNC(=O)C(C)O MCULE-4714977257 [0,0,0,0,0,0|3,0,1]=4 212 B6R0.3 CNC(=O)[C@@H](C)O MCULE-8955033466 [0,0,0,0,0,0|3,0,1]=4 213 B6R0.3 CNC(=O)[C@H](C)O MCULE-8015727044 [0,0,0,0,0,0|3,0,1]=4 214 B6R0.3 CNC(C)C(C)C MCULE-3041212030 [0,0,0,0,0,0|4,0,0]=4 215 B6R0.3 CNC(C)C(C)C MCULE-7052543779 [0,0,0,0,0,0|4,0,0]=4 216 B6R0.3 COC(=O)C(C)O MCULE-7040827393 [0,0,0,0,0,0|3,0,1]=4 217 B6R0.3 COC(=O)C(C)O MCULE-7872489483 [0,0,0,0,0,0|3,0,1]=4 218 B6R0.3 COC(=O)[C@@H](C)O MCULE-5441095431 [0,0,0,0,0,0|3,0,1]=4 219 B6R0.3 COC(=O)[C@@H](C)O MCULE-6924152779 [0,0,0,0,0,0|3,0,1]=4 220 B6R0.3 COC(=O)[C@H](C)O MCULE-2590929895 [0,0,0,0,0,0|3,0,1]=4 221 B6R0.3 COC(=O)[C@H](C)O MCULE-3292709954 [0,0,0,0,0,0|3,0,1]=4 222 B6R0.3 COC(C)C(C)O MCULE-9844405908 [0,0,0,0,0,0|3,0,0]=3 223 B6R0.3 COC(C)[C@@H](C)N MCULE-2029978265 [0,0,0,0,0,0|4,0,0]=4 224 B6R0.3 COC(C)[C@@H](C)N MCULE-4755003017 [0,0,0,0,0,0|4,0,0]=4 225 B6R0.3 COC(C)[C@@H](C)N MCULE-9820337483 [0,0,0,0,0,0|4,0,0]=4 226 B6R0.3 COC(C)[C@@H](C)N MCULE-9820818995 [0,0,0,0,0,0|4,0,0]=4 227 B6R0.3 CSC(C)C(C)O MCULE-9554880840 [0,0,0,0,0,0|3,0,0]=3 228 B6R0.3 C[C@@H](CN)C(=O)O MCULE-4438181090 [0,0,0,0,0,0|3,0,1]=4 229 B6R0.3 C[C@@H](CN)C(=O)O MCULE-4599481344 [0,0,0,0,0,0|3,0,1]=4 230 B6R0.3 C[C@@H](CN)C(=O)O MCULE-5826933618 [0,0,0,0,0,0|3,0,1]=4 231 B6R0.3 C[C@@H](CN)C(=O)O MCULE-5914856504 [0,0,0,0,0,0|3,0,1]=4 232 B6R0.3 C[C@@H](CO)C(=O)O MCULE-1381224499 [0,0,0,0,0,0|2,0,1]=3 233 B6R0.3 C[C@@H](CO)C(=O)O MCULE-4599417419 [0,0,0,0,0,0|2,0,1]=3 234 B6R0.3 C[C@@H](CO)N(C)C MCULE-4388248602 [0,0,0,0,0,0|3,0,0]=3 235 B6R0.3 C[C@@H](CS)N(C)C MCULE-7111398165 [0,0,0,0,0,0|3,1,0]=4 236 B6R0.3 C[C@@H](F)[C@@H](F)CN MCULE-9285557840 [0,0,0,0,0,0|3,0,0]=3 237 B6R0.3 C[C@@H](F)[C@H](F)CN MCULE-9353092073 [0,0,0,0,0,0|3,0,0]=3 238 B6R0.3 C[C@@H](O)[C@@H](N)CO MCULE-1499224916 [0,0,0,0,0,0|0,0,0]=0 239 B6R0.3 C[C@@H](O)[C@@H](N)CO MCULE-3539522955 [0,0,0,0,0,0|0,0,0]=0 240 B6R0.3 C[C@@H](O)[C@H](N)CO MCULE-1381786707 [0,0,0,0,0,0|0,0,0]=0 241 B6R0.3 C[C@@H](O)[C@H](N)CO MCULE-3627537672 [0,0,0,0,0,0|0,0,0]=0 242 B6R0.3 C[C@@H](O)[C@H](N)CO MCULE-5429038645 [0,0,0,0,0,0|0,0,0]=0 243 B6R0.3 C[C@@H](O)[C@H](N)CO MCULE-6146168744 [0,0,0,0,0,0|0,0,0]=0 244 B6R0.3 C[C@H](CN)C(=O)O MCULE-3703540023 [0,0,0,0,0,0|3,0,1]=4 245 B6R0.3 C[C@H](CN)C(=O)O MCULE-5714771083 [0,0,0,0,0,0|3,0,1]=4 246 B6R0.3 C[C@H](CN)C(=O)O MCULE-9009901306 [0,0,0,0,0,0|3,0,1]=4 247 B6R0.3 C[C@H](CN)C(=O)O MCULE-9217365463 [0,0,0,0,0,0|3,0,1]=4 248 B6R0.3 C[C@H](CO)C(=O)O MCULE-7012562122 [0,0,0,0,0,0|2,0,1]=3 249 B6R0.3 C[C@H](CO)C(=O)O MCULE-9702865885 [0,0,0,0,0,0|2,0,1]=3 250 B6R0.3 C[C@H](CO)C(=O)[O-] MCULE-5733737039 [0,0,0,0,0,0|2,0,2]=4 251 B6R0.3 C[C@H](N)C(=O)CCl MCULE-1387458909 [0,0,0,0,0,0|3,0,1]=4 252 B6R0.3 C[C@H](N)C(=O)CCl MCULE-3307546885 [0,0,0,0,0,0|3,0,1]=4 253 B6R0.3 C[C@H](O)[C@@H](N)CO MCULE-5329315346 [0,0,0,0,0,0|0,0,0]=0 254 B6R0.3 C[C@H](O)[C@@H](N)CO MCULE-7239426628 [0,0,0,0,0,0|0,0,0]=0 255 B6R0.3 C[C@H](O)[C@@H](N)CO MCULE-7437797788 [0,0,0,0,0,0|0,0,0]=0 256 B6R0.3 C[C@H](O)[C@H](N)CO MCULE-2378004602 [0,0,0,0,0,0|0,0,0]=0 257 B6R0.3 C[C@H](O)[C@H](N)CO MCULE-9436764758 [0,0,0,0,0,0|0,0,0]=0 258 B6R0.3 ClCC(Cl)C(Cl)Cl MCULE-6272586982 [0,0,0,0,0,0|4,0,0]=4 259 B6R0.3 N/C(=N\O)/C(Cl)Cl MCULE-7826685582 [0,0,0,0,0,0|3,0,1]=4 260 B6R0.3 N/C(=N\O)/C(F)F MCULE-3144106869 [0,0,0,0,0,0|3,0,1]=4 261 B6R0.3 NC(=O)C(N)CO MCULE-4842751232 [0,0,0,0,0,0|1,0,2]=3 262 B6R0.3 NC(=O)C(N)CO MCULE-6854366147 [0,0,0,0,0,0|1,0,2]=3 263 B6R0.3 NC(=O)C(N)CS MCULE-3144051628 [0,0,0,0,0,0|1,1,2]=4 264 B6R0.3 NC(=O)C(N)CS MCULE-7739536595 [0,0,0,0,0,0|1,1,2]=4 265 B6R0.3 NC(=O)[C@@H](N)CO MCULE-2185844038 [0,0,0,0,0,0|1,0,2]=3 266 B6R0.3 NC(=O)[C@@H](N)CO MCULE-3623516041 [0,0,0,0,0,0|1,0,2]=3 267 B6R0.3 NC(=O)[C@@H](N)CO MCULE-6218638108 [0,0,0,0,0,0|1,0,2]=3 268 B6R0.3 NC(=O)[C@@H](N)CS MCULE-9790378691 [0,0,0,0,0,0|1,1,2]=4 269 B6R0.3 NC(=O)[C@H](N)CO MCULE-2061645482 [0,0,0,0,0,0|1,0,2]=3 270 B6R0.3 NC(=O)[C@H](N)CO MCULE-5920366137 [0,0,0,0,0,0|1,0,2]=3 271 B6R0.3 NC(=O)[C@H](N)CO MCULE-7612340519 [0,0,0,0,0,0|1,0,2]=3 272 B6R0.3 NC(=O)[C@H](N)CO MCULE-7734326153 [0,0,0,0,0,0|1,0,2]=3 273 B6R0.3 NC(CCl)C(=O)O MCULE-1601405489 [0,0,0,0,0,0|2,0,1]=3 274 B6R0.3 NC(CCl)C(=O)O MCULE-3020306643 [0,0,0,0,0,0|2,0,1]=3 275 B6R0.3 NC(CCl)C(=O)O MCULE-5440349631 [0,0,0,0,0,0|2,0,1]=3 276 B6R0.3 NC(CF)C(=O)O MCULE-3274339636 [0,0,0,0,0,0|2,0,1]=3 277 B6R0.3 NC(CO)C(=O)O MCULE-2425237422 [0,0,0,0,0,0|1,0,1]=2 278 B6R0.3 NC(CO)C(=O)O MCULE-6460387318 [0,0,0,0,0,0|1,0,1]=2 279 B6R0.3 NC(CS)C(=O)O MCULE-1666411258 [0,0,0,0,0,0|1,1,1]=3 280 B6R0.3 NC(CS)C(=O)O MCULE-2938329352 [0,0,0,0,0,0|1,1,1]=3 281 B6R0.3 NC(CS)C(=O)O MCULE-7203902929 [0,0,0,0,0,0|1,1,1]=3 282 B6R0.3 NC(CS)C(=O)O MCULE-7790846545 [0,0,0,0,0,0|1,1,1]=3 283 B6R0.3 NCC(Br)C(=O)O MCULE-2289205408 [0,0,0,0,0,0|3,0,1]=4 284 B6R0.3 NCC(Br)C(=O)O MCULE-9361399143 [0,0,0,0,0,0|3,0,1]=4 285 B6R0.3 NCC(F)C(=O)O MCULE-5666887061 [0,0,0,0,0,0|3,0,1]=4 286 B6R0.3 NCC(F)C(=O)O MCULE-6134707533 [0,0,0,0,0,0|3,0,1]=4 287 B6R0.3 NCC(N)C(=O)O MCULE-1867799207 [0,0,0,0,0,0|2,0,1]=3 288 B6R0.3 NCC(N)C(=O)O MCULE-4853376364 [0,0,0,0,0,0|2,0,1]=3 289 B6R0.3 NCC(N)C(=O)O MCULE-7636331821 [0,0,0,0,0,0|2,0,1]=3 290 B6R0.3 NCC(N)C(=O)O MCULE-7735444546 [0,0,0,0,0,0|2,0,1]=3 291 B6R0.3 NCC(N)C(=O)O MCULE-9197553017 [0,0,0,0,0,0|2,0,1]=3 292 B6R0.3 NCC(O)C(=O)O MCULE-2137675488 [0,0,0,0,0,0|3,0,1]=4 293 B6R0.3 NCC(O)C(=O)O MCULE-3348306437 [0,0,0,0,0,0|3,0,1]=4 294 B6R0.3 NCC(O)C(F)F MCULE-3263599594 [0,0,0,0,0,0|4,0,0]=4 295 B6R0.3 NCC(O)C(F)F MCULE-6925242752 [0,0,0,0,0,0|4,0,0]=4 296 B6R0.3 NC[C@@H](F)C(=O)O MCULE-3544959183 [0,0,0,0,0,0|3,0,1]=4 297 B6R0.3 NC[C@@H](F)C(=O)O MCULE-4122418685 [0,0,0,0,0,0|3,0,1]=4 298 B6R0.3 NC[C@@H](F)C(=O)O MCULE-8592364466 [0,0,0,0,0,0|3,0,1]=4 299 B6R0.3 NC[C@@H](F)C(=O)O MCULE-9106826144 [0,0,0,0,0,0|3,0,1]=4 300 B6R0.3 NC[C@@H](N)C(=O)O MCULE-5363126654 [0,0,0,0,0,0|2,0,1]=3 301 B6R0.3 NC[C@@H](N)C(=O)O MCULE-8998345978 [0,0,0,0,0,0|2,0,1]=3 302 B6R0.3 NC[C@@H](N)C(=O)O MCULE-9125384126 [0,0,0,0,0,0|2,0,1]=3 303 B6R0.3 NC[C@@H](O)C(=O)O MCULE-5922773276 [0,0,0,0,0,0|3,0,1]=4 304 B6R0.3 NC[C@@H](O)C(=O)O MCULE-8921832932 [0,0,0,0,0,0|3,0,1]=4 305 B6R0.3 NC[C@H](F)C(=O)O MCULE-2695037152 [0,0,0,0,0,0|3,0,1]=4 306 B6R0.3 NC[C@H](F)C(=O)O MCULE-4323150722 [0,0,0,0,0,0|3,0,1]=4 307 B6R0.3 NC[C@H](F)C(=O)O MCULE-6701791437 [0,0,0,0,0,0|3,0,1]=4 308 B6R0.3 NC[C@H](F)C(=O)O MCULE-7674783008 [0,0,0,0,0,0|3,0,1]=4 309 B6R0.3 NC[C@H](N)C(=O)O MCULE-1389567062 [0,0,0,0,0,0|2,0,1]=3 310 B6R0.3 NC[C@H](N)C(=O)O MCULE-1833064192 [0,0,0,0,0,0|2,0,1]=3 311 B6R0.3 NC[C@H](N)C(=O)O MCULE-2347369254 [0,0,0,0,0,0|2,0,1]=3 312 B6R0.3 NC[C@H](N)C(=O)O MCULE-2781423323 [0,0,0,0,0,0|2,0,1]=3 313 B6R0.3 NC[C@H](N)C(=O)O MCULE-6498458695 [0,0,0,0,0,0|2,0,1]=3 314 B6R0.3 NC[C@H](N)C(=O)O MCULE-8313668715 [0,0,0,0,0,0|2,0,1]=3 315 B6R0.3 NC[C@H](O)C(=O)O MCULE-5854124012 [0,0,0,0,0,0|3,0,1]=4 316 B6R0.3 NC[C@H](O)C(=O)O MCULE-7536593166 [0,0,0,0,0,0|3,0,1]=4 317 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-2896868744 [0,0,0,0,0,0|2,0,1]=3 318 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-5799339909 [0,0,0,0,0,0|2,0,1]=3 319 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-7445121230 [0,0,0,0,0,0|2,0,1]=3 320 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-9137000163 [0,0,0,0,0,0|2,0,1]=3 321 B6R0.3 N[C@@H](CO)C(=O)O MCULE-4580794842 [0,0,0,0,0,0|1,0,1]=2 322 B6R0.3 N[C@@H](CO)C(=O)O MCULE-5604658333 [0,0,0,0,0,0|1,0,1]=2 323 B6R0.3 N[C@@H](CO)C(=O)O MCULE-5884286841 [0,0,0,0,0,0|1,0,1]=2 324 B6R0.3 N[C@@H](CO)C(=O)O MCULE-6118038121 [0,0,0,0,0,0|1,0,1]=2 325 B6R0.3 N[C@@H](CS)C(=O)O MCULE-1896679526 [0,0,0,0,0,0|1,1,1]=3 326 B6R0.3 N[C@@H](CS)C(=O)O MCULE-2206038012 [0,0,0,0,0,0|1,1,1]=3 327 B6R0.3 N[C@@H](CS)C(=O)O MCULE-6337217524 [0,0,0,0,0,0|1,1,1]=3 328 B6R0.3 N[C@@H](CS)C(=O)O MCULE-9685479191 [0,0,0,0,0,0|1,1,1]=3 329 B6R0.3 N[C@H](CCl)C(=O)O MCULE-2647266636 [0,0,0,0,0,0|2,0,1]=3 330 B6R0.3 N[C@H](CCl)C(=O)O MCULE-7797369596 [0,0,0,0,0,0|2,0,1]=3 331 B6R0.3 N[C@H](CCl)C(=O)O MCULE-8133148482 [0,0,0,0,0,0|2,0,1]=3 332 B6R0.3 N[C@H](CCl)C(=O)O MCULE-9324545858 [0,0,0,0,0,0|2,0,1]=3 333 B6R0.3 N[C@H](CF)C(=O)O MCULE-4766495272 [0,0,0,0,0,0|2,0,1]=3 334 B6R0.3 N[C@H](CF)C(=O)O MCULE-7679315401 [0,0,0,0,0,0|2,0,1]=3 335 B6R0.3 N[C@H](CO)C(=O)O MCULE-3271603208 [0,0,0,0,0,0|1,0,1]=2 336 B6R0.3 N[C@H](CO)C(=O)O MCULE-8560981570 [0,0,0,0,0,0|1,0,1]=2 337 B6R0.3 N[C@H](CS)C(=O)O MCULE-2137827959 [0,0,0,0,0,0|1,1,1]=3 338 B6R0.3 N[C@H](CS)C(=O)O MCULE-4521387126 [0,0,0,0,0,0|1,1,1]=3 339 B6R0.3 N[C@H](CS)C(=O)O MCULE-7201506202 [0,0,0,0,0,0|1,1,1]=3 340 B6R0.3 N[C@H](CS)C(=O)O MCULE-9147562606 [0,0,0,0,0,0|1,1,1]=3 341 B6R0.3 O=C(O)C(=O)CO MCULE-2263002631 [0,0,0,0,0,0|2,0,2]=4 342 B6R0.3 O=C(O)C(Br)CBr MCULE-9991448725 [0,0,0,0,0,0|3,0,1]=4 343 B6R0.3 O=C(O)C(Br)CF MCULE-6577995297 [0,0,0,0,0,0|3,0,1]=4 344 B6R0.3 O=C(O)C(Br)CO MCULE-9060407295 [0,0,0,0,0,0|2,0,1]=3 345 B6R0.3 O=C(O)C(Cl)CCl MCULE-4757238565 [0,0,0,0,0,0|3,0,1]=4 346 B6R0.3 O=C(O)C(Cl)CO MCULE-3671026398 [0,0,0,0,0,0|2,0,1]=3 347 B6R0.3 O=C(O)C(F)CF MCULE-4323199927 [0,0,0,0,0,0|3,0,1]=4 348 B6R0.3 O=C(O)C(O)CBr MCULE-2600199692 [0,0,0,0,0,0|3,0,1]=4 349 B6R0.3 O=C(O)C(O)CCl MCULE-6346810624 [0,0,0,0,0,0|3,0,1]=4 350 B6R0.3 O=C(O)C(O)CO MCULE-3634533503 [0,0,0,0,0,0|2,0,1]=3 351 B6R0.3 O=C(O)[C@@H](Br)CO MCULE-4486884639 [0,0,0,0,0,0|2,0,1]=3 352 B6R0.3 O=C(O)[C@@H](Br)CO MCULE-8586594526 [0,0,0,0,0,0|2,0,1]=3 353 B6R0.3 O=C(O)[C@@H](O)CCl MCULE-4927034524 [0,0,0,0,0,0|3,0,1]=4 354 B6R0.3 O=C(O)[C@@H](O)CO MCULE-4917119993 [0,0,0,0,0,0|2,0,1]=3 355 B6R0.3 O=C(O)[C@@H](O)CO MCULE-7996851129 [0,0,0,0,0,0|2,0,1]=3 356 B6R0.3 O=C(O)[C@H](Br)CO MCULE-3770944978 [0,0,0,0,0,0|2,0,1]=3 357 B6R0.3 O=C(O)[C@H](Br)CO MCULE-6926119866 [0,0,0,0,0,0|2,0,1]=3 358 B6R0.3 O=C(O)[C@H](O)CF MCULE-4453713074 [0,0,0,0,0,0|3,0,1]=4 359 B6R0.3 O=C([O-])[C@@H](O)CO MCULE-4498291090 [0,0,0,0,0,0|2,0,2]=4 360 B6R0.3 O=N(=O)C(Br)CO MCULE-2147001744 [0,0,0,0,0,0|3,0,1]=4 361 B6R0.3 OC(CBr)C(F)F MCULE-2512834773 [0,0,0,0,0,0|4,0,0]=4 362 B6R0.3 OC[C@@H](O)C(F)F MCULE-5042610356 [0,0,0,0,0,0|3,0,0]=3 363 B6R0.3 OC[C@@H](O)C(F)F MCULE-8643910063 [0,0,0,0,0,0|3,0,0]=3 364 B6R0.3 [C@@H](N)(C=C)C(=O)O MCULE-9406839633 [0,0,0,0,0,0|2,0,2]=4 365 B6R0.3 [C@@H](N)(CN)C(=O)O MCULE-2844054083 [0,0,0,0,0,0|2,0,1]=3 366 B6R0.3 [C@H](N)(CO)C(=O)N MCULE-2792784400 [0,0,0,0,0,0|1,0,2]=3 367 B6R0.3 [C@H](S)(CC)C(=O)O MCULE-4267293279 [0,0,0,0,0,0|3,0,1]=4 368 B6R0.3 [SeH]C[C@H](N)C(=O)O MCULE-8205075370 [0,0,0,0,0,0|1,1,1]=3 369 B5R0.1 C#CCC(C)C MCULE-2506063278 [1,0,0,0,0,0|2,0,1]=4 370 B5R0.1 C#CCC(C)N MCULE-1523044787 [1,0,0,0,0,0|2,0,1]=4 371 B5R0.1 C#CCC(C)N MCULE-3399522488 [1,0,0,0,0,0|2,0,1]=4 372 B5R0.1 C#CCC(C)O MCULE-2487589857 [1,0,0,0,0,0|1,0,1]=3 373 B5R0.1 C(C)(N)CCC MCULE-4800297905 [1,0,0,0,0,0|2,0,0]=3 374 B5R0.1 C(C)(N)CCC MCULE-7674864567 [1,0,0,0,0,0|2,0,0]=3 375 B5R0.1 C(C)(N)CCO MCULE-5545469271 [1,0,0,0,0,0|1,0,0]=2 376 B5R0.1 C/C=C/C(C)O MCULE-3191147789 [1,0,0,0,0,0|1,0,2]=4 377 B5R0.1 C=C(Br)CCO MCULE-3743908958 [1,0,0,0,0,0|1,0,2]=4 378 B5R0.1 C=C(C)CCBr MCULE-3439794005 [1,0,0,0,0,0|2,0,1]=4 379 B5R0.1 C=C(C)CCC MCULE-8225129744 [1,0,0,0,0,0|2,0,1]=4 380 B5R0.1 C=C(C)CCCl MCULE-2816016781 [1,0,0,0,0,0|2,0,1]=4 381 B5R0.1 C=C(C)CCI MCULE-6317205481 [1,0,0,0,0,0|2,0,1]=4 382 B5R0.1 C=C(C)CCN MCULE-4037025602 [1,0,0,0,0,0|2,0,1]=4 383 B5R0.1 C=C(C)CCN MCULE-5001503744 [1,0,0,0,0,0|2,0,1]=4 384 B5R0.1 C=C(C)CCO MCULE-2689800711 [1,0,0,0,0,0|1,0,1]=3 385 B5R0.1 C=CCC(C)Br MCULE-5638987302 [1,0,0,0,0,0|2,0,1]=4 386 B5R0.1 C=CCC(C)C MCULE-4586731422 [1,0,0,0,0,0|2,0,1]=4 387 B5R0.1 C=CCC(C)N MCULE-5354228552 [1,0,0,0,0,0|2,0,1]=4 388 B5R0.1 C=CCC(C)N MCULE-9454660067 [1,0,0,0,0,0|2,0,1]=4 389 B5R0.1 C=CCC(C)O MCULE-7724200334 [1,0,0,0,0,0|1,0,1]=3 390 B5R0.1 C=CCC(C)O MCULE-9910771503 [1,0,0,0,0,0|1,0,1]=3 391 B5R0.1 C=CC[C@@H](C)O MCULE-1663575568 [1,0,0,0,0,0|1,0,1]=3 392 B5R0.1 C=CC[C@@H](C)O MCULE-3971480179 [1,0,0,0,0,0|1,0,1]=3 393 B5R0.1 C=CC[C@H](C)N MCULE-2398654329 [1,0,0,0,0,0|2,0,1]=4 394 B5R0.1 C=CC[C@H](C)N MCULE-5817451810 [1,0,0,0,0,0|2,0,1]=4 395 B5R0.1 C=CC[C@H](C)O MCULE-5783959808 [1,0,0,0,0,0|1,0,1]=3 396 B5R0.1 C=CC[C@H](C)O MCULE-6146696600 [1,0,0,0,0,0|1,0,1]=3 397 B5R0.1 CC#CC(C)O MCULE-5523814936 [1,0,0,0,0,0|1,0,2]=4 398 B5R0.1 CC(=CCO)C MCULE-3984123588 [1,0,0,0,0,0|1,0,2]=4 399 B5R0.1 CC(=CCO)Cl MCULE-6459066496 [1,0,0,0,0,0|1,0,2]=4 400 B5R0.1 CC(=CCO)I MCULE-4600854759 [1,0,0,0,0,0|1,0,2]=4 401 B5R0.1 CC(=O)CCBr MCULE-2615300206 [1,0,0,0,0,0|1,0,2]=4 402 B5R0.1 CC(=O)CCCl MCULE-8019748964 [1,0,0,0,0,0|1,0,2]=4 403 B5R0.1 CC(=O)CCN MCULE-7550348751 [1,0,0,0,0,0|1,0,2]=4 404 B5R0.1 CC(=O)CCN MCULE-9519063810 [1,0,0,0,0,0|1,0,2]=4 405 B5R0.1 CC(=O)CCO MCULE-6328537335 [1,0,0,0,0,0|0,0,2]=3 406 B5R0.1 CC(=O)NCO MCULE-4563335540 [1,0,0,0,0,0|1,0,2]=4 407 B5R0.1 CC(Br)CC#N MCULE-6321379216 [1,0,0,0,0,0|2,0,1]=4 408 B5R0.1 CC(Br)CCBr MCULE-1045475402 [1,0,0,0,0,0|2,0,0]=3 409 B5R0.1 CC(C)/C=N/O MCULE-3201457095 [1,0,0,0,0,0|2,0,1]=4 410 B5R0.1 CC(C)C=NO MCULE-9842574696 [1,0,0,0,0,0|2,0,1]=4 411 B5R0.1 CC(C)CC#N MCULE-4346986727 [1,0,0,0,0,0|2,0,1]=4 412 B5R0.1 CC(C)CC=O MCULE-2939497534 [1,0,0,0,0,0|1,0,2]=4 413 B5R0.1 CC(C)CCBr MCULE-7163010428 [1,0,0,0,0,0|2,0,0]=3 414 B5R0.1 CC(C)CCCl MCULE-8360122696 [1,0,0,0,0,0|2,0,0]=3 415 B5R0.1 CC(C)CCCl MCULE-9017922949 [1,0,0,0,0,0|2,0,0]=3 416 B5R0.1 CC(C)CCI MCULE-4934529500 [1,0,0,0,0,0|2,0,0]=3 417 B5R0.1 CC(C)CCN MCULE-3081003576 [1,0,0,0,0,0|2,0,0]=3 418 B5R0.1 CC(C)CCN MCULE-5118782389 [1,0,0,0,0,0|2,0,0]=3 419 B5R0.1 CC(C)CCN MCULE-5217981670 [1,0,0,0,0,0|2,0,0]=3 420 B5R0.1 CC(C)CCN MCULE-6280940933 [1,0,0,0,0,0|2,0,0]=3 421 B5R0.1 CC(C)CCO MCULE-7411270401 [1,0,0,0,0,0|1,0,0]=2 422 B5R0.1 CC(C)CCS MCULE-7115473363 [1,0,0,0,0,0|1,1,0]=3 423 B5R0.1 CC(C)CNN MCULE-6797887001 [1,0,0,0,0,0|3,0,0]=4 424 B5R0.1 CC(C)CNN MCULE-9592971233 [1,0,0,0,0,0|3,0,0]=4 425 B5R0.1 CC(C)CNN MCULE-9725792452 [1,0,0,0,0,0|3,0,0]=4 426 B5R0.1 CC(C)CON MCULE-3476786246 [1,0,0,0,0,0|3,0,0]=4 427 B5R0.1 CC(C)CON MCULE-4450654727 [1,0,0,0,0,0|3,0,0]=4 428 B5R0.1 CC(C)OCCl MCULE-3680602217 [1,0,0,0,0,0|3,0,0]=4 429 B5R0.1 CC(C)SCCl MCULE-3836735379 [1,0,0,0,0,0|3,0,0]=4 430 B5R0.1 CC(Cl)CCCl MCULE-3656498608 [1,0,0,0,0,0|2,0,0]=3 431 B5R0.1 CC(Cl)CCO MCULE-1955496242 [1,0,0,0,0,0|1,0,0]=2 432 B5R0.1 CC(F)CCBr MCULE-3035340901 [1,0,0,0,0,0|2,0,0]=3 433 B5R0.1 CC(F)CCI MCULE-6469250150 [1,0,0,0,0,0|2,0,0]=3 434 B5R0.1 CC(F)CCN MCULE-2805813131 [1,0,0,0,0,0|2,0,0]=3 435 B5R0.1 CC(F)CCN MCULE-5849913362 [1,0,0,0,0,0|2,0,0]=3 436 B5R0.1 CC(N)CC#N MCULE-2350352782 [1,0,0,0,0,0|2,0,1]=4 437 B5R0.1 CC(N)CC#N MCULE-7269201059 [1,0,0,0,0,0|2,0,1]=4 438 B5R0.1 CC(N)CCN MCULE-5308134596 [1,0,0,0,0,0|2,0,0]=3 439 B5R0.1 CC(N)CCN MCULE-5880045507 [1,0,0,0,0,0|2,0,0]=3 440 B5R0.1 CC(N)CCN MCULE-7827515430 [1,0,0,0,0,0|2,0,0]=3 441 B5R0.1 CC(N)CCO MCULE-1771399942 [1,0,0,0,0,0|1,0,0]=2 442 B5R0.1 CC(N)CCO MCULE-7239872808 [1,0,0,0,0,0|1,0,0]=2 443 B5R0.1 CC(O)CC#N MCULE-7172428142 [1,0,0,0,0,0|1,0,1]=3 444 B5R0.1 CC(O)CCBr MCULE-7983169885 [1,0,0,0,0,0|1,0,0]=2 445 B5R0.1 CC(O)CCCl MCULE-2952545606 [1,0,0,0,0,0|1,0,0]=2 446 B5R0.1 CC(O)CCN MCULE-6836791276 [1,0,0,0,0,0|1,0,0]=2 447 B5R0.1 CC(O)CCN MCULE-7186260925 [1,0,0,0,0,0|1,0,0]=2 448 B5R0.1 CC(O)CCO MCULE-1694239851 [1,0,0,0,0,0|0,0,0]=1 449 B5R0.1 CC(O)CCO MCULE-7784884948 [1,0,0,0,0,0|0,0,0]=1 450 B5R0.1 CC(O)CNN MCULE-4956670781 [1,0,0,0,0,0|2,0,0]=3 451 B5R0.1 CC(O)CNN MCULE-7917439573 [1,0,0,0,0,0|2,0,0]=3 452 B5R0.1 CC(O)CON MCULE-1051091134 [1,0,0,0,0,0|2,0,0]=3 453 B5R0.1 CC(O)CON MCULE-6722092589 [1,0,0,0,0,0|2,0,0]=3 454 B5R0.1 CC(S)CCO MCULE-5702212503 [1,0,0,0,0,0|0,1,0]=2 455 B5R0.1 CC=CC(C)O MCULE-4806592836 [1,0,0,0,0,0|1,0,2]=4 456 B5R0.1 CCCB(O)O MCULE-4994980798 [1,0,0,0,0,0|3,0,0]=4 457 B5R0.1 CCCC(=O)C MCULE-7174095676 [1,0,0,0,0,0|1,0,2]=4 458 B5R0.1 CCCC(=O)O MCULE-4116382006 [1,0,0,0,0,0|2,0,1]=4 459 B5R0.1 CCCC(=S)O MCULE-3382199964 [1,0,0,0,0,0|2,0,1]=4 460 B5R0.1 CCCC(C)Br MCULE-3178073667 [1,0,0,0,0,0|2,0,0]=3 461 B5R0.1 CCCC(C)C MCULE-9604552974 [1,0,0,0,0,0|2,0,0]=3 462 B5R0.1 CCCC(C)N MCULE-2640298430 [1,0,0,0,0,0|2,0,0]=3 463 B5R0.1 CCCC(C)N MCULE-7225905167 [1,0,0,0,0,0|2,0,0]=3 464 B5R0.1 CCCC(C)O MCULE-8205906299 [1,0,0,0,0,0|1,0,0]=2 465 B5R0.1 CCCC(C)S MCULE-1649095713 [1,0,0,0,0,0|1,1,0]=3 466 B5R0.1 CCCC(O)Cl MCULE-3188577082 [1,0,0,0,0,0|2,0,0]=3 467 B5R0.1 CCCN(C)C MCULE-8702643596 [1,0,0,0,0,0|3,0,0]=4 468 B5R0.1 CCC[C@@H](C)N MCULE-2394536966 [1,0,0,0,0,0|2,0,0]=3 469 B5R0.1 CCC[C@@H](C)N MCULE-3008898216 [1,0,0,0,0,0|2,0,0]=3 470 B5R0.1 CCC[C@@H](C)N MCULE-5656861143 [1,0,0,0,0,0|2,0,0]=3 471 B5R0.1 CCC[C@@H](C)N MCULE-8113159645 [1,0,0,0,0,0|2,0,0]=3 472 B5R0.1 CCC[C@@H](C)O MCULE-1540573875 [1,0,0,0,0,0|1,0,0]=2 473 B5R0.1 CCC[C@H](C)N MCULE-2068574015 [1,0,0,0,0,0|2,0,0]=3 474 B5R0.1 CCC[C@H](C)N MCULE-3439133019 [1,0,0,0,0,0|2,0,0]=3 475 B5R0.1 CCC[C@H](C)N MCULE-5495177657 [1,0,0,0,0,0|2,0,0]=3 476 B5R0.1 CCC[C@H](C)N MCULE-7962028651 [1,0,0,0,0,0|2,0,0]=3 477 B5R0.1 CCC[C@H](C)O MCULE-6976816276 [1,0,0,0,0,0|1,0,0]=2 478 B5R0.1 CCNC(C)C MCULE-8064118469 [1,0,0,0,0,0|3,0,0]=4 479 B5R0.1 CCOC(C)C MCULE-1934548340 [1,0,0,0,0,0|3,0,0]=4 480 B5R0.1 CCOC(C)Cl MCULE-8486994638 [1,0,0,0,0,0|3,0,0]=4 481 B5R0.1 CCSC(C)C MCULE-3738251898 [1,0,0,0,0,0|3,0,0]=4 482 B5R0.1 CN(C)CCBr MCULE-4844398053 [1,0,0,0,0,0|3,0,0]=4 483 B5R0.1 CN(C)CCCl MCULE-4297554717 [1,0,0,0,0,0|3,0,0]=4 484 B5R0.1 CN(C)CCCl MCULE-4465544992 [1,0,0,0,0,0|3,0,0]=4 485 B5R0.1 CN(C)CCI MCULE-4687894526 [1,0,0,0,0,0|3,0,0]=4 486 B5R0.1 CN(C)CCI MCULE-7464680246 [1,0,0,0,0,0|3,0,0]=4 487 B5R0.1 CN(C)CCI MCULE-9051868668 [1,0,0,0,0,0|3,0,0]=4 488 B5R0.1 CN(C)CCN MCULE-6693759372 [1,0,0,0,0,0|3,0,0]=4 489 B5R0.1 CN(C)CCN MCULE-6929925748 [1,0,0,0,0,0|3,0,0]=4 490 B5R0.1 CN(C)CCN MCULE-7881547574 [1,0,0,0,0,0|3,0,0]=4 491 B5R0.1 CN(C)CCO MCULE-5715813465 [1,0,0,0,0,0|2,0,0]=3 492 B5R0.1 CN(C)CCO MCULE-7567469160 [1,0,0,0,0,0|2,0,0]=3 493 B5R0.1 CN(C)CCO MCULE-9024108074 [1,0,0,0,0,0|2,0,0]=3 494 B5R0.1 CN(C)CCS MCULE-4356815596 [1,0,0,0,0,0|2,1,0]=4 495 B5R0.1 CN(C)CCS MCULE-4611688723 [1,0,0,0,0,0|2,1,0]=4 496 B5R0.1 CN(C)CCS MCULE-6259585517 [1,0,0,0,0,0|2,1,0]=4 497 B5R0.1 CN(N)CCN MCULE-2782966878 [1,0,0,0,0,0|3,0,0]=4 498 B5R0.1 CNCC(C)C MCULE-6582386339 [1,0,0,0,0,0|3,0,0]=4 499 B5R0.1 CNCC(C)C MCULE-6856717783 [1,0,0,0,0,0|3,0,0]=4 500 B5R0.1 CNCC(C)F MCULE-4381138647 [1,0,0,0,0,0|3,0,0]=4 501 B5R0.1 CNCC(C)F MCULE-9018181183 [1,0,0,0,0,0|3,0,0]=4 502 B5R0.1 CNCC(C)O MCULE-3671071529 [1,0,0,0,0,0|2,0,0]=3 503 B5R0.1 CNCC(C)O MCULE-4171705304 [1,0,0,0,0,0|2,0,0]=3 504 B5R0.1 CNC[C@@H](C)O MCULE-2953164520 [1,0,0,0,0,0|2,0,0]=3 505 B5R0.1 CNC[C@@H](C)O MCULE-3161721140 [1,0,0,0,0,0|2,0,0]=3 506 B5R0.1 CNC[C@@H](C)O MCULE-6218150837 [1,0,0,0,0,0|2,0,0]=3 507 B5R0.1 CNC[C@@H](C)O MCULE-8245274547 [1,0,0,0,0,0|2,0,0]=3 508 B5R0.1 CNC[C@H](C)O MCULE-2655303492 [1,0,0,0,0,0|2,0,0]=3 509 B5R0.1 CNC[C@H](C)O MCULE-7346940457 [1,0,0,0,0,0|2,0,0]=3 510 B5R0.1 COCC(C)Br MCULE-6850689931 [1,0,0,0,0,0|3,0,0]=4 511 B5R0.1 COCC(C)I MCULE-8608265714 [1,0,0,0,0,0|3,0,0]=4 512 B5R0.1 COCC(C)N MCULE-1896873634 [1,0,0,0,0,0|3,0,0]=4 513 B5R0.1 COCC(C)N MCULE-2549420211 [1,0,0,0,0,0|3,0,0]=4 514 B5R0.1 COCC(C)N MCULE-3490410444 [1,0,0,0,0,0|3,0,0]=4 515 B5R0.1 COCC(C)N MCULE-7089888882 [1,0,0,0,0,0|3,0,0]=4 516 B5R0.1 COCC(C)O MCULE-4022733014 [1,0,0,0,0,0|2,0,0]=3 517 B5R0.1 COCC(C)O MCULE-7513310960 [1,0,0,0,0,0|2,0,0]=3 518 B5R0.1 COC[C@@H](C)N MCULE-1225912236 [1,0,0,0,0,0|3,0,0]=4 519 B5R0.1 COC[C@@H](C)N MCULE-2754628271 [1,0,0,0,0,0|3,0,0]=4 520 B5R0.1 COC[C@@H](C)N MCULE-4676764915 [1,0,0,0,0,0|3,0,0]=4 521 B5R0.1 COC[C@@H](C)N MCULE-8891950737 [1,0,0,0,0,0|3,0,0]=4 522 B5R0.1 COC[C@@H](C)O MCULE-6287552520 [1,0,0,0,0,0|2,0,0]=3 523 B5R0.1 COC[C@@H](C)O MCULE-7942118801 [1,0,0,0,0,0|2,0,0]=3 524 B5R0.1 COC[C@H](C)N MCULE-2465679418 [1,0,0,0,0,0|3,0,0]=4 525 B5R0.1 COC[C@H](C)N MCULE-2998593539 [1,0,0,0,0,0|3,0,0]=4 526 B5R0.1 COC[C@H](C)N MCULE-3161045661 [1,0,0,0,0,0|3,0,0]=4 527 B5R0.1 COC[C@H](C)N MCULE-9550165578 [1,0,0,0,0,0|3,0,0]=4 528 B5R0.1 COC[C@H](C)O MCULE-5908531683 [1,0,0,0,0,0|2,0,0]=3 529 B5R0.1 COC[C@H](C)O MCULE-8619138238 [1,0,0,0,0,0|2,0,0]=3 530 B5R0.1 CS(=O)CCBr MCULE-7846126230 [1,0,0,0,0,0|2,0,1]=4 531 B5R0.1 CS(=O)CCCl MCULE-7012781505 [1,0,0,0,0,0|2,0,1]=4 532 B5R0.1 CS(=O)CCN MCULE-6497874560 [1,0,0,0,0,0|2,0,1]=4 533 B5R0.1 CS(=O)CCN MCULE-8275663766 [1,0,0,0,0,0|2,0,1]=4 534 B5R0.1 CS(=O)CCN MCULE-8330490290 [1,0,0,0,0,0|2,0,1]=4 535 B5R0.1 CS(=O)CCO MCULE-8331553582 [1,0,0,0,0,0|1,0,1]=3 536 B5R0.1 CSCC(C)N MCULE-7985946030 [1,0,0,0,0,0|3,0,0]=4 537 B5R0.1 CSCC(C)O MCULE-2227652351 [1,0,0,0,0,0|2,0,0]=3 538 B5R0.1 C[C@@H](N)CC#N MCULE-1923686728 [1,0,0,0,0,0|2,0,1]=4 539 B5R0.1 C[C@@H](N)CC#N MCULE-5694530830 [1,0,0,0,0,0|2,0,1]=4 540 B5R0.1 C[C@@H](N)CC#N MCULE-8880445785 [1,0,0,0,0,0|2,0,1]=4 541 B5R0.1 C[C@@H](N)CC#N MCULE-9410509782 [1,0,0,0,0,0|2,0,1]=4 542 B5R0.1 C[C@@H](N)CCO MCULE-4224878672 [1,0,0,0,0,0|1,0,0]=2 543 B5R0.1 C[C@@H](N)CCO MCULE-5727539473 [1,0,0,0,0,0|1,0,0]=2 544 B5R0.1 C[C@@H](O)CC#N MCULE-2879004464 [1,0,0,0,0,0|1,0,1]=3 545 B5R0.1 C[C@@H](O)CCN MCULE-7588849994 [1,0,0,0,0,0|1,0,0]=2 546 B5R0.1 C[C@@H](O)CCN MCULE-7895006310 [1,0,0,0,0,0|1,0,0]=2 547 B5R0.1 C[C@@H](O)CCN MCULE-9071323255 [1,0,0,0,0,0|1,0,0]=2 548 B5R0.1 C[C@@H](O)CCN MCULE-9627550610 [1,0,0,0,0,0|1,0,0]=2 549 B5R0.1 C[C@@H](O)CCO MCULE-6277947442 [1,0,0,0,0,0|0,0,0]=1 550 B5R0.1 C[C@@H](O)CCO MCULE-9742368348 [1,0,0,0,0,0|0,0,0]=1 551 B5R0.1 C[C@@H](O)CON MCULE-3740397343 [1,0,0,0,0,0|2,0,0]=3 552 B5R0.1 C[C@@H](O)CON MCULE-8274376872 [1,0,0,0,0,0|2,0,0]=3 553 B5R0.1 C[C@H](N)CC#N MCULE-1876010727 [1,0,0,0,0,0|2,0,1]=4 554 B5R0.1 C[C@H](N)CC#N MCULE-6927344020 [1,0,0,0,0,0|2,0,1]=4 555 B5R0.1 C[C@H](N)CC#N MCULE-9082410813 [1,0,0,0,0,0|2,0,1]=4 556 B5R0.1 C[C@H](N)CC#N MCULE-9498047771 [1,0,0,0,0,0|2,0,1]=4 557 B5R0.1 C[C@H](N)CCO MCULE-1496375567 [1,0,0,0,0,0|1,0,0]=2 558 B5R0.1 C[C@H](N)CCO MCULE-4744824708 [1,0,0,0,0,0|1,0,0]=2 559 B5R0.1 C[C@H](N)CCO MCULE-7219173683 [1,0,0,0,0,0|1,0,0]=2 560 B5R0.1 C[C@H](N)CCO MCULE-9164942837 [1,0,0,0,0,0|1,0,0]=2 561 B5R0.1 C[C@H](O)CC#N MCULE-1968982761 [1,0,0,0,0,0|1,0,1]=3 562 B5R0.1 C[C@H](O)CCN MCULE-7570743309 [1,0,0,0,0,0|1,0,0]=2 563 B5R0.1 C[C@H](O)CCN MCULE-9428853702 [1,0,0,0,0,0|1,0,0]=2 564 B5R0.1 C[C@H](O)CCO MCULE-2504912618 [1,0,0,0,0,0|0,0,0]=1 565 B5R0.1 C[C@H](O)CCO MCULE-2958119786 [1,0,0,0,0,0|0,0,0]=1 566 B5R0.1 C[C@H](O)CON MCULE-4216605221 [1,0,0,0,0,0|2,0,0]=3 567 B5R0.1 C[C@H](O)CON MCULE-9863094719 [1,0,0,0,0,0|2,0,0]=3 568 B5R0.1 C[NH+](C)CCBr MCULE-4990293495 [1,0,0,0,0,0|3,0,0]=4 569 B5R0.1 C[S+](C)CCCl MCULE-1305595131 [1,0,0,0,0,0|3,0,0]=4 570 B5R0.1 C[S+](C)CCCl MCULE-9761617787 [1,0,0,0,0,0|3,0,0]=4 571 B5R0.1 C[S@@](=O)CCO MCULE-4485824334 [1,0,0,0,0,0|1,0,1]=3 572 B5R0.1 N=C(N)CCO MCULE-4567824707 [1,0,0,0,0,0|2,0,1]=4 573 B5R0.1 N=C(N)CCO MCULE-7139693715 [1,0,0,0,0,0|2,0,1]=4 574 B5R0.1 NC(=O)CCO MCULE-4026170350 [1,0,0,0,0,0|1,0,2]=4 575 B5R0.1 NCCC(=O)O MCULE-1344289084 [1,0,0,0,0,0|2,0,1]=4 576 B5R0.1 NCCC(=O)O MCULE-2298605337 [1,0,0,0,0,0|2,0,1]=4 577 B5R0.1 NCCC(=O)O MCULE-9375577631 [1,0,0,0,0,0|2,0,1]=4 578 B5R0.1 NCCC(F)F MCULE-3610134573 [1,0,0,0,0,0|3,0,0]=4 579 B5R0.1 NCCC(F)F MCULE-5561095460 [1,0,0,0,0,0|3,0,0]=4 580 B5R0.1 NCCP(=O)O MCULE-7093964616 [1,0,0,0,0,0|3,0,0]=4 581 B5R0.1 NCCS(=O)O MCULE-4372248641 [1,0,0,0,0,0|3,0,0]=4 582 B5R0.1 O=C(O)CCBr MCULE-2816055853 [1,0,0,0,0,0|2,0,1]=4 583 B5R0.1 O=C(O)CCCl MCULE-8511144183 [1,0,0,0,0,0|2,0,1]=4 584 B5R0.1 O=C(O)CCF MCULE-4382025684 [1,0,0,0,0,0|2,0,1]=4 585 B5R0.1 O=C(O)CCI MCULE-3371354708 [1,0,0,0,0,0|2,0,1]=4 586 B5R0.1 O=C(O)CCO MCULE-3428604829 [1,0,0,0,0,0|1,0,1]=3 587 B5R0.1 O=C(O)CCS MCULE-3211932163 [1,0,0,0,0,0|1,1,1]=4 588 B5R0.1 O=C(O)CNO MCULE-4437067339 [1,0,0,0,0,0|2,0,1]=4 589 B5R0.1 O=C([O-])CCO MCULE-4429611588 [1,0,0,0,0,0|1,0,2]=4 590 B5R0.1 O=N(=O)CCO MCULE-2060841405 [1,0,0,0,0,0|2,0,1]=4 591 B5R0.1 OCCC(F)F MCULE-9207688926 [1,0,0,0,0,0|2,0,0]=3 592 B5R0.1 [C@@H](C)(O)CCC MCULE-9717120293 [1,0,0,0,0,0|1,0,0]=2 593 B5R0.1 [C@@H](C)(O)CNC MCULE-2044067921 [1,0,0,0,0,0|2,0,0]=3 594 B5R0.1 [C@H](C)(O)CC#N MCULE-6894178072 [1,0,0,0,0,0|1,0,1]=3 595 B5R0.1 [C@H](C)(O)CCC MCULE-2689023898 [1,0,0,0,0,0|1,0,0]=2 596 B5R0.3 BrCC(Br)CBr MCULE-7323713039 [1,0,0,0,0,0|3,0,0]=4 597 B5R0.3 C#CC(N)CC MCULE-2327605941 [1,0,0,0,0,0|1,0,1]=3 598 B5R0.3 C#CC(N)CC MCULE-3572771620 [1,0,0,0,0,0|1,0,1]=3 599 B5R0.3 C#CC(N)CO MCULE-2442851523 [1,0,0,0,0,0|0,0,2]=3 600 B5R0.3 C#CC(N)CO MCULE-3866086926 [1,0,0,0,0,0|0,0,2]=3 601 B5R0.3 C#CC(O)CC MCULE-9890863731 [1,0,0,0,0,0|2,0,1]=4 602 B5R0.3 C#C[C@H](N)CO MCULE-2312982984 [1,0,0,0,0,0|0,0,2]=3 603 B5R0.3 C#C[C@H](N)CO MCULE-8124038281 [1,0,0,0,0,0|0,0,2]=3 604 B5R0.3 C#C[C@H](N)CO MCULE-8753140181 [1,0,0,0,0,0|0,0,2]=3 605 B5R0.3 C#C[C@H](N)CO MCULE-9874393436 [1,0,0,0,0,0|0,0,2]=3 606 B5R0.3 C=C(CC)CBr MCULE-1652422688 [1,0,0,0,0,0|2,0,1]=4 607 B5R0.3 C=C(CC)CC MCULE-9174509622 [1,0,0,0,0,0|2,0,1]=4 608 B5R0.3 C=C(CC)CN MCULE-2269385026 [1,0,0,0,0,0|2,0,1]=4 609 B5R0.3 C=C(CC)CN MCULE-3033447984 [1,0,0,0,0,0|2,0,1]=4 610 B5R0.3 C=C(CC)CO MCULE-8127766352 [1,0,0,0,0,0|1,0,1]=3 611 B5R0.3 C=C(CO)CBr MCULE-9563589949 [1,0,0,0,0,0|2,0,1]=4 612 B5R0.3 C=C(CO)CO MCULE-2682601949 [1,0,0,0,0,0|1,0,1]=3 613 B5R0.3 C=CC(C)CC MCULE-8112547661 [1,0,0,0,0,0|2,0,1]=4 614 B5R0.3 C=CC(N)CC MCULE-6270835453 [1,0,0,0,0,0|1,0,1]=3 615 B5R0.3 C=CC(N)CC MCULE-7920121163 [1,0,0,0,0,0|1,0,1]=3 616 B5R0.3 C=CC(N)CO MCULE-2457433196 [1,0,0,0,0,0|0,0,2]=3 617 B5R0.3 C=CC(N)CO MCULE-6697949182 [1,0,0,0,0,0|0,0,2]=3 618 B5R0.3 C=CC(N)CO MCULE-7137123222 [1,0,0,0,0,0|0,0,2]=3 619 B5R0.3 C=CC(N)CO MCULE-8388687355 [1,0,0,0,0,0|0,0,2]=3 620 B5R0.3 C=CC(O)CC MCULE-2794806228 [1,0,0,0,0,0|2,0,1]=4 621 B5R0.3 C=CC(O)CO MCULE-6172654550 [1,0,0,0,0,0|1,0,2]=4 622 B5R0.3 C=C[C@@H](N)CO MCULE-1000343618 [1,0,0,0,0,0|0,0,2]=3 623 B5R0.3 C=C[C@@H](N)CO MCULE-1074988940 [1,0,0,0,0,0|0,0,2]=3 624 B5R0.3 C=C[C@@H](N)CO MCULE-3685491078 [1,0,0,0,0,0|0,0,2]=3 625 B5R0.3 C=C[C@@H](N)CO MCULE-4969611575 [1,0,0,0,0,0|0,0,2]=3 626 B5R0.3 C=C[C@@H](O)CO MCULE-5957455616 [1,0,0,0,0,0|1,0,2]=4 627 B5R0.3 C=C[C@H](N)CO MCULE-2834725512 [1,0,0,0,0,0|0,0,2]=3 628 B5R0.3 C=C[C@H](N)CO MCULE-3281738311 [1,0,0,0,0,0|0,0,2]=3 629 B5R0.3 C=C[C@H](N)CO MCULE-3551585090 [1,0,0,0,0,0|0,0,2]=3 630 B5R0.3 C=C[C@H](N)CO MCULE-9055556349 [1,0,0,0,0,0|0,0,2]=3 631 B5R0.3 C=C[C@H](O)CO MCULE-6068203844 [1,0,0,0,0,0|1,0,2]=4 632 B5R0.3 C=C[C@H](O)CO MCULE-9367072182 [1,0,0,0,0,0|1,0,2]=4 633 B5R0.3 CC(C#N)CO MCULE-1644391554 [1,0,0,0,0,0|2,0,1]=4 634 B5R0.3 CC(CBr)CBr MCULE-7586113999 [1,0,0,0,0,0|3,0,0]=4 635 B5R0.3 CC(CCl)CBr MCULE-5101754687 [1,0,0,0,0,0|3,0,0]=4 636 B5R0.3 CC(CCl)CCl MCULE-1169456620 [1,0,0,0,0,0|3,0,0]=4 637 B5R0.3 CC(CI)CI MCULE-4568725580 [1,0,0,0,0,0|3,0,0]=4 638 B5R0.3 CC(CN)CCl MCULE-2423692318 [1,0,0,0,0,0|3,0,0]=4 639 B5R0.3 CC(CN)CCl MCULE-8419541212 [1,0,0,0,0,0|3,0,0]=4 640 B5R0.3 CC(CN)CN MCULE-1464804013 [1,0,0,0,0,0|3,0,0]=4 641 B5R0.3 CC(CN)CN MCULE-3273307813 [1,0,0,0,0,0|3,0,0]=4 642 B5R0.3 CC(CN)CO MCULE-5880795484 [1,0,0,0,0,0|2,0,0]=3 643 B5R0.3 CC(CN)CO MCULE-8083007887 [1,0,0,0,0,0|2,0,0]=3 644 B5R0.3 CC(CO)CBr MCULE-3815333295 [1,0,0,0,0,0|2,0,0]=3 645 B5R0.3 CC(CO)CBr MCULE-5695891877 [1,0,0,0,0,0|2,0,0]=3 646 B5R0.3 CC(CO)CO MCULE-2340730326 [1,0,0,0,0,0|1,0,0]=2 647 B5R0.3 CC(CO)CS MCULE-1990992504 [1,0,0,0,0,0|1,1,0]=3 648 B5R0.3 CC(CO)NN MCULE-3362748538 [1,0,0,0,0,0|3,0,0]=4 649 B5R0.3 CC(CO)NN MCULE-4440318216 [1,0,0,0,0,0|3,0,0]=4 650 B5R0.3 CC/C(=N/O)/C MCULE-9139048973 [1,0,0,0,0,0|2,0,1]=4 651 B5R0.3 CC/C(=N/O)/N MCULE-2794748611 [1,0,0,0,0,0|1,0,1]=3 652 B5R0.3 CC/C(=N/O)/N MCULE-7162577220 [1,0,0,0,0,0|1,0,1]=3 653 B5R0.3 CCC(=NO)C MCULE-1859652505 [1,0,0,0,0,0|2,0,1]=4 654 B5R0.3 CCC(=O)CBr MCULE-7825573294 [1,0,0,0,0,0|2,0,1]=4 655 B5R0.3 CCC(=O)CC MCULE-8236549739 [1,0,0,0,0,0|2,0,1]=4 656 B5R0.3 CCC(=O)CCl MCULE-9019890380 [1,0,0,0,0,0|2,0,1]=4 657 B5R0.3 CCC(=O)CN MCULE-1863418812 [1,0,0,0,0,0|2,0,1]=4 658 B5R0.3 CCC(=O)CN MCULE-5831164340 [1,0,0,0,0,0|2,0,1]=4 659 B5R0.3 CCC(=O)CO MCULE-8674894820 [1,0,0,0,0,0|1,0,1]=3 660 B5R0.3 CCC(=O)NO MCULE-1033164448 [1,0,0,0,0,0|2,0,1]=4 661 B5R0.3 CCC(Br)C#N MCULE-4015907163 [1,0,0,0,0,0|2,0,1]=4 662 B5R0.3 CCC(Br)C=O MCULE-3064952987 [1,0,0,0,0,0|1,0,2]=4 663 B5R0.3 CCC(Br)CBr MCULE-5254958560 [1,0,0,0,0,0|2,0,0]=3 664 B5R0.3 CCC(Br)CC MCULE-7435628721 [1,0,0,0,0,0|2,0,0]=3 665 B5R0.3 CCC(Br)CO MCULE-7211805716 [1,0,0,0,0,0|1,0,0]=2 666 B5R0.3 CCC(C)C#N MCULE-6204122967 [1,0,0,0,0,0|2,0,1]=4 667 B5R0.3 CCC(C)C=O MCULE-2523669899 [1,0,0,0,0,0|1,0,2]=4 668 B5R0.3 CCC(C)CBr MCULE-5451416952 [1,0,0,0,0,0|2,0,0]=3 669 B5R0.3 CCC(C)CC MCULE-2542807917 [1,0,0,0,0,0|2,0,0]=3 670 B5R0.3 CCC(C)CCl MCULE-7450386476 [1,0,0,0,0,0|2,0,0]=3 671 B5R0.3 CCC(C)CI MCULE-5444509280 [1,0,0,0,0,0|2,0,0]=3 672 B5R0.3 CCC(C)CN MCULE-2777327284 [1,0,0,0,0,0|2,0,0]=3 673 B5R0.3 CCC(C)CN MCULE-7014901600 [1,0,0,0,0,0|2,0,0]=3 674 B5R0.3 CCC(C)CO MCULE-6521026296 [1,0,0,0,0,0|1,0,0]=2 675 B5R0.3 CCC(C)CS MCULE-7795095685 [1,0,0,0,0,0|1,1,0]=3 676 B5R0.3 CCC(C)NC MCULE-2676584804 [1,0,0,0,0,0|3,0,0]=4 677 B5R0.3 CCC(C)NC MCULE-6158046887 [1,0,0,0,0,0|3,0,0]=4 678 B5R0.3 CCC(C)NN MCULE-6074476998 [1,0,0,0,0,0|3,0,0]=4 679 B5R0.3 CCC(C)NN MCULE-8130021960 [1,0,0,0,0,0|3,0,0]=4 680 B5R0.3 CCC(C)NN MCULE-8519369369 [1,0,0,0,0,0|3,0,0]=4 681 B5R0.3 CCC(C)NO MCULE-1247092627 [1,0,0,0,0,0|2,0,0]=3 682 B5R0.3 CCC(C)NO MCULE-6169819668 [1,0,0,0,0,0|2,0,0]=3 683 B5R0.3 CCC(C)OC MCULE-7354431606 [1,0,0,0,0,0|3,0,0]=4 684 B5R0.3 CCC(C)ON MCULE-2907890438 [1,0,0,0,0,0|3,0,0]=4 685 B5R0.3 CCC(C)ON MCULE-4364205813 [1,0,0,0,0,0|3,0,0]=4 686 B5R0.3 CCC(Cl)C#N MCULE-7185233128 [1,0,0,0,0,0|2,0,1]=4 687 B5R0.3 CCC(Cl)C=O MCULE-5238776091 [1,0,0,0,0,0|1,0,2]=4 688 B5R0.3 CCC(Cl)CCl MCULE-5122022797 [1,0,0,0,0,0|2,0,0]=3 689 B5R0.3 CCC(Cl)CO MCULE-1756262629 [1,0,0,0,0,0|1,0,0]=2 690 B5R0.3 CCC(F)CBr MCULE-3226052264 [1,0,0,0,0,0|2,0,0]=3 691 B5R0.3 CCC(F)CN MCULE-1291385596 [1,0,0,0,0,0|2,0,0]=3 692 B5R0.3 CCC(F)CN MCULE-7421331323 [1,0,0,0,0,0|2,0,0]=3 693 B5R0.3 CCC(I)CC MCULE-1119844552 [1,0,0,0,0,0|2,0,0]=3 694 B5R0.3 CCC(N)C#N MCULE-1350483203 [1,0,0,0,0,0|1,0,1]=3 695 B5R0.3 CCC(N)C#N MCULE-3867024162 [1,0,0,0,0,0|1,0,1]=3 696 B5R0.3 CCC(N)CBr MCULE-3567691924 [1,0,0,0,0,0|1,0,0]=2 697 B5R0.3 CCC(N)CC MCULE-4261937519 [1,0,0,0,0,0|1,0,0]=2 698 B5R0.3 CCC(N)CC MCULE-5899128891 [1,0,0,0,0,0|1,0,0]=2 699 B5R0.3 CCC(N)CN MCULE-6911484065 [1,0,0,0,0,0|1,0,0]=2 700 B5R0.3 CCC(N)CN MCULE-8376506697 [1,0,0,0,0,0|1,0,0]=2 701 B5R0.3 CCC(N)CO MCULE-1135809021 [1,0,0,0,0,0|0,0,0]=1 702 B5R0.3 CCC(N)CO MCULE-7588854111 [1,0,0,0,0,0|0,0,0]=1 703 B5R0.3 CCC(O)C#N MCULE-5389816542 [1,0,0,0,0,0|2,0,1]=4 704 B5R0.3 CCC(O)CBr MCULE-4205031860 [1,0,0,0,0,0|2,0,0]=3 705 B5R0.3 CCC(O)CC MCULE-5553645045 [1,0,0,0,0,0|2,0,0]=3 706 B5R0.3 CCC(O)CCl MCULE-8359810208 [1,0,0,0,0,0|2,0,0]=3 707 B5R0.3 CCC(O)CN MCULE-5197026448 [1,0,0,0,0,0|2,0,0]=3 708 B5R0.3 CCC(O)CO MCULE-2488753438 [1,0,0,0,0,0|1,0,0]=2 709 B5R0.3 CCC(O)CO MCULE-7297282094 [1,0,0,0,0,0|1,0,0]=2 710 B5R0.3 CCC(S)CC MCULE-2556259434 [1,0,0,0,0,0|2,0,0]=3 711 B5R0.3 CCC(S)CS MCULE-9332449950 [1,0,0,0,0,0|1,1,0]=3 712 B5R0.3 CCC([NH3+])CBr MCULE-6971158198 [1,0,0,0,0,0|1,0,1]=3 713 B5R0.3 CCN(C)CC MCULE-7207964917 [1,0,0,0,0,0|3,0,0]=4 714 B5R0.3 CCN(N)CC MCULE-9853386945 [1,0,0,0,0,0|2,0,0]=3 715 B5R0.3 CCN(N)CC MCULE-9962617398 [1,0,0,0,0,0|2,0,0]=3 716 B5R0.3 CCN(O)CC MCULE-6022935768 [1,0,0,0,0,0|3,0,0]=4 717 B5R0.3 CCP(=O)CC MCULE-2216184595 [1,0,0,0,0,0|3,0,0]=4 718 B5R0.3 CCP(Cl)CC MCULE-4484529264 [1,0,0,0,0,0|3,0,0]=4 719 B5R0.3 CCS(=O)CC MCULE-5102735179 [1,0,0,0,0,0|3,0,0]=4 720 B5R0.3 CC[C@@H](C)CBr MCULE-5675886072 [1,0,0,0,0,0|2,0,0]=3 721 B5R0.3 CC[C@@H](C)CN MCULE-7612408107 [1,0,0,0,0,0|2,0,0]=3 722 B5R0.3 CC[C@@H](C)CO MCULE-6700783698 [1,0,0,0,0,0|1,0,0]=2 723 B5R0.3 CC[C@@H](C)CO MCULE-8175790803 [1,0,0,0,0,0|1,0,0]=2 724 B5R0.3 CC[C@@H](N)C#N MCULE-3696119254 [1,0,0,0,0,0|1,0,1]=3 725 B5R0.3 CC[C@@H](N)C#N MCULE-5586041766 [1,0,0,0,0,0|1,0,1]=3 726 B5R0.3 CC[C@@H](N)CO MCULE-3821348404 [1,0,0,0,0,0|0,0,0]=1 727 B5R0.3 CC[C@@H](N)CO MCULE-7190248306 [1,0,0,0,0,0|0,0,0]=1 728 B5R0.3 CC[C@@H](O)CN MCULE-2854535153 [1,0,0,0,0,0|2,0,0]=3 729 B5R0.3 CC[C@@H](O)CN MCULE-8228547956 [1,0,0,0,0,0|2,0,0]=3 730 B5R0.3 CC[C@@H](O)CO MCULE-3948477298 [1,0,0,0,0,0|1,0,0]=2 731 B5R0.3 CC[C@@H](O)CO MCULE-5098109795 [1,0,0,0,0,0|1,0,0]=2 732 B5R0.3 CC[C@H](C)C#N MCULE-9118306872 [1,0,0,0,0,0|2,0,1]=4 733 B5R0.3 CC[C@H](C)CBr MCULE-3263714447 [1,0,0,0,0,0|2,0,0]=3 734 B5R0.3 CC[C@H](C)CBr MCULE-3384648570 [1,0,0,0,0,0|2,0,0]=3 735 B5R0.3 CC[C@H](C)CCl MCULE-6795758745 [1,0,0,0,0,0|2,0,0]=3 736 B5R0.3 CC[C@H](C)CCl MCULE-8147276830 [1,0,0,0,0,0|2,0,0]=3 737 B5R0.3 CC[C@H](C)CI MCULE-9690776923 [1,0,0,0,0,0|2,0,0]=3 738 B5R0.3 CC[C@H](C)CN MCULE-1380819951 [1,0,0,0,0,0|2,0,0]=3 739 B5R0.3 CC[C@H](C)CN MCULE-1396096112 [1,0,0,0,0,0|2,0,0]=3 740 B5R0.3 CC[C@H](C)CN MCULE-2971933862 [1,0,0,0,0,0|2,0,0]=3 741 B5R0.3 CC[C@H](C)CN MCULE-3698084674 [1,0,0,0,0,0|2,0,0]=3 742 B5R0.3 CC[C@H](C)CO MCULE-1493424061 [1,0,0,0,0,0|1,0,0]=2 743 B5R0.3 CC[C@H](C)CO MCULE-6879443668 [1,0,0,0,0,0|1,0,0]=2 744 B5R0.3 CC[C@H](N)C#N MCULE-4431283179 [1,0,0,0,0,0|1,0,1]=3 745 B5R0.3 CC[C@H](N)C#N MCULE-8842235277 [1,0,0,0,0,0|1,0,1]=3 746 B5R0.3 CC[C@H](N)CF MCULE-3646304583 [1,0,0,0,0,0|1,0,0]=2 747 B5R0.3 CC[C@H](N)CF MCULE-4493834638 [1,0,0,0,0,0|1,0,0]=2 748 B5R0.3 CC[C@H](N)CO MCULE-5500083870 [1,0,0,0,0,0|0,0,0]=1 749 B5R0.3 CC[C@H](N)CO MCULE-6312512384 [1,0,0,0,0,0|0,0,0]=1 750 B5R0.3 CC[C@H](O)CN MCULE-4385930741 [1,0,0,0,0,0|2,0,0]=3 751 B5R0.3 CC[C@H](O)CO MCULE-2194264642 [1,0,0,0,0,0|1,0,0]=2 752 B5R0.3 CC[C@H](O)CO MCULE-5503575962 [1,0,0,0,0,0|1,0,0]=2 753 B5R0.3 CNC(=N)CO MCULE-3239749882 [1,0,0,0,0,0|1,0,2]=4 754 B5R0.3 CNC(=O)CO MCULE-5899226107 [1,0,0,0,0,0|2,0,1]=4 755 B5R0.3 CNC(C)CN MCULE-1599162912 [1,0,0,0,0,0|3,0,0]=4 756 B5R0.3 CNC(C)CN MCULE-1637391260 [1,0,0,0,0,0|3,0,0]=4 757 B5R0.3 CNC(C)CO MCULE-3841057780 [1,0,0,0,0,0|2,0,0]=3 758 B5R0.3 CNC(C)CO MCULE-6474892275 [1,0,0,0,0,0|2,0,0]=3 759 B5R0.3 CN[C@@H](C)CO MCULE-1633741835 [1,0,0,0,0,0|2,0,0]=3 760 B5R0.3 CN[C@@H](C)CO MCULE-6736108875 [1,0,0,0,0,0|2,0,0]=3 761 B5R0.3 CN[C@@H](C)CO MCULE-7554801630 [1,0,0,0,0,0|2,0,0]=3 762 B5R0.3 CN[C@@H](C)CO MCULE-9312521497 [1,0,0,0,0,0|2,0,0]=3 763 B5R0.3 CN[C@H](C)CO MCULE-2402322400 [1,0,0,0,0,0|2,0,0]=3 764 B5R0.3 CN[C@H](C)CO MCULE-4362091386 [1,0,0,0,0,0|2,0,0]=3 765 B5R0.3 CN[C@H](C)CO MCULE-5426855707 [1,0,0,0,0,0|2,0,0]=3 766 B5R0.3 CN[C@H](C)CO MCULE-9777995604 [1,0,0,0,0,0|2,0,0]=3 767 B5R0.3 COC(=O)CO MCULE-8734582763 [1,0,0,0,0,0|2,0,1]=4 768 B5R0.3 COC(C)CBr MCULE-6831960550 [1,0,0,0,0,0|3,0,0]=4 769 B5R0.3 COC(C)CCl MCULE-6614968111 [1,0,0,0,0,0|3,0,0]=4 770 B5R0.3 COC(C)CI MCULE-9561627722 [1,0,0,0,0,0|3,0,0]=4 771 B5R0.3 COC(C)CN MCULE-1378513525 [1,0,0,0,0,0|3,0,0]=4 772 B5R0.3 COC(C)CN MCULE-6114730248 [1,0,0,0,0,0|3,0,0]=4 773 B5R0.3 COC(C)CN MCULE-7516064224 [1,0,0,0,0,0|3,0,0]=4 774 B5R0.3 COC(C)CN MCULE-8277408054 [1,0,0,0,0,0|3,0,0]=4 775 B5R0.3 COC(C)CO MCULE-5269990702 [1,0,0,0,0,0|2,0,0]=3 776 B5R0.3 COC(C)CO MCULE-7173093332 [1,0,0,0,0,0|2,0,0]=3 777 B5R0.3 CO[C@@H](C)CN MCULE-1448950160 [1,0,0,0,0,0|3,0,0]=4 778 B5R0.3 CO[C@@H](C)CN MCULE-3784073249 [1,0,0,0,0,0|3,0,0]=4 779 B5R0.3 CO[C@@H](C)CN MCULE-6073633931 [1,0,0,0,0,0|3,0,0]=4 780 B5R0.3 CO[C@@H](C)CN MCULE-9516756218 [1,0,0,0,0,0|3,0,0]=4 781 B5R0.3 CO[C@@H](C)CO MCULE-5600457791 [1,0,0,0,0,0|2,0,0]=3 782 B5R0.3 CO[C@@H](C)CO MCULE-7981152382 [1,0,0,0,0,0|2,0,0]=3 783 B5R0.3 CO[C@H](C)CN MCULE-4143562009 [1,0,0,0,0,0|3,0,0]=4 784 B5R0.3 CO[C@H](C)CN MCULE-4184510827 [1,0,0,0,0,0|3,0,0]=4 785 B5R0.3 CO[C@H](C)CN MCULE-9625722424 [1,0,0,0,0,0|3,0,0]=4 786 B5R0.3 CO[C@H](C)CN MCULE-9882567615 [1,0,0,0,0,0|3,0,0]=4 787 B5R0.3 CO[C@H](C)CO MCULE-4211976708 [1,0,0,0,0,0|2,0,0]=3 788 B5R0.3 CO[C@H](C)CO MCULE-7592020348 [1,0,0,0,0,0|2,0,0]=3 789 B5R0.3 CSC(C)CN MCULE-8841622109 [1,0,0,0,0,0|3,0,0]=4 790 B5R0.3 CSC(C)CO MCULE-4646435737 [1,0,0,0,0,0|2,0,0]=3 791 B5R0.3 C[C@@H](CN)CO MCULE-4662215148 [1,0,0,0,0,0|2,0,0]=3 792 B5R0.3 C[C@@H](CN)CO MCULE-7870198689 [1,0,0,0,0,0|2,0,0]=3 793 B5R0.3 C[C@@H](CO)CBr MCULE-3691541800 [1,0,0,0,0,0|2,0,0]=3 794 B5R0.3 C[C@@H](CO)CBr MCULE-4447849056 [1,0,0,0,0,0|2,0,0]=3 795 B5R0.3 C[C@H](CO)CBr MCULE-4031825779 [1,0,0,0,0,0|2,0,0]=3 796 B5R0.3 C[C@H](CO)CBr MCULE-6846167456 [1,0,0,0,0,0|2,0,0]=3 797 B5R0.3 ClCC(Br)CBr MCULE-2454576835 [1,0,0,0,0,0|3,0,0]=4 798 B5R0.3 ClCC(Cl)CCl MCULE-3839333809 [1,0,0,0,0,0|3,0,0]=4 799 B5R0.3 FCC(Br)CBr MCULE-3296621964 [1,0,0,0,0,0|3,0,0]=4 800 B5R0.3 FCC(Cl)CF MCULE-6083002482 [1,0,0,0,0,0|3,0,0]=4 801 B5R0.3 FCC(I)CF MCULE-1837926612 [1,0,0,0,0,0|3,0,0]=4 802 B5R0.3 N#CC(N)CO MCULE-5918855868 [1,0,0,0,0,0|1,0,1]=3 803 B5R0.3 N#CC(N)CO MCULE-8439000158 [1,0,0,0,0,0|1,0,1]=3 804 B5R0.3 N/C(=N/O)/CF MCULE-8149459701 [1,0,0,0,0,0|2,0,1]=4 805 B5R0.3 N/C(=N/O)/CO MCULE-1684161600 [1,0,0,0,0,0|1,0,1]=3 806 B5R0.3 N/C(=N\O)/CCl MCULE-4486676288 [1,0,0,0,0,0|2,0,1]=4 807 B5R0.3 NC(CF)CF MCULE-4671221738 [1,0,0,0,0,0|2,0,0]=3 808 B5R0.3 NC(CF)CF MCULE-8916274721 [1,0,0,0,0,0|2,0,0]=3 809 B5R0.3 NC(CO)CF MCULE-3756808200 [1,0,0,0,0,0|1,0,0]=2 810 B5R0.3 NC(CO)CF MCULE-9468719402 [1,0,0,0,0,0|1,0,0]=2 811 B5R0.3 NC(CO)CO MCULE-1559988016 [1,0,0,0,0,0|0,0,0]=1 812 B5R0.3 NC(CO)CO MCULE-4954119952 [1,0,0,0,0,0|0,0,0]=1 813 B5R0.3 NCC(Br)CBr MCULE-4507622045 [1,0,0,0,0,0|3,0,0]=4 814 B5R0.3 NCC(Br)CBr MCULE-9707598399 [1,0,0,0,0,0|3,0,0]=4 815 B5R0.3 NCC(F)CN MCULE-8855486562 [1,0,0,0,0,0|3,0,0]=4 816 B5R0.3 NCC(F)CO MCULE-6156319956 [1,0,0,0,0,0|2,0,0]=3 817 B5R0.3 NCC(F)CO MCULE-7472307328 [1,0,0,0,0,0|2,0,0]=3 818 B5R0.3 NCC(O)CCl MCULE-1566349721 [1,0,0,0,0,0|3,0,0]=4 819 B5R0.3 NCC(O)CCl MCULE-3532626994 [1,0,0,0,0,0|3,0,0]=4 820 B5R0.3 NCC(O)CCl MCULE-5045913208 [1,0,0,0,0,0|3,0,0]=4 821 B5R0.3 NCC(O)CCl MCULE-7168455596 [1,0,0,0,0,0|3,0,0]=4 822 B5R0.3 NCC(O)CF MCULE-7529777116 [1,0,0,0,0,0|3,0,0]=4 823 B5R0.3 NCC(O)CF MCULE-8092861019 [1,0,0,0,0,0|3,0,0]=4 824 B5R0.3 NCC(O)CN MCULE-4689186078 [1,0,0,0,0,0|3,0,0]=4 825 B5R0.3 NCC(O)CO MCULE-2689763818 [1,0,0,0,0,0|2,0,0]=3 826 B5R0.3 NCC(O)CO MCULE-6096620010 [1,0,0,0,0,0|2,0,0]=3 827 B5R0.3 NCC(O)CO MCULE-7307777212 [1,0,0,0,0,0|2,0,0]=3 828 B5R0.3 NC[C@@H](F)CO MCULE-3273711180 [1,0,0,0,0,0|2,0,0]=3 829 B5R0.3 NC[C@@H](F)CO MCULE-6673969522 [1,0,0,0,0,0|2,0,0]=3 830 B5R0.3 NC[C@@H](N)CO MCULE-7333007012 [1,0,0,0,0,0|1,0,0]=2 831 B5R0.3 NC[C@@H](N)CO MCULE-9200386635 [1,0,0,0,0,0|1,0,0]=2 832 B5R0.3 NC[C@@H](O)CCl MCULE-1905964392 [1,0,0,0,0,0|3,0,0]=4 833 B5R0.3 NC[C@@H](O)CCl MCULE-5592096864 [1,0,0,0,0,0|3,0,0]=4 834 B5R0.3 NC[C@@H](O)CCl MCULE-5723497450 [1,0,0,0,0,0|3,0,0]=4 835 B5R0.3 NC[C@@H](O)CCl MCULE-7112738263 [1,0,0,0,0,0|3,0,0]=4 836 B5R0.3 NC[C@@H](O)CO MCULE-7897503444 [1,0,0,0,0,0|2,0,0]=3 837 B5R0.3 NC[C@@H](O)CO MCULE-8044821624 [1,0,0,0,0,0|2,0,0]=3 838 B5R0.3 NC[C@@H](O)CO MCULE-9443333756 [1,0,0,0,0,0|2,0,0]=3 839 B5R0.3 NC[C@H](F)CO MCULE-2595736378 [1,0,0,0,0,0|2,0,0]=3 840 B5R0.3 NC[C@H](F)CO MCULE-7417074078 [1,0,0,0,0,0|2,0,0]=3 841 B5R0.3 NC[C@H](F)CO MCULE-7938231499 [1,0,0,0,0,0|2,0,0]=3 842 B5R0.3 NC[C@H](N)CO MCULE-1060049548 [1,0,0,0,0,0|1,0,0]=2 843 B5R0.3 NC[C@H](N)CO MCULE-9942356112 [1,0,0,0,0,0|1,0,0]=2 844 B5R0.3 NC[C@H](O)CBr MCULE-4679771824 [1,0,0,0,0,0|3,0,0]=4 845 B5R0.3 NC[C@H](O)CBr MCULE-4785059460 [1,0,0,0,0,0|3,0,0]=4 846 B5R0.3 NC[C@H](O)CCl MCULE-3625478007 [1,0,0,0,0,0|3,0,0]=4 847 B5R0.3 NC[C@H](O)CCl MCULE-6692503791 [1,0,0,0,0,0|3,0,0]=4 848 B5R0.3 NC[C@H](O)CO MCULE-5835551322 [1,0,0,0,0,0|2,0,0]=3 849 B5R0.3 NC[C@H](O)CO MCULE-6021133883 [1,0,0,0,0,0|2,0,0]=3 850 B5R0.3 NC[C@H](O)CO MCULE-7461568841 [1,0,0,0,0,0|2,0,0]=3 851 B5R0.3 NC[C@H](O)CO MCULE-8112454132 [1,0,0,0,0,0|2,0,0]=3 852 B5R0.3 N[C@@H](CO)CF MCULE-1103631898 [1,0,0,0,0,0|1,0,0]=2 853 B5R0.3 N[C@@H](CO)CF MCULE-1137418239 [1,0,0,0,0,0|1,0,0]=2 854 B5R0.3 N[C@@H](CO)CF MCULE-7452275160 [1,0,0,0,0,0|1,0,0]=2 855 B5R0.3 N[C@@H](CO)CF MCULE-9154795583 [1,0,0,0,0,0|1,0,0]=2 856 B5R0.3 N[C@H](CO)CF MCULE-1070351343 [1,0,0,0,0,0|1,0,0]=2 857 B5R0.3 N[C@H](CO)CF MCULE-4715788718 [1,0,0,0,0,0|1,0,0]=2 858 B5R0.3 N[C@H](CO)CF MCULE-8220585202 [1,0,0,0,0,0|1,0,0]=2 859 B5R0.3 N[C@H](CO)CF MCULE-8991857376 [1,0,0,0,0,0|1,0,0]=2 860 B5R0.3 O=C(CO)CO MCULE-7188810449 [1,0,0,0,0,0|1,0,1]=3 861 B5R0.3 O=CC(O)CO MCULE-9581740191 [1,0,0,0,0,0|1,0,2]=4 862 B5R0.3 O=C[C@@H](O)CO MCULE-3883857491 [1,0,0,0,0,0|1,0,2]=4 863 B5R0.3 O=C[C@@H](O)CO MCULE-7852783182 [1,0,0,0,0,0|1,0,2]=4 864 B5R0.3 O=C[C@H](O)CO MCULE-4574984840 [1,0,0,0,0,0|1,0,2]=4 865 B5R0.3 OC(CBr)CBr MCULE-9071238259 [1,0,0,0,0,0|3,0,0]=4 866 B5R0.3 OC(CCl)CBr MCULE-3844020597 [1,0,0,0,0,0|3,0,0]=4 867 B5R0.3 OC(CCl)CCl MCULE-7873018520 [1,0,0,0,0,0|3,0,0]=4 868 B5R0.3 OC(CCl)CI MCULE-3276637880 [1,0,0,0,0,0|3,0,0]=4 869 B5R0.3 OC(CF)CBr MCULE-3915880352 [1,0,0,0,0,0|3,0,0]=4 870 B5R0.3 OC(CF)CCl MCULE-6441743377 [1,0,0,0,0,0|3,0,0]=4 871 B5R0.3 OC(CF)CF MCULE-3360341794 [1,0,0,0,0,0|3,0,0]=4 872 B5R0.3 OC(CI)CI MCULE-6842895270 [1,0,0,0,0,0|3,0,0]=4 873 B5R0.3 OCC(Br)CBr MCULE-9616107956 [1,0,0,0,0,0|2,0,0]=3 874 B5R0.3 OCC(Br)CO MCULE-9272628834 [1,0,0,0,0,0|1,0,0]=2 875 B5R0.3 OCC(Cl)CCl MCULE-2120585852 [1,0,0,0,0,0|2,0,0]=3 876 B5R0.3 OCC(Cl)CO MCULE-7487945326 [1,0,0,0,0,0|1,0,0]=2 877 B5R0.3 OCC(F)CBr MCULE-2889937576 [1,0,0,0,0,0|2,0,0]=3 878 B5R0.3 OCC(F)CO MCULE-2970537690 [1,0,0,0,0,0|1,0,0]=2 879 B5R0.3 OCC(O)CBr MCULE-9116190245 [1,0,0,0,0,0|2,0,0]=3 880 B5R0.3 OCC(O)CCl MCULE-7895191088 [1,0,0,0,0,0|2,0,0]=3 881 B5R0.3 OCC(O)CCl MCULE-8992242488 [1,0,0,0,0,0|2,0,0]=3 882 B5R0.3 OCC(O)CF MCULE-3575952891 [1,0,0,0,0,0|2,0,0]=3 883 B5R0.3 OCC(O)CF MCULE-8981430411 [1,0,0,0,0,0|2,0,0]=3 884 B5R0.3 OCC(O)CI MCULE-6705992930 [1,0,0,0,0,0|2,0,0]=3 885 B5R0.3 OCC(O)CO MCULE-6349111826 [1,0,0,0,0,0|1,0,0]=2 886 B5R0.3 OCC(O)CS MCULE-6300188207 [1,0,0,0,0,0|1,1,0]=3 887 B5R0.3 OCC(S)CS MCULE-9735516119 [1,0,0,0,0,0|1,1,0]=3 888 B5R0.3 OC[C@@H](O)CCl MCULE-1311776512 [1,0,0,0,0,0|2,0,0]=3 889 B5R0.3 OC[C@@H](O)CCl MCULE-2685107404 [1,0,0,0,0,0|2,0,0]=3 890 B5R0.3 OC[C@@H](O)CF MCULE-3274443966 [1,0,0,0,0,0|2,0,0]=3 891 B5R0.3 OC[C@@H](O)CF MCULE-5908395855 [1,0,0,0,0,0|2,0,0]=3 892 B5R0.3 OC[C@H](O)CBr MCULE-5035020863 [1,0,0,0,0,0|2,0,0]=3 893 B5R0.3 OC[C@H](O)CCl MCULE-2098232262 [1,0,0,0,0,0|2,0,0]=3 894 B5R0.3 OC[C@H](O)CCl MCULE-5801605349 [1,0,0,0,0,0|2,0,0]=3 895 B5R0.3 OC[C@H](O)CF MCULE-3309672397 [1,0,0,0,0,0|2,0,0]=3 896 B5R0.3 OC[C@H](O)CF MCULE-7695783253 [1,0,0,0,0,0|2,0,0]=3 897 B5R0.3 O[C@@H](CCl)CI MCULE-5324720097 [1,0,0,0,0,0|3,0,0]=4 898 B5R0.3 O[C@H](CCl)CI MCULE-2790157830 [1,0,0,0,0,0|3,0,0]=4 899 B5R0.3 [C@H](O)(CN)CCl MCULE-1220791610 [1,0,0,0,0,0|3,0,0]=4 900 B5R0.3 [C@H](O)(CN)CCl MCULE-4106901858 [1,0,0,0,0,0|3,0,0]=4 901 B5R0.5 C=C(C)C(C)C MCULE-2535284443 [1,0,0,0,0,0|2,0,1]=4 902 B5R0.5 C=C(C)C(C)Cl MCULE-5294924458 [1,0,0,0,0,0|2,0,1]=4 903 B5R0.5 C=C(C)C(C)O MCULE-3768810742 [1,0,0,0,0,0|1,0,1]=3 904 B5R0.5 CC(=O)C(C)Br MCULE-3764525199 [1,0,0,0,0,0|1,0,2]=4 905 B5R0.5 CC(=O)C(C)C MCULE-5982732938 [1,0,0,0,0,0|1,0,2]=4 906 B5R0.5 CC(=O)C(C)Cl MCULE-5065840606 [1,0,0,0,0,0|1,0,2]=4 907 B5R0.5 CC(=O)C(C)F MCULE-2129925918 [1,0,0,0,0,0|1,0,2]=4 908 B5R0.5 CC(=O)C(C)N MCULE-5716124999 [1,0,0,0,0,0|0,0,2]=3 909 B5R0.5 CC(=O)C(C)N MCULE-9248002534 [1,0,0,0,0,0|0,0,2]=3 910 B5R0.5 CC(=O)C(C)O MCULE-5374414264 [1,0,0,0,0,0|1,0,1]=3 911 B5R0.5 CC(=O)C(C)S MCULE-2716722148 [1,0,0,0,0,0|1,0,2]=4 912 B5R0.5 CC(=O)N(C)N MCULE-2447375293 [1,0,0,0,0,0|1,0,2]=4 913 B5R0.5 CC(=O)[C@H](C)N MCULE-2609095078 [1,0,0,0,0,0|0,0,2]=3 914 B5R0.5 CC(=O)[C@H](C)N MCULE-6039921944 [1,0,0,0,0,0|0,0,2]=3 915 B5R0.5 CC(=O)[C@H](C)N MCULE-6387613992 [1,0,0,0,0,0|0,0,2]=3 916 B5R0.5 CC(=O)[C@H](C)N MCULE-7052375323 [1,0,0,0,0,0|0,0,2]=3 917 B5R0.5 CC(Br)C(=O)N MCULE-9226586148 [1,0,0,0,0,0|1,0,2]=4 918 B5R0.5 CC(Br)C(=O)O MCULE-3935837943 [1,0,0,0,0,0|2,0,1]=4 919 B5R0.5 CC(Br)C(=O)O MCULE-6068441065 [1,0,0,0,0,0|2,0,1]=4 920 B5R0.5 CC(Br)C(C)Br MCULE-8272754345 [1,0,0,0,0,0|2,0,0]=3 921 B5R0.5 CC(Br)C(Cl)Br MCULE-8471336753 [1,0,0,0,0,0|3,0,0]=4 922 B5R0.5 CC(Br)C(Cl)Cl MCULE-1643063989 [1,0,0,0,0,0|3,0,0]=4 923 B5R0.5 CC(C)B(O)O MCULE-1255589444 [1,0,0,0,0,0|3,0,0]=4 924 B5R0.5 CC(C)C(=N)N MCULE-2464075086 [1,0,0,0,0,0|2,0,1]=4 925 B5R0.5 CC(C)C(=N)N MCULE-6743996580 [1,0,0,0,0,0|2,0,1]=4 926 B5R0.5 CC(C)C(=O)N MCULE-9773835068 [1,0,0,0,0,0|1,0,2]=4 927 B5R0.5 CC(C)C(=O)O MCULE-7783770647 [1,0,0,0,0,0|2,0,1]=4 928 B5R0.5 CC(C)C(=S)N MCULE-3546856315 [1,0,0,0,0,0|1,1,1]=4 929 B5R0.5 CC(C)C(C)Br MCULE-8934980523 [1,0,0,0,0,0|2,0,0]=3 930 B5R0.5 CC(C)C(C)C MCULE-7887644548 [1,0,0,0,0,0|2,0,0]=3 931 B5R0.5 CC(C)C(C)I MCULE-7528764320 [1,0,0,0,0,0|2,0,0]=3 932 B5R0.5 CC(C)C(C)N MCULE-1630754475 [1,0,0,0,0,0|1,0,0]=2 933 B5R0.5 CC(C)C(C)N MCULE-1801901816 [1,0,0,0,0,0|1,0,0]=2 934 B5R0.5 CC(C)C(C)N MCULE-3544463874 [1,0,0,0,0,0|1,0,0]=2 935 B5R0.5 CC(C)C(C)N MCULE-4774844065 [1,0,0,0,0,0|1,0,0]=2 936 B5R0.5 CC(C)C(C)O MCULE-4829392845 [1,0,0,0,0,0|1,0,0]=2 937 B5R0.5 CC(C)C(C)S MCULE-7489203323 [1,0,0,0,0,0|1,1,0]=3 938 B5R0.5 CC(C)C(I)I MCULE-6684789578 [1,0,0,0,0,0|3,0,0]=4 939 B5R0.5 CC(C)N(C)C MCULE-1993251030 [1,0,0,0,0,0|3,0,0]=4 940 B5R0.5 CC(C)S(=O)N MCULE-8425110407 [1,0,0,0,0,0|2,0,1]=4 941 B5R0.5 CC(C)S(=O)O MCULE-5200056082 [1,0,0,0,0,0|3,0,0]=4 942 B5R0.5 CC(C)[C@@H](C)N MCULE-1953734886 [1,0,0,0,0,0|1,0,0]=2 943 B5R0.5 CC(C)[C@@H](C)N MCULE-3105334197 [1,0,0,0,0,0|1,0,0]=2 944 B5R0.5 CC(C)[C@@H](C)N MCULE-9470429569 [1,0,0,0,0,0|1,0,0]=2 945 B5R0.5 CC(C)[C@@H](C)O MCULE-3565458505 [1,0,0,0,0,0|1,0,0]=2 946 B5R0.5 CC(C)[C@H](C)N MCULE-2859174363 [1,0,0,0,0,0|1,0,0]=2 947 B5R0.5 CC(C)[C@H](C)N MCULE-3034457659 [1,0,0,0,0,0|1,0,0]=2 948 B5R0.5 CC(C)[C@H](C)N MCULE-5904658917 [1,0,0,0,0,0|1,0,0]=2 949 B5R0.5 CC(C)[C@H](C)O MCULE-1553214756 [1,0,0,0,0,0|1,0,0]=2 950 B5R0.5 CC(C)[C@H](C)O MCULE-8141633445 [1,0,0,0,0,0|1,0,0]=2 951 B5R0.5 CC(Cl)C(=N)N MCULE-2357555185 [1,0,0,0,0,0|2,0,1]=4 952 B5R0.5 CC(Cl)C(=N)N MCULE-5302250002 [1,0,0,0,0,0|2,0,1]=4 953 B5R0.5 CC(Cl)C(=O)N MCULE-5322078211 [1,0,0,0,0,0|1,0,2]=4 954 B5R0.5 CC(Cl)C(=O)O MCULE-3597230803 [1,0,0,0,0,0|2,0,1]=4 955 B5R0.5 CC(Cl)C(=O)O MCULE-5449120618 [1,0,0,0,0,0|2,0,1]=4 956 B5R0.5 CC(Cl)C(C)Cl MCULE-6954506926 [1,0,0,0,0,0|2,0,0]=3 957 B5R0.5 CC(Cl)C(Cl)Cl MCULE-1848161215 [1,0,0,0,0,0|3,0,0]=4 958 B5R0.5 CC(F)C(=O)O MCULE-7334922730 [1,0,0,0,0,0|2,0,1]=4 959 B5R0.5 CC(I)C(=O)N MCULE-8608495554 [1,0,0,0,0,0|1,0,2]=4 960 B5R0.5 CC(N)C(=O)N MCULE-1264398810 [1,0,0,0,0,0|1,0,2]=4 961 B5R0.5 CC(N)C(=O)N MCULE-2251123672 [1,0,0,0,0,0|1,0,2]=4 962 B5R0.5 CC(N)C(=O)N MCULE-2273926073 [1,0,0,0,0,0|1,0,2]=4 963 B5R0.5 CC(N)C(=O)N MCULE-5340923071 [1,0,0,0,0,0|1,0,2]=4 964 B5R0.5 CC(N)C(=O)N MCULE-6061233032 [1,0,0,0,0,0|1,0,2]=4 965 B5R0.5 CC(N)C(=O)N MCULE-9273221837 [1,0,0,0,0,0|1,0,2]=4 966 B5R0.5 CC(N)C(=O)O MCULE-3498369789 [1,0,0,0,0,0|1,0,1]=3 967 B5R0.5 CC(N)C(=O)O MCULE-3809839392 [1,0,0,0,0,0|1,0,1]=3 968 B5R0.5 CC(N)C(=O)O MCULE-4751903561 [1,0,0,0,0,0|1,0,1]=3 969 B5R0.5 CC(N)C(=O)O MCULE-6963397848 [1,0,0,0,0,0|1,0,1]=3 970 B5R0.5 CC(N)C(C)N MCULE-6724099648 [1,0,0,0,0,0|1,0,0]=2 971 B5R0.5 CC(N)C(C)O MCULE-3512899672 [1,0,0,0,0,0|0,0,0]=1 972 B5R0.5 CC(N)C(C)O MCULE-6286987696 [1,0,0,0,0,0|0,0,0]=1 973 B5R0.5 CC(N)C(F)F MCULE-5449346446 [1,0,0,0,0,0|2,0,0]=3 974 B5R0.5 CC(O)C(=N)N MCULE-4358846536 [1,0,0,0,0,0|1,0,1]=3 975 B5R0.5 CC(O)C(=N)N MCULE-5644516205 [1,0,0,0,0,0|1,0,1]=3 976 B5R0.5 CC(O)C(=O)N MCULE-6247123668 [1,0,0,0,0,0|0,0,2]=3 977 B5R0.5 CC(O)C(=O)N MCULE-7823792358 [1,0,0,0,0,0|0,0,2]=3 978 B5R0.5 CC(O)C(=O)O MCULE-3922256529 [1,0,0,0,0,0|1,0,1]=3 979 B5R0.5 CC(O)C(=O)O MCULE-5387110670 [1,0,0,0,0,0|1,0,1]=3 980 B5R0.5 CC(O)C(=O)[O-] MCULE-1056716990 [1,0,0,0,0,0|1,0,2]=4 981 B5R0.5 CC(O)C(=O)[O-] MCULE-8184872865 [1,0,0,0,0,0|1,0,2]=4 982 B5R0.5 CC(O)C(=O)[O-] MCULE-8730993694 [1,0,0,0,0,0|1,0,2]=4 983 B5R0.5 CC(O)C(C)Br MCULE-1140424623 [1,0,0,0,0,0|1,0,0]=2 984 B5R0.5 CC(O)C(C)Cl MCULE-3352632568 [1,0,0,0,0,0|1,0,0]=2 985 B5R0.5 CC(O)C(C)O MCULE-2858785316 [1,0,0,0,0,0|1,0,0]=2 986 B5R0.5 CC(O)C(C)S MCULE-3741743569 [1,0,0,0,0,0|1,0,0]=2 987 B5R0.5 CC(O)C(F)F MCULE-1258374037 [1,0,0,0,0,0|2,0,0]=3 988 B5R0.5 CC(S)C(=O)N MCULE-1465182001 [1,0,0,0,0,0|0,1,2]=4 989 B5R0.5 CC(S)C(=O)O MCULE-6944738352 [1,0,0,0,0,0|1,1,1]=4 990 B5R0.5 CC(S)C(C)S MCULE-3508721208 [1,0,0,0,0,0|1,1,0]=3 991 B5R0.5 C[C@@H](Br)C(=O)O MCULE-8303539222 [1,0,0,0,0,0|2,0,1]=4 992 B5R0.5 C[C@@H](Br)C(=O)O MCULE-8530283309 [1,0,0,0,0,0|2,0,1]=4 993 B5R0.5 C[C@@H](Cl)C(=O)O MCULE-6578788045 [1,0,0,0,0,0|2,0,1]=4 994 B5R0.5 C[C@@H](Cl)C(=O)O MCULE-8314108697 [1,0,0,0,0,0|2,0,1]=4 995 B5R0.5 C[C@@H](F)C(=O)N MCULE-1505685009 [1,0,0,0,0,0|1,0,2]=4 996 B5R0.5 C[C@@H](N)C(=O)N MCULE-4677983549 [1,0,0,0,0,0|1,0,2]=4 997 B5R0.5 C[C@@H](N)C(=O)N MCULE-6112443507 [1,0,0,0,0,0|1,0,2]=4 998 B5R0.5 C[C@@H](N)C(=O)N MCULE-7940270709 [1,0,0,0,0,0|1,0,2]=4 999 B5R0.5 C[C@@H](N)C(=O)N MCULE-8482332558 [1,0,0,0,0,0|1,0,2]=4 1000 B5R0.5 C[C@@H](N)C(=O)O MCULE-3571488623 [1,0,0,0,0,0|1,0,1]=3 1001 B5R0.5 C[C@@H](N)C(=O)O MCULE-9756365751 [1,0,0,0,0,0|1,0,1]=3 1002 B5R0.5 C[C@@H](N)C(F)F MCULE-3679161461 [1,0,0,0,0,0|2,0,0]=3 1003 B5R0.5 C[C@@H](N)C(F)F MCULE-5068481064 [1,0,0,0,0,0|2,0,0]=3 1004 B5R0.5 C[C@@H](N)[C@@H](C)N MCULE-5194916344 [1,0,0,0,0,0|1,0,0]=2 1005 B5R0.5 C[C@@H](N)[C@@H](C)O MCULE-4537991630 [1,0,0,0,0,0|0,0,0]=1 1006 B5R0.5 C[C@@H](N)[C@@H](C)O MCULE-5710552020 [1,0,0,0,0,0|0,0,0]=1 1007 B5R0.5 C[C@@H](N)[C@@H](C)O MCULE-5951487868 [1,0,0,0,0,0|0,0,0]=1 1008 B5R0.5 C[C@@H](N)[C@@H](C)O MCULE-8093543292 [1,0,0,0,0,0|0,0,0]=1 1009 B5R0.5 C[C@@H](N)[C@@H](C)O MCULE-8196664475 [1,0,0,0,0,0|0,0,0]=1 1010 B5R0.5 C[C@@H](O)C(=N)N MCULE-1498978023 [1,0,0,0,0,0|1,0,1]=3 1011 B5R0.5 C[C@@H](O)C(=N)N MCULE-6124491136 [1,0,0,0,0,0|1,0,1]=3 1012 B5R0.5 C[C@@H](O)C(=N)N MCULE-7410387081 [1,0,0,0,0,0|1,0,1]=3 1013 B5R0.5 C[C@@H](O)C(=N)N MCULE-9566288141 [1,0,0,0,0,0|1,0,1]=3 1014 B5R0.5 C[C@@H](O)C(=O)N MCULE-2026557726 [1,0,0,0,0,0|0,0,2]=3 1015 B5R0.5 C[C@@H](O)C(=O)N MCULE-8056291801 [1,0,0,0,0,0|0,0,2]=3 1016 B5R0.5 C[C@@H](O)C(=O)O MCULE-4625208788 [1,0,0,0,0,0|1,0,1]=3 1017 B5R0.5 C[C@@H](O)C(=O)O MCULE-9141235095 [1,0,0,0,0,0|1,0,1]=3 1018 B5R0.5 C[C@@H](O)C(=O)[O-] MCULE-5673591667 [1,0,0,0,0,0|1,0,2]=4 1019 B5R0.5 C[C@@H](O)C(=O)[O-] MCULE-8146434340 [1,0,0,0,0,0|1,0,2]=4 1020 B5R0.5 C[C@@H](O)C(=O)[O-] MCULE-9026662277 [1,0,0,0,0,0|1,0,2]=4 1021 B5R0.5 C[C@@H](O)[C@@H](C)O MCULE-2843927827 [1,0,0,0,0,0|1,0,0]=2 1022 B5R0.5 C[C@@H](O)[C@@H](C)O MCULE-3739961672 [1,0,0,0,0,0|1,0,0]=2 1023 B5R0.5 C[C@@H](O)[C@@H](C)O MCULE-5488313047 [1,0,0,0,0,0|1,0,0]=2 1024 B5R0.5 C[C@H](Br)C(=O)O MCULE-4788730445 [1,0,0,0,0,0|2,0,1]=4 1025 B5R0.5 C[C@H](Br)C(=O)O MCULE-9354978281 [1,0,0,0,0,0|2,0,1]=4 1026 B5R0.5 C[C@H](Br)[C@@H](C)Br MCULE-7263507123 [1,0,0,0,0,0|2,0,0]=3 1027 B5R0.5 C[C@H](Cl)C(=O)O MCULE-4816831649 [1,0,0,0,0,0|2,0,1]=4 1028 B5R0.5 C[C@H](Cl)C(=O)O MCULE-8389122613 [1,0,0,0,0,0|2,0,1]=4 1029 B5R0.5 C[C@H](F)C(=O)N MCULE-7457242428 [1,0,0,0,0,0|1,0,2]=4 1030 B5R0.5 C[C@H](N)C(=O)N MCULE-4716963408 [1,0,0,0,0,0|1,0,2]=4 1031 B5R0.5 C[C@H](N)C(=O)N MCULE-6879702251 [1,0,0,0,0,0|1,0,2]=4 1032 B5R0.5 C[C@H](N)C(=O)N MCULE-7090555441 [1,0,0,0,0,0|1,0,2]=4 1033 B5R0.5 C[C@H](N)C(=O)N MCULE-7293369315 [1,0,0,0,0,0|1,0,2]=4 1034 B5R0.5 C[C@H](N)C(=O)N MCULE-7341432132 [1,0,0,0,0,0|1,0,2]=4 1035 B5R0.5 C[C@H](N)C(=O)N MCULE-7556063213 [1,0,0,0,0,0|1,0,2]=4 1036 B5R0.5 C[C@H](N)C(=O)N MCULE-8320991932 [1,0,0,0,0,0|1,0,2]=4 1037 B5R0.5 C[C@H](N)C(=O)N MCULE-8491573930 [1,0,0,0,0,0|1,0,2]=4 1038 B5R0.5 C[C@H](N)C(=O)O MCULE-4916719758 [1,0,0,0,0,0|1,0,1]=3 1039 B5R0.5 C[C@H](N)C(=O)O MCULE-5261590548 [1,0,0,0,0,0|1,0,1]=3 1040 B5R0.5 C[C@H](N)C(=O)O MCULE-7791919887 [1,0,0,0,0,0|1,0,1]=3 1041 B5R0.5 C[C@H](N)C(=O)O MCULE-8724854497 [1,0,0,0,0,0|1,0,1]=3 1042 B5R0.5 C[C@H](N)[C@@H](C)O MCULE-6389040758 [1,0,0,0,0,0|0,0,0]=1 1043 B5R0.5 C[C@H](N)[C@@H](C)O MCULE-7956913866 [1,0,0,0,0,0|0,0,0]=1 1044 B5R0.5 C[C@H](N)[C@H](C)N MCULE-1560418234 [1,0,0,0,0,0|1,0,0]=2 1045 B5R0.5 C[C@H](N)[C@H](C)O MCULE-1340338147 [1,0,0,0,0,0|0,0,0]=1 1046 B5R0.5 C[C@H](N)[C@H](C)O MCULE-1738016964 [1,0,0,0,0,0|0,0,0]=1 1047 B5R0.5 C[C@H](N)[C@H](C)O MCULE-2254798251 [1,0,0,0,0,0|0,0,0]=1 1048 B5R0.5 C[C@H](N)[C@H](C)O MCULE-7688101680 [1,0,0,0,0,0|0,0,0]=1 1049 B5R0.5 C[C@H](O)C(=O)N MCULE-8400190365 [1,0,0,0,0,0|0,0,2]=3 1050 B5R0.5 C[C@H](O)C(=O)O MCULE-5695391344 [1,0,0,0,0,0|1,0,1]=3 1051 B5R0.5 C[C@H](O)C(=O)O MCULE-8864689875 [1,0,0,0,0,0|1,0,1]=3 1052 B5R0.5 C[C@H](O)C(=O)[O-] MCULE-1034285072 [1,0,0,0,0,0|1,0,2]=4 1053 B5R0.5 C[C@H](O)C(=O)[O-] MCULE-3598405830 [1,0,0,0,0,0|1,0,2]=4 1054 B5R0.5 C[C@H](O)C(=O)[O-] MCULE-7525689298 [1,0,0,0,0,0|1,0,2]=4 1055 B5R0.5 C[C@H](O)C(=O)[O-] MCULE-8057429776 [1,0,0,0,0,0|1,0,2]=4 1056 B5R0.5 C[C@H](O)C(=O)[O-] MCULE-8729310894 [1,0,0,0,0,0|1,0,2]=4 1057 B5R0.5 C[C@H](O)[C@@H](C)N MCULE-3776841970 [1,0,0,0,0,0|0,0,0]=1 1058 B5R0.5 C[C@H](O)[C@@H](C)N MCULE-4906999918 [1,0,0,0,0,0|0,0,0]=1 1059 B5R0.5 C[C@H](O)[C@@H](C)N MCULE-5860404631 [1,0,0,0,0,0|0,0,0]=1 1060 B5R0.5 C[C@H](O)[C@@H](C)N MCULE-5888789996 [1,0,0,0,0,0|0,0,0]=1 1061 B5R0.5 C[C@H](O)[C@@H](C)O MCULE-8389904530 [1,0,0,0,0,0|1,0,0]=2 1062 B5R0.5 C[C@H](O)[C@H](C)O MCULE-8448870055 [1,0,0,0,0,0|1,0,0]=2 1063 B5R0.5 C[C@H](O)[C@H](C)O MCULE-9615630900 [1,0,0,0,0,0|1,0,0]=2 1064 B5R0.5 C[C@H](S)[C@@H](C)O MCULE-3347141817 [1,0,0,0,0,0|1,0,0]=2 1065 B5R0.5 NC(O)C(=O)O MCULE-6546070388 [1,0,0,0,0,0|1,0,1]=3 1066 B5R0.5 O=C(O)C(O)O MCULE-8045135900 [1,0,0,0,0,0|2,0,1]=4 1067 B5R0.5 OC(O)C(Cl)Cl MCULE-3363992346 [1,0,0,0,0,0|3,0,0]=4 1068 B5R0.5 [C@@H](C)(O)C(=O)N MCULE-6953360641 [1,0,0,0,0,0|0,0,2]=3 1069 B5R0.5 [NH3+]C(C)C(C)[NH3+] MCULE-4215582247 [1,0,0,0,0,0|1,0,1]=3 1070 B7R0.5 C#CCC(N)C(=O)O MCULE-2022398365 [0,1,0,0,0,0|2,0,1]=4 1071 B7R0.5 C#CCC(N)C(=O)O MCULE-2451098139 [0,1,0,0,0,0|2,0,1]=4 1072 B7R0.5 C#CCC(N)C(=O)O MCULE-4330300997 [0,1,0,0,0,0|2,0,1]=4 1073 B7R0.5 C#CCC(N)C(=O)O MCULE-5100293043 [0,1,0,0,0,0|2,0,1]=4 1074 B7R0.5 C#CCC(O)C(C)C MCULE-5540203369 [0,1,0,0,0,0|3,0,0]=4 1075 B7R0.5 C#CC[C@@H](N)C(=O)O MCULE-1266511504 [0,1,0,0,0,0|2,0,1]=4 1076 B7R0.5 C#CC[C@@H](N)C(=O)O MCULE-2589808316 [0,1,0,0,0,0|2,0,1]=4 1077 B7R0.5 C#CC[C@@H](N)C(=O)O MCULE-4703021434 [0,1,0,0,0,0|2,0,1]=4 1078 B7R0.5 C#CC[C@@H](N)C(=O)O MCULE-5616417783 [0,1,0,0,0,0|2,0,1]=4 1079 B7R0.5 C#CC[C@H](N)C(=O)O MCULE-1593368546 [0,1,0,0,0,0|2,0,1]=4 1080 B7R0.5 C#CC[C@H](N)C(=O)O MCULE-5683421535 [0,1,0,0,0,0|2,0,1]=4 1081 B7R0.5 C#CC[C@H](N)C(=O)O MCULE-7302855511 [0,1,0,0,0,0|2,0,1]=4 1082 B7R0.5 C#CC[C@H](N)C(=O)O MCULE-9256626051 [0,1,0,0,0,0|2,0,1]=4 1083 B7R0.5 C=CCC(C)C(C)C MCULE-8461199830 [0,1,0,0,0,0|3,0,0]=4 1084 B7R0.5 C=CCC(N)C(=O)O MCULE-1550468430 [0,1,0,0,0,0|2,0,1]=4 1085 B7R0.5 C=CCC(N)C(=O)O MCULE-1783682768 [0,1,0,0,0,0|2,0,1]=4 1086 B7R0.5 C=CCC(N)C(=O)O MCULE-8721864064 [0,1,0,0,0,0|2,0,1]=4 1087 B7R0.5 C=CCC(N)C(=O)O MCULE-9091562338 [0,1,0,0,0,0|2,0,1]=4 1088 B7R0.5 C=CCC(O)C(C)C MCULE-2334905388 [0,1,0,0,0,0|3,0,0]=4 1089 B7R0.5 C=CC[C@@H](N)C(=O)O MCULE-3817126030 [0,1,0,0,0,0|2,0,1]=4 1090 B7R0.5 C=CC[C@@H](N)C(=O)O MCULE-5479618260 [0,1,0,0,0,0|2,0,1]=4 1091 B7R0.5 C=CC[C@@H](N)C(=O)O MCULE-6719393730 [0,1,0,0,0,0|2,0,1]=4 1092 B7R0.5 C=CC[C@@H](N)C(=O)O MCULE-7577627870 [0,1,0,0,0,0|2,0,1]=4 1093 B7R0.5 C=CC[C@H](N)C(=O)O MCULE-2073484196 [0,1,0,0,0,0|2,0,1]=4 1094 B7R0.5 C=CC[C@H](N)C(=O)O MCULE-3267648941 [0,1,0,0,0,0|2,0,1]=4 1095 B7R0.5 C=CC[C@H](N)C(=O)O MCULE-4183531139 [0,1,0,0,0,0|2,0,1]=4 1096 B7R0.5 C=CC[C@H](N)C(=O)O MCULE-8225762047 [0,1,0,0,0,0|2,0,1]=4 1097 B7R0.5 CC(=O)C(C)CCO MCULE-3907160101 [0,1,0,0,0,0|1,0,2]=4 1098 B7R0.5 CC(=O)C(Cl)CCO MCULE-1606704903 [0,1,0,0,0,0|1,0,2]=4 1099 B7R0.5 CC(C)C(=O)NCO MCULE-4279406951 [0,1,0,0,0,0|2,0,1]=4 1100 B7R0.5 CC(C)C(C)CCO MCULE-9837449555 [0,1,0,0,0,0|2,0,0]=3 1101 B7R0.5 CC(C)C(N)CCO MCULE-4571836019 [0,1,0,0,0,0|1,0,0]=2 1102 B7R0.5 CC(C)C(O)CC#N MCULE-5148911726 [0,1,0,0,0,0|3,0,0]=4 1103 B7R0.5 CC(C)C(O)CCCl MCULE-3510291624 [0,1,0,0,0,0|3,0,0]=4 1104 B7R0.5 CC(C)C(O)CCN MCULE-2039463209 [0,1,0,0,0,0|3,0,0]=4 1105 B7R0.5 CC(C)C(O)CCN MCULE-2941304015 [0,1,0,0,0,0|3,0,0]=4 1106 B7R0.5 CC(C)C(O)CCO MCULE-8819967893 [0,1,0,0,0,0|2,0,0]=3 1107 B7R0.5 CC(C)N(C)CCO MCULE-5948661117 [0,1,0,0,0,0|3,0,0]=4 1108 B7R0.5 CC(C)[C@H](N)CCO MCULE-5628923252 [0,1,0,0,0,0|1,0,0]=2 1109 B7R0.5 CC(C)[C@H](O)CCN MCULE-1853419872 [0,1,0,0,0,0|3,0,0]=4 1110 B7R0.5 CC(C)[C@H](O)CCN MCULE-1886424228 [0,1,0,0,0,0|3,0,0]=4 1111 B7R0.5 CC(C)[C@H](O)CCN MCULE-7762475170 [0,1,0,0,0,0|3,0,0]=4 1112 B7R0.5 CC(C)[C@H](O)CCN MCULE-8675177820 [0,1,0,0,0,0|3,0,0]=4 1113 B7R0.5 CC(CCO)C(=O)O MCULE-9724304469 [0,1,0,0,0,0|2,0,1]=4 1114 B7R0.5 CC(CCO)N(C)C MCULE-4175956173 [0,1,0,0,0,0|3,0,0]=4 1115 B7R0.5 CCCC(Br)C(C)Br MCULE-4740207556 [0,1,0,0,0,0|3,0,0]=4 1116 B7R0.5 CCCC(C)C(C)C MCULE-1008931357 [0,1,0,0,0,0|3,0,0]=4 1117 B7R0.5 CCCC(C)C(C)N MCULE-3555650010 [0,1,0,0,0,0|3,0,0]=4 1118 B7R0.5 CCCC(C)C(C)N MCULE-8637319249 [0,1,0,0,0,0|3,0,0]=4 1119 B7R0.5 CCCC(C)C(C)O MCULE-3222709632 [0,1,0,0,0,0|2,0,0]=3 1120 B7R0.5 CCCC(N)C(=O)O MCULE-1684743992 [0,1,0,0,0,0|2,0,1]=4 1121 B7R0.5 CCCC(N)C(=O)O MCULE-5263067403 [0,1,0,0,0,0|2,0,1]=4 1122 B7R0.5 CCCC(N)C(=O)O MCULE-7151907627 [0,1,0,0,0,0|2,0,1]=4 1123 B7R0.5 CCCC(O)C(C)C MCULE-8942406791 [0,1,0,0,0,0|3,0,0]=4 1124 B7R0.5 CCC[C@@H](N)C(=O)O MCULE-1302378905 [0,1,0,0,0,0|2,0,1]=4 1125 B7R0.5 CCC[C@@H](N)C(=O)O MCULE-5246507817 [0,1,0,0,0,0|2,0,1]=4 1126 B7R0.5 CCC[C@H](N)C(=O)O MCULE-2890516597 [0,1,0,0,0,0|2,0,1]=4 1127 B7R0.5 CCC[C@H](N)C(=O)O MCULE-4690406880 [0,1,0,0,0,0|2,0,1]=4 1128 B7R0.5 CCC[C@H](N)C(=O)O MCULE-9323049450 [0,1,0,0,0,0|2,0,1]=4 1129 B7R0.5 CCNC(=O)[C@H](C)O MCULE-9098995292 [0,1,0,0,0,0|2,0,1]=4 1130 B7R0.5 CCNC(C)C(C)C MCULE-4222747158 [0,1,0,0,0,0|3,0,0]=4 1131 B7R0.5 CCNC(C)C(C)C MCULE-4653009965 [0,1,0,0,0,0|3,0,0]=4 1132 B7R0.5 CCOC(=N)C(C)O MCULE-4906645723 [0,1,0,0,0,0|1,0,2]=4 1133 B7R0.5 CCOC(=N)C(C)O MCULE-6342692176 [0,1,0,0,0,0|1,0,2]=4 1134 B7R0.5 CCOC(=O)C(C)O MCULE-8057202883 [0,1,0,0,0,0|2,0,1]=4 1135 B7R0.5 CCOC(=O)C(C)O MCULE-9679398205 [0,1,0,0,0,0|2,0,1]=4 1136 B7R0.5 CCOC(=O)[C@@H](C)O MCULE-3372948910 [0,1,0,0,0,0|2,0,1]=4 1137 B7R0.5 CCOC(=O)[C@@H](C)O MCULE-5795033916 [0,1,0,0,0,0|2,0,1]=4 1138 B7R0.5 CCOC(=O)[C@H](C)O MCULE-4333545760 [0,1,0,0,0,0|2,0,1]=4 1139 B7R0.5 CCOC(=O)[C@H](C)O MCULE-8787861948 [0,1,0,0,0,0|2,0,1]=4 1140 B7R0.5 CCOC(Cl)C(C)Cl MCULE-8602425289 [0,1,0,0,0,0|3,0,0]=4 1141 B7R0.5 CNCC(N)C(=O)O MCULE-4360775406 [0,1,0,0,0,0|2,0,1]=4 1142 B7R0.5 CNCC(N)C(=O)O MCULE-4913403405 [0,1,0,0,0,0|2,0,1]=4 1143 B7R0.5 CNCC(N)C(C)C MCULE-6535124409 [0,1,0,0,0,0|2,0,0]=3 1144 B7R0.5 CNC[C@H](N)C(=O)O MCULE-3465445123 [0,1,0,0,0,0|2,0,1]=4 1145 B7R0.5 CNC[C@H](N)C(=O)O MCULE-7309489523 [0,1,0,0,0,0|2,0,1]=4 1146 B7R0.5 CNC[C@H](N)C(=O)O MCULE-8418254346 [0,1,0,0,0,0|2,0,1]=4 1147 B7R0.5 CNC[C@H](N)C(=O)O MCULE-8752314299 [0,1,0,0,0,0|2,0,1]=4 1148 B7R0.5 COCC(=O)C(C)C MCULE-8251961368 [0,1,0,0,0,0|2,0,1]=4 1149 B7R0.5 COCC(Br)C(=O)O MCULE-2977381282 [0,1,0,0,0,0|2,0,1]=4 1150 B7R0.5 COCC(C)C(=O)C MCULE-5328927786 [0,1,0,0,0,0|1,0,2]=4 1151 B7R0.5 COCC(C)C(=O)O MCULE-9776415948 [0,1,0,0,0,0|2,0,1]=4 1152 B7R0.5 COCC(C)C(C)N MCULE-6465669754 [0,1,0,0,0,0|2,0,0]=3 1153 B7R0.5 COCC(Cl)C(=O)O MCULE-1439107016 [0,1,0,0,0,0|2,0,1]=4 1154 B7R0.5 COCC(N)C(=O)N MCULE-2465830538 [0,1,0,0,0,0|1,0,2]=4 1155 B7R0.5 COCC(N)C(=O)N MCULE-6194410780 [0,1,0,0,0,0|1,0,2]=4 1156 B7R0.5 COCC(N)C(=O)O MCULE-4336440568 [0,1,0,0,0,0|1,0,1]=3 1157 B7R0.5 COCC(N)C(=O)O MCULE-4899043582 [0,1,0,0,0,0|1,0,1]=3 1158 B7R0.5 COCC(N)C(=O)O MCULE-6964823693 [0,1,0,0,0,0|1,0,1]=3 1159 B7R0.5 COCC(N)C(=O)O MCULE-7037870255 [0,1,0,0,0,0|1,0,1]=3 1160 B7R0.5 COCC(N)C(C)C MCULE-4185259512 [0,1,0,0,0,0|1,0,0]=2 1161 B7R0.5 COCC(N)C(C)C MCULE-6424539237 [0,1,0,0,0,0|1,0,0]=2 1162 B7R0.5 COCC(O)C(=O)O MCULE-3185498869 [0,1,0,0,0,0|2,0,1]=4 1163 B7R0.5 COCC(O)C(C)C MCULE-3818851772 [0,1,0,0,0,0|2,0,0]=3 1164 B7R0.5 COC[C@@H](N)C(=O)O MCULE-1827086666 [0,1,0,0,0,0|1,0,1]=3 1165 B7R0.5 COC[C@@H](N)C(=O)O MCULE-4868456769 [0,1,0,0,0,0|1,0,1]=3 1166 B7R0.5 COC[C@@H](N)C(=O)O MCULE-5275247485 [0,1,0,0,0,0|1,0,1]=3 1167 B7R0.5 COC[C@@H](N)C(=O)O MCULE-7339751251 [0,1,0,0,0,0|1,0,1]=3 1168 B7R0.5 COC[C@@H](N)C(C)C MCULE-2081062888 [0,1,0,0,0,0|1,0,0]=2 1169 B7R0.5 COC[C@@H](N)C(C)C MCULE-3286077946 [0,1,0,0,0,0|1,0,0]=2 1170 B7R0.5 COC[C@@H](N)C(C)C MCULE-3882144478 [0,1,0,0,0,0|1,0,0]=2 1171 B7R0.5 COC[C@H](N)C(=O)O MCULE-3719679803 [0,1,0,0,0,0|1,0,1]=3 1172 B7R0.5 COC[C@H](N)C(=O)O MCULE-4874807874 [0,1,0,0,0,0|1,0,1]=3 1173 B7R0.5 COC[C@H](N)C(=O)O MCULE-5303156917 [0,1,0,0,0,0|1,0,1]=3 1174 B7R0.5 COC[C@H](N)C(=O)O MCULE-8138564560 [0,1,0,0,0,0|1,0,1]=3 1175 B7R0.5 COC[C@H](N)C(C)C MCULE-3191900867 [0,1,0,0,0,0|1,0,0]=2 1176 B7R0.5 COC[C@H](N)C(C)C MCULE-3410691563 [0,1,0,0,0,0|1,0,0]=2 1177 B7R0.5 CSCC(N)C(=O)O MCULE-7668628251 [0,1,0,0,0,0|1,1,1]=4 1178 B7R0.5 CSC[C@H](N)C(=O)O MCULE-1178337776 [0,1,0,0,0,0|1,1,1]=4 1179 B7R0.5 CSC[C@H](N)C(=O)O MCULE-2769761337 [0,1,0,0,0,0|1,1,1]=4 1180 B7R0.5 C[Se]CC(N)C(=O)O MCULE-3357465269 [0,1,0,0,0,0|1,1,1]=4 1181 B7R0.5 C[Se]CC(N)C(=O)O MCULE-7671606756 [0,1,0,0,0,0|1,1,1]=4 1182 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-5208306365 [0,1,0,0,0,0|1,1,1]=4 1183 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-6734478742 [0,1,0,0,0,0|1,1,1]=4 1184 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-6760615750 [0,1,0,0,0,0|1,1,1]=4 1185 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-7512025617 [0,1,0,0,0,0|1,1,1]=4 1186 B7R0.5 N#CCC(N)C(=O)O MCULE-4929926467 [0,1,0,0,0,0|2,0,1]=4 1187 B7R0.5 N#CC[C@H](N)C(=O)O MCULE-6294926701 [0,1,0,0,0,0|2,0,1]=4 1188 B7R0.5 N#CC[C@H](N)C(=O)O MCULE-6432920316 [0,1,0,0,0,0|2,0,1]=4 1189 B7R0.5 NC(CCBr)C(=O)O MCULE-1900559475 [0,1,0,0,0,0|2,0,1]=4 1190 B7R0.5 NC(CCBr)C(=O)O MCULE-7293320576 [0,1,0,0,0,0|2,0,1]=4 1191 B7R0.5 NC(CCF)C(=O)O MCULE-5519595590 [0,1,0,0,0,0|2,0,1]=4 1192 B7R0.5 NC(CCF)C(=O)O MCULE-7293194855 [0,1,0,0,0,0|2,0,1]=4 1193 B7R0.5 NC(CCO)C(=O)O MCULE-1744838687 [0,1,0,0,0,0|1,0,1]=3 1194 B7R0.5 NC(CCO)C(=O)O MCULE-9642233758 [0,1,0,0,0,0|1,0,1]=3 1195 B7R0.5 NC(CCO)C(F)F MCULE-1854847569 [0,1,0,0,0,0|2,0,0]=3 1196 B7R0.5 NC(CCS)C(=O)O MCULE-8057550187 [0,1,0,0,0,0|1,1,1]=4 1197 B7R0.5 NC(CCS)C(=O)O MCULE-8117596001 [0,1,0,0,0,0|1,1,1]=4 1198 B7R0.5 NC(CNO)C(=O)O MCULE-2332662988 [0,1,0,0,0,0|1,0,1]=3 1199 B7R0.5 NCCC(N)C(=O)O MCULE-1239764966 [0,1,0,0,0,0|2,0,1]=4 1200 B7R0.5 NCCC(N)C(=O)O MCULE-2441123923 [0,1,0,0,0,0|2,0,1]=4 1201 B7R0.5 NCCC(N)C(=O)O MCULE-3966593369 [0,1,0,0,0,0|2,0,1]=4 1202 B7R0.5 NCCC(N)C(=O)O MCULE-4212078130 [0,1,0,0,0,0|2,0,1]=4 1203 B7R0.5 NCCC(N)C(=O)O MCULE-7713366571 [0,1,0,0,0,0|2,0,1]=4 1204 B7R0.5 NCCC(N)C(=O)O MCULE-8402131049 [0,1,0,0,0,0|2,0,1]=4 1205 B7R0.5 NCCC(N)C(=O)O MCULE-9198187552 [0,1,0,0,0,0|2,0,1]=4 1206 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-4000770618 [0,1,0,0,0,0|2,0,1]=4 1207 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-5775312784 [0,1,0,0,0,0|2,0,1]=4 1208 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-6259961704 [0,1,0,0,0,0|2,0,1]=4 1209 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-9871958374 [0,1,0,0,0,0|2,0,1]=4 1210 B7R0.5 NCC[C@H](N)C(=O)O MCULE-1745978456 [0,1,0,0,0,0|2,0,1]=4 1211 B7R0.5 NCC[C@H](N)C(=O)O MCULE-3856066353 [0,1,0,0,0,0|2,0,1]=4 1212 B7R0.5 NCC[C@H](N)C(=O)O MCULE-3919721317 [0,1,0,0,0,0|2,0,1]=4 1213 B7R0.5 NCC[C@H](N)C(=O)O MCULE-5434373726 [0,1,0,0,0,0|2,0,1]=4 1214 B7R0.5 NCC[C@H](N)C(=O)O MCULE-5992578597 [0,1,0,0,0,0|2,0,1]=4 1215 B7R0.5 NCC[C@H](N)C(=O)O MCULE-6536533546 [0,1,0,0,0,0|2,0,1]=4 1216 B7R0.5 NCC[C@H](N)C(=O)O MCULE-6978035806 [0,1,0,0,0,0|2,0,1]=4 1217 B7R0.5 NCC[C@H](N)C(=O)O MCULE-8762011291 [0,1,0,0,0,0|2,0,1]=4 1218 B7R0.5 NCC[C@H](N)C(=O)O MCULE-9645608127 [0,1,0,0,0,0|2,0,1]=4 1219 B7R0.5 NOC[C@H](N)C(=O)O MCULE-1050292176 [0,1,0,0,0,0|1,0,1]=3 1220 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-2388269464 [0,1,0,0,0,0|2,0,1]=4 1221 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-2456796412 [0,1,0,0,0,0|2,0,1]=4 1222 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-6229782603 [0,1,0,0,0,0|2,0,1]=4 1223 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-8123446168 [0,1,0,0,0,0|2,0,1]=4 1224 B7R0.5 N[C@@H](CCO)C(=O)O MCULE-2370353784 [0,1,0,0,0,0|1,0,1]=3 1225 B7R0.5 N[C@@H](CCO)C(=O)O MCULE-4861747928 [0,1,0,0,0,0|1,0,1]=3 1226 B7R0.5 N[C@@H](CCS)C(=O)O MCULE-4021115723 [0,1,0,0,0,0|1,1,1]=4 1227 B7R0.5 N[C@@H](CCS)C(=O)O MCULE-7661321953 [0,1,0,0,0,0|1,1,1]=4 1228 B7R0.5 N[C@@H](CSS)C(=O)O MCULE-3029500977 [0,1,0,0,0,0|1,1,1]=4 1229 B7R0.5 N[C@H](CCBr)C(=O)O MCULE-1975650690 [0,1,0,0,0,0|2,0,1]=4 1230 B7R0.5 N[C@H](CCBr)C(=O)O MCULE-7245104465 [0,1,0,0,0,0|2,0,1]=4 1231 B7R0.5 N[C@H](CCO)C(=O)O MCULE-8005652100 [0,1,0,0,0,0|1,0,1]=3 1232 B7R0.5 N[C@H](CCO)C(=O)O MCULE-8613625039 [0,1,0,0,0,0|1,0,1]=3 1233 B7R0.5 N[C@H](CCS)C(=O)O MCULE-1110046008 [0,1,0,0,0,0|1,1,1]=4 1234 B7R0.5 N[C@H](CCS)C(=O)O MCULE-7556963357 [0,1,0,0,0,0|1,1,1]=4 1235 B7R0.5 O=C(O)C(O)CCO MCULE-9096271794 [0,1,0,0,0,0|2,0,1]=4 1236 B7R0.5 [C@H](N)(CC#C)C(=O)O MCULE-7308061694 [0,1,0,0,0,0|2,0,1]=4 1237 B7R0.10 BrCC(Br)C(Br)CBr MCULE-4342639702 [0,1,0,0,0,0|3,0,0]=4 1238 B7R0.10 BrC[C@H](Br)[C@H](Br)CBr MCULE-9743935577 [0,1,0,0,0,0|3,0,0]=4 1239 B7R0.10 C#CC(N)C(C)CC MCULE-4599913336 [0,1,0,0,0,0|2,0,1]=4 1240 B7R0.10 C#CC(N)C(C)CC MCULE-6841022785 [0,1,0,0,0,0|2,0,1]=4 1241 B7R0.10 C/C(=N\O)/C(=N/O)/N MCULE-8105401552 [0,1,0,0,0,0|1,0,2]=4 1242 B7R0.10 C=CC(C)C(C)CC MCULE-2366850706 [0,1,0,0,0,0|3,0,0]=4 1243 B7R0.10 CC(=NO)/C(=N/O)/N MCULE-5306915355 [0,1,0,0,0,0|1,0,2]=4 1244 B7R0.10 CC(CCl)C(C)CCl MCULE-1834137730 [0,1,0,0,0,0|3,0,0]=4 1245 B7R0.10 CC(CN)C(N)CO MCULE-1520376315 [0,1,0,0,0,0|1,0,0]=2 1246 B7R0.10 CC(CN)[C@H](N)CO MCULE-9250442888 [0,1,0,0,0,0|1,0,0]=2 1247 B7R0.10 CCC(=O)C(O)CC MCULE-7549931190 [0,1,0,0,0,0|2,0,1]=4 1248 B7R0.10 CCC(C)/C(=N/O)/N MCULE-3220820796 [0,1,0,0,0,0|2,0,1]=4 1249 B7R0.10 CCC(C)/C(=N/O)/N MCULE-6860766298 [0,1,0,0,0,0|2,0,1]=4 1250 B7R0.10 CCC(C)C(C)CC MCULE-8164178184 [0,1,0,0,0,0|3,0,0]=4 1251 B7R0.10 CCC(C)C(N)C#N MCULE-4516295423 [0,1,0,0,0,0|2,0,1]=4 1252 B7R0.10 CCC(C)C(N)C#N MCULE-9668149479 [0,1,0,0,0,0|2,0,1]=4 1253 B7R0.10 CCC(C)C(N)CO MCULE-3990781918 [0,1,0,0,0,0|1,0,0]=2 1254 B7R0.10 CCC(C)C(N)CO MCULE-9261445768 [0,1,0,0,0,0|1,0,0]=2 1255 B7R0.10 CCC(C)C(O)CC MCULE-3936368693 [0,1,0,0,0,0|2,0,0]=3 1256 B7R0.10 CCC(C)C(O)CN MCULE-1941564207 [0,1,0,0,0,0|2,0,0]=3 1257 B7R0.10 CCC(C)C(O)CO MCULE-9999862073 [0,1,0,0,0,0|2,0,0]=3 1258 B7R0.10 CCC(C)[C@H](N)C#N MCULE-7403677699 [0,1,0,0,0,0|2,0,1]=4 1259 B7R0.10 CCC(C)[C@H](N)C#N MCULE-7724941860 [0,1,0,0,0,0|2,0,1]=4 1260 B7R0.10 CCC(C)[C@H](N)C#N MCULE-8975526389 [0,1,0,0,0,0|2,0,1]=4 1261 B7R0.10 CCC(C)[C@H](N)C#N MCULE-9352431409 [0,1,0,0,0,0|2,0,1]=4 1262 B7R0.10 CCC(N)C(=O)NC MCULE-7274856339 [0,1,0,0,0,0|1,0,2]=4 1263 B7R0.10 CCC(N)C(=O)NC MCULE-9912780545 [0,1,0,0,0,0|1,0,2]=4 1264 B7R0.10 CCC(N)C(=O)NO MCULE-9162328479 [0,1,0,0,0,0|2,0,1]=4 1265 B7R0.10 CCC(N)C(=O)OC MCULE-1569242271 [0,1,0,0,0,0|1,0,2]=4 1266 B7R0.10 CCC(N)C(=O)OC MCULE-3183954116 [0,1,0,0,0,0|1,0,2]=4 1267 B7R0.10 CCC(N)C(=O)OC MCULE-4045754117 [0,1,0,0,0,0|1,0,2]=4 1268 B7R0.10 CCC(N)C(=O)OC MCULE-5328984047 [0,1,0,0,0,0|1,0,2]=4 1269 B7R0.10 CCC(N)C(O)CC MCULE-3578258801 [0,1,0,0,0,0|1,0,0]=2 1270 B7R0.10 CCC(O)C(C)CO MCULE-3930931405 [0,1,0,0,0,0|1,0,0]=2 1271 B7R0.10 CCC(O)C(C)CO MCULE-4472852672 [0,1,0,0,0,0|1,0,0]=2 1272 B7R0.10 CCC(S)C(C)CO MCULE-1500370684 [0,1,0,0,0,0|1,1,0]=3 1273 B7R0.10 CCN(C)C(C)CO MCULE-3647031998 [0,1,0,0,0,0|3,0,0]=4 1274 B7R0.10 CC[C@@H](C)[C@@H](N)CO MCULE-2122638055 [0,1,0,0,0,0|1,0,0]=2 1275 B7R0.10 CC[C@@H](C)[C@@H](N)CO MCULE-7964651759 [0,1,0,0,0,0|1,0,0]=2 1276 B7R0.10 CC[C@@H](C)[C@@H](N)CO MCULE-8482653298 [0,1,0,0,0,0|1,0,0]=2 1277 B7R0.10 CC[C@@H](N)C(=O)OC MCULE-6794991435 [0,1,0,0,0,0|1,0,2]=4 1278 B7R0.10 CC[C@@H](N)C(=O)OC MCULE-6825672331 [0,1,0,0,0,0|1,0,2]=4 1279 B7R0.10 CC[C@@H](N)C(=O)OC MCULE-7307663817 [0,1,0,0,0,0|1,0,2]=4 1280 B7R0.10 CC[C@@H](N)C(=O)OC MCULE-8717527808 [0,1,0,0,0,0|1,0,2]=4 1281 B7R0.10 CC[C@H](C)[C@H](N)CF MCULE-3409941550 [0,1,0,0,0,0|2,0,0]=3 1282 B7R0.10 CC[C@H](C)[C@H](N)CF MCULE-9750756690 [0,1,0,0,0,0|2,0,0]=3 1283 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-3647332227 [0,1,0,0,0,0|1,0,0]=2 1284 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-5774547825 [0,1,0,0,0,0|1,0,0]=2 1285 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-8401203397 [0,1,0,0,0,0|1,0,0]=2 1286 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-8452836661 [0,1,0,0,0,0|1,0,0]=2 1287 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-9307589673 [0,1,0,0,0,0|1,0,0]=2 1288 B7R0.10 CC[C@H](N)C(=O)OC MCULE-2336816190 [0,1,0,0,0,0|1,0,2]=4 1289 B7R0.10 CC[C@H](N)C(=O)OC MCULE-3480066740 [0,1,0,0,0,0|1,0,2]=4 1290 B7R0.10 CC[C@H](N)C(=O)OC MCULE-4883083558 [0,1,0,0,0,0|1,0,2]=4 1291 B7R0.10 CC[C@H](N)C(=O)OC MCULE-6241184216 [0,1,0,0,0,0|1,0,2]=4 1292 B7R0.10 CNC(=O)C(N)CO MCULE-1507161216 [0,1,0,0,0,0|0,0,2]=3 1293 B7R0.10 COC(=O)C(Br)CO MCULE-1678765423 [0,1,0,0,0,0|1,0,2]=4 1294 B7R0.10 COC(=O)C(Br)CO MCULE-8437488397 [0,1,0,0,0,0|1,0,2]=4 1295 B7R0.10 COC(=O)C(C)CO MCULE-1168600238 [0,1,0,0,0,0|1,0,2]=4 1296 B7R0.10 COC(=O)C(C)CO MCULE-9207150786 [0,1,0,0,0,0|1,0,2]=4 1297 B7R0.10 COC(=O)C(Cl)CO MCULE-9496750776 [0,1,0,0,0,0|1,0,2]=4 1298 B7R0.10 COC(=O)C(F)CO MCULE-2188518229 [0,1,0,0,0,0|1,0,2]=4 1299 B7R0.10 COC(=O)C(N)CCl MCULE-2253564316 [0,1,0,0,0,0|1,0,2]=4 1300 B7R0.10 COC(=O)C(N)CCl MCULE-3851909822 [0,1,0,0,0,0|1,0,2]=4 1301 B7R0.10 COC(=O)C(N)CCl MCULE-4649966066 [0,1,0,0,0,0|1,0,2]=4 1302 B7R0.10 COC(=O)C(N)CCl MCULE-9193407415 [0,1,0,0,0,0|1,0,2]=4 1303 B7R0.10 COC(=O)C(N)CF MCULE-2617218019 [0,1,0,0,0,0|1,0,2]=4 1304 B7R0.10 COC(=O)C(N)CF MCULE-3926207531 [0,1,0,0,0,0|1,0,2]=4 1305 B7R0.10 COC(=O)C(N)CN MCULE-7949926265 [0,1,0,0,0,0|1,0,2]=4 1306 B7R0.10 COC(=O)C(N)CN MCULE-9215212479 [0,1,0,0,0,0|1,0,2]=4 1307 B7R0.10 COC(=O)C(N)CO MCULE-1874204534 [0,1,0,0,0,0|0,0,2]=3 1308 B7R0.10 COC(=O)C(N)CO MCULE-1907797317 [0,1,0,0,0,0|0,0,2]=3 1309 B7R0.10 COC(=O)C(N)CO MCULE-3851022091 [0,1,0,0,0,0|0,0,2]=3 1310 B7R0.10 COC(=O)C(N)CO MCULE-9875856930 [0,1,0,0,0,0|0,0,2]=3 1311 B7R0.10 COC(=O)C(N)CS MCULE-5131519605 [0,1,0,0,0,0|0,1,2]=4 1312 B7R0.10 COC(=O)C(N)CS MCULE-5561205392 [0,1,0,0,0,0|0,1,2]=4 1313 B7R0.10 COC(=O)C(N)CS MCULE-9291008448 [0,1,0,0,0,0|0,1,2]=4 1314 B7R0.10 COC(=O)C(N)CS MCULE-9963292576 [0,1,0,0,0,0|0,1,2]=4 1315 B7R0.10 COC(=O)C(O)CO MCULE-1234820163 [0,1,0,0,0,0|1,0,2]=4 1316 B7R0.10 COC(=O)C(O)CO MCULE-2142801284 [0,1,0,0,0,0|1,0,2]=4 1317 B7R0.10 COC(=O)[C@@H](Br)CO MCULE-8075978888 [0,1,0,0,0,0|1,0,2]=4 1318 B7R0.10 COC(=O)[C@@H](Br)CO MCULE-8903256620 [0,1,0,0,0,0|1,0,2]=4 1319 B7R0.10 COC(=O)[C@@H](C)CO MCULE-6738074317 [0,1,0,0,0,0|1,0,2]=4 1320 B7R0.10 COC(=O)[C@@H](C)CO MCULE-9697255968 [0,1,0,0,0,0|1,0,2]=4 1321 B7R0.10 COC(=O)[C@@H](N)CCl MCULE-1649684135 [0,1,0,0,0,0|1,0,2]=4 1322 B7R0.10 COC(=O)[C@@H](N)CCl MCULE-4803192908 [0,1,0,0,0,0|1,0,2]=4 1323 B7R0.10 COC(=O)[C@@H](N)CCl MCULE-6514033613 [0,1,0,0,0,0|1,0,2]=4 1324 B7R0.10 COC(=O)[C@@H](N)CCl MCULE-7997387565 [0,1,0,0,0,0|1,0,2]=4 1325 B7R0.10 COC(=O)[C@@H](N)CN MCULE-4407014418 [0,1,0,0,0,0|1,0,2]=4 1326 B7R0.10 COC(=O)[C@@H](N)CN MCULE-4854066134 [0,1,0,0,0,0|1,0,2]=4 1327 B7R0.10 COC(=O)[C@@H](N)CN MCULE-5060962890 [0,1,0,0,0,0|1,0,2]=4 1328 B7R0.10 COC(=O)[C@@H](N)CN MCULE-8572432694 [0,1,0,0,0,0|1,0,2]=4 1329 B7R0.10 COC(=O)[C@@H](N)CO MCULE-2171593224 [0,1,0,0,0,0|0,0,2]=3 1330 B7R0.10 COC(=O)[C@@H](N)CO MCULE-3393088985 [0,1,0,0,0,0|0,0,2]=3 1331 B7R0.10 COC(=O)[C@@H](N)CO MCULE-5476910845 [0,1,0,0,0,0|0,0,2]=3 1332 B7R0.10 COC(=O)[C@@H](N)CO MCULE-9984439264 [0,1,0,0,0,0|0,0,2]=3 1333 B7R0.10 COC(=O)[C@@H](N)CS MCULE-2560943261 [0,1,0,0,0,0|0,1,2]=4 1334 B7R0.10 COC(=O)[C@@H](N)CS MCULE-3682774490 [0,1,0,0,0,0|0,1,2]=4 1335 B7R0.10 COC(=O)[C@@H](N)CS MCULE-6613123984 [0,1,0,0,0,0|0,1,2]=4 1336 B7R0.10 COC(=O)[C@@H](N)CS MCULE-7354291938 [0,1,0,0,0,0|0,1,2]=4 1337 B7R0.10 COC(=O)[C@@H](O)CO MCULE-3655137528 [0,1,0,0,0,0|1,0,2]=4 1338 B7R0.10 COC(=O)[C@@H](O)CO MCULE-5801355812 [0,1,0,0,0,0|1,0,2]=4 1339 B7R0.10 COC(=O)[C@H](Br)CO MCULE-8230787734 [0,1,0,0,0,0|1,0,2]=4 1340 B7R0.10 COC(=O)[C@H](C)CO MCULE-5719676432 [0,1,0,0,0,0|1,0,2]=4 1341 B7R0.10 COC(=O)[C@H](C)CO MCULE-8479546806 [0,1,0,0,0,0|1,0,2]=4 1342 B7R0.10 COC(=O)[C@H](N)CCl MCULE-1199425954 [0,1,0,0,0,0|1,0,2]=4 1343 B7R0.10 COC(=O)[C@H](N)CCl MCULE-2611523756 [0,1,0,0,0,0|1,0,2]=4 1344 B7R0.10 COC(=O)[C@H](N)CCl MCULE-6503487325 [0,1,0,0,0,0|1,0,2]=4 1345 B7R0.10 COC(=O)[C@H](N)CCl MCULE-8714444412 [0,1,0,0,0,0|1,0,2]=4 1346 B7R0.10 COC(=O)[C@H](N)CO MCULE-4463451892 [0,1,0,0,0,0|0,0,2]=3 1347 B7R0.10 COC(=O)[C@H](N)CO MCULE-5622938569 [0,1,0,0,0,0|0,0,2]=3 1348 B7R0.10 COC(=O)[C@H](N)CO MCULE-6021580541 [0,1,0,0,0,0|0,0,2]=3 1349 B7R0.10 COC(=O)[C@H](N)CO MCULE-8237708167 [0,1,0,0,0,0|0,0,2]=3 1350 B7R0.10 COC(=O)[C@H](N)CS MCULE-1845308816 [0,1,0,0,0,0|0,1,2]=4 1351 B7R0.10 COC(=O)[C@H](N)CS MCULE-3480554390 [0,1,0,0,0,0|0,1,2]=4 1352 B7R0.10 COC(=O)[C@H](N)CS MCULE-4432617084 [0,1,0,0,0,0|0,1,2]=4 1353 B7R0.10 COC(=O)[C@H](N)CS MCULE-5747217193 [0,1,0,0,0,0|0,1,2]=4 1354 B7R0.10 COC(=O)[C@H](O)CO MCULE-4219956218 [0,1,0,0,0,0|1,0,2]=4 1355 B7R0.10 COC(=O)[C@H](O)CO MCULE-8891571940 [0,1,0,0,0,0|1,0,2]=4 1356 B7R0.10 COC(C)/C(=N/O)/N MCULE-3009628521 [0,1,0,0,0,0|1,0,1]=3 1357 B7R0.10 COC(C)C(O)C#N MCULE-7134393596 [0,1,0,0,0,0|2,0,1]=4 1358 B7R0.10 ClCC(Cl)C(Cl)CCl MCULE-9682638312 [0,1,0,0,0,0|3,0,0]=4 1359 B7R0.10 ClC[C@H](Cl)[C@H](Cl)CCl MCULE-1943421741 [0,1,0,0,0,0|3,0,0]=4 1360 B7R0.10 NC(CCl)C(=O)NO MCULE-8256545065 [0,1,0,0,0,0|2,0,1]=4 1361 B7R0.10 NC[C@@H](F)[C@H](F)CF MCULE-8718491620 [0,1,0,0,0,0|3,0,0]=4 1362 B7R0.10 NC[C@H](F)[C@H](F)CF MCULE-9246801464 [0,1,0,0,0,0|3,0,0]=4 1363 B7R0.10 NC[C@H](O)[C@H](O)CN MCULE-1073397630 [0,1,0,0,0,0|2,0,0]=3 1364 B7R0.10 NC[C@H](O)[C@H](O)CN MCULE-8068595970 [0,1,0,0,0,0|2,0,0]=3 1365 B7R0.10 NNC(=O)C(N)CO MCULE-3324075598 [0,1,0,0,0,0|1,0,2]=4 1366 B7R0.10 NNC(=O)C(N)CO MCULE-6651241883 [0,1,0,0,0,0|1,0,2]=4 1367 B7R0.10 N[C@@H](CO)[C@@H](N)CO MCULE-2394488011 [0,1,0,0,0,0|1,0,0]=2 1368 B7R0.10 O=C(CO)C(O)CO MCULE-9818197491 [0,1,0,0,0,0|1,0,1]=3 1369 B7R0.10 O=C(CO)[C@@H](O)CO MCULE-8306776225 [0,1,0,0,0,0|1,0,1]=3 1370 B7R0.10 O=C(CO)[C@@H](O)CO MCULE-8666498937 [0,1,0,0,0,0|1,0,1]=3 1371 B7R0.10 O=C(CO)[C@H](O)CO MCULE-7828531161 [0,1,0,0,0,0|1,0,1]=3 1372 B7R0.10 O=CC(O)C(O)CO MCULE-9564469242 [0,1,0,0,0,0|1,0,1]=3 1373 B7R0.10 O=C[C@@H](O)[C@@H](O)CO MCULE-3532911413 [0,1,0,0,0,0|1,0,1]=3 1374 B7R0.10 O=C[C@@H](O)[C@@H](O)CO MCULE-5707669784 [0,1,0,0,0,0|1,0,1]=3 1375 B7R0.10 O=C[C@@H](O)[C@H](O)CO MCULE-4902023669 [0,1,0,0,0,0|1,0,1]=3 1376 B7R0.10 O=C[C@H](O)[C@@H](O)CO MCULE-5975565699 [0,1,0,0,0,0|1,0,1]=3 1377 B7R0.10 O=C[C@H](O)[C@H](O)CO MCULE-3036594515 [0,1,0,0,0,0|1,0,1]=3 1378 B7R0.10 O=C[C@H](O)[C@H](O)CO MCULE-5412566780 [0,1,0,0,0,0|1,0,1]=3 1379 B7R0.10 OC(CBr)C(O)CBr MCULE-4608370293 [0,1,0,0,0,0|2,0,0]=3 1380 B7R0.10 OC(CCl)C(O)CCl MCULE-9282587936 [0,1,0,0,0,0|2,0,0]=3 1381 B7R0.10 OC(CS)C(O)CS MCULE-7432075835 [0,1,0,0,0,0|1,1,0]=3 1382 B7R0.10 OCC(Br)C(Br)CO MCULE-4593943249 [0,1,0,0,0,0|2,0,0]=3 1383 B7R0.10 OCC(O)C(O)CO MCULE-9009953851 [0,1,0,0,0,0|1,0,0]=2 1384 B7R0.10 OC[C@@H](Br)[C@H](Br)CO MCULE-7293448690 [0,1,0,0,0,0|2,0,0]=3 1385 B7R0.10 OC[C@@H](O)[C@H](O)CO MCULE-1593828237 [0,1,0,0,0,0|1,0,0]=2 1386 B7R0.10 OC[C@@H](O)[C@H](O)CO MCULE-7577661973 [0,1,0,0,0,0|1,0,0]=2 1387 B7R0.10 OC[C@@H](O)[C@H](S)CS MCULE-1423721945 [0,1,0,0,0,0|1,1,0]=3 1388 B7R0.10 OC[C@H](O)[C@@H](O)CO MCULE-7306394407 [0,1,0,0,0,0|1,0,0]=2 1389 B7R0.10 OC[C@H](O)[C@@H](O)CO MCULE-8013265935 [0,1,0,0,0,0|1,0,0]=2 1390 B7R0.10 OC[C@H](O)[C@H](O)CO MCULE-6886999157 [0,1,0,0,0,0|1,0,0]=2 1391 B7R0.10 O[C@@H](CS)[C@@H](O)CS MCULE-6947486648 [0,1,0,0,0,0|1,1,0]=3 1392 B7R0.10 O[C@@H](CS)[C@@H](O)CS MCULE-8883019394 [0,1,0,0,0,0|1,1,0]=3 1393 B7R0.10 O[C@H](CBr)[C@H](O)CBr MCULE-5914686116 [0,1,0,0,0,0|2,0,0]=3 1394 B7R0.10 O[C@H](CCl)[C@@H](O)CCl MCULE-8266433235 [0,1,0,0,0,0|2,0,0]=3 1395 B7R0.10 O[C@H](CS)[C@@H](O)CS MCULE-3618084743 [0,1,0,0,0,0|1,1,0]=3 1396 B7R0.10 O[C@H](CS)[C@H](O)CS MCULE-3329450277 [0,1,0,0,0,0|1,1,0]=3 1397 B7R0.10 O[C@H](CS)[C@H](O)CS MCULE-9065556670 [0,1,0,0,0,0|1,1,0]=3 1398 B7R0.10 O[C@H](CS)[C@H](O)CS MCULE-9666091728 [0,1,0,0,0,0|1,1,0]=3 1399 B7R0.10 [C@@H](C)(CC)[C@@H](N)CO MCULE-4423825378 [0,1,0,0,0,0|1,0,0]=2 1400 B7R0.13 CC(=O)C(C)(C)CO MCULE-7885820738 [0,1,0,0,0,0|1,0,2]=4 1401 B7R0.13 CC(C)(CO)C(=O)O MCULE-8700273400 [0,1,0,0,0,0|2,0,1]=4 1402 B7R0.13 CC(C)(CO)C(F)F MCULE-5444524351 [0,1,0,0,0,0|3,0,0]=4 1403 B7R0.13 CC(C)C(C)(C)CBr MCULE-1417156153 [0,1,0,0,0,0|3,0,0]=4 1404 B7R0.13 CC(C)C(C)(C)CN MCULE-1474008645 [0,1,0,0,0,0|3,0,0]=4 1405 B7R0.13 CC(C)C(C)(C)CN MCULE-3575810096 [0,1,0,0,0,0|3,0,0]=4 1406 B7R0.13 CC(C)C(C)(C)CO MCULE-1206498909 [0,1,0,0,0,0|2,0,0]=3 1407 B7R0.13 CC(C)C(C)(N)C#N MCULE-1173643434 [0,1,0,0,0,0|2,0,1]=4 1408 B7R0.13 CC(C)C(C)(N)CN MCULE-2884198159 [0,1,0,0,0,0|2,0,0]=3 1409 B7R0.13 CC(C)C(C)(O)CN MCULE-2436598879 [0,1,0,0,0,0|3,0,0]=4 1410 B7R0.13 CC(C)C(C)(O)CO MCULE-7640109698 [0,1,0,0,0,0|2,0,0]=3 1411 B7R0.13 CC(N)(CO)C(=O)O MCULE-5973815630 [0,1,0,0,0,0|1,0,1]=3 1412 B7R0.13 CC(N)(CO)C(=O)O MCULE-6877149014 [0,1,0,0,0,0|1,0,1]=3 1413 B7R0.13 CC(N)(CS)C(=O)O MCULE-4669241619 [0,1,0,0,0,0|1,1,1]=4 1414 B7R0.13 CC(N)(CS)C(=O)O MCULE-8539612367 [0,1,0,0,0,0|1,1,1]=4 1415 B7R0.13 CC(O)(CO)C(=O)O MCULE-5566145169 [0,1,0,0,0,0|2,0,1]=4 1416 B7R0.13 CC(O)C(C)(C)C#N MCULE-7199396443 [0,1,0,0,0,0|2,0,1]=4 1417 B7R0.13 CC(O)C(C)(C)CN MCULE-2675460571 [0,1,0,0,0,0|2,0,0]=3 1418 B7R0.13 CC(O)C(C)(C)CO MCULE-1064066796 [0,1,0,0,0,0|1,0,0]=2 1419 B7R0.13 CCC(C)(C)C(C)N MCULE-8507623985 [0,1,0,0,0,0|3,0,0]=4 1420 B7R0.13 CCC(C)(C)C(C)N MCULE-9937664897 [0,1,0,0,0,0|3,0,0]=4 1421 B7R0.13 CCC(C)(N)C(=O)O MCULE-4944905519 [0,1,0,0,0,0|2,0,1]=4 1422 B7R0.13 CCC(C)(N)C(=O)O MCULE-8684474701 [0,1,0,0,0,0|2,0,1]=4 1423 B7R0.13 CCC(C)(N)C(=O)O MCULE-9925925283 [0,1,0,0,0,0|2,0,1]=4 1424 B7R0.13 CCC(C)(O)C(C)O MCULE-5475978311 [0,1,0,0,0,0|2,0,0]=3 1425 B7R0.13 CC[C@@](C)(N)C(=O)O MCULE-4076270773 [0,1,0,0,0,0|2,0,1]=4 1426 B7R0.13 CC[C@@](C)(N)C(=O)O MCULE-4696366287 [0,1,0,0,0,0|2,0,1]=4 1427 B7R0.13 CC[C@@](C)(N)C(=O)O MCULE-7243626223 [0,1,0,0,0,0|2,0,1]=4 1428 B7R0.13 CC[C@@](C)(N)C(=O)O MCULE-8928070809 [0,1,0,0,0,0|2,0,1]=4 1429 B7R0.13 CC[C@](C)(N)C(=O)O MCULE-1912860688 [0,1,0,0,0,0|2,0,1]=4 1430 B7R0.13 CC[C@](C)(N)C(=O)O MCULE-3601494140 [0,1,0,0,0,0|2,0,1]=4 1431 B7R0.13 CC[C@](C)(N)C(=O)O MCULE-4886902354 [0,1,0,0,0,0|2,0,1]=4 1432 B7R0.13 CC[C@](C)(N)C(=O)O MCULE-8271138085 [0,1,0,0,0,0|2,0,1]=4 1433 B7R0.13 CN(C)C(C)(C)CO MCULE-8067899319 [0,1,0,0,0,0|3,0,0]=4 1434 B7R0.13 C[C@@](N)(CO)C(=O)O MCULE-2146963065 [0,1,0,0,0,0|1,0,1]=3 1435 B7R0.13 C[C@@](N)(CO)C(=O)O MCULE-7622447669 [0,1,0,0,0,0|1,0,1]=3 1436 B7R0.13 C[C@@](N)(CS)C(=O)O MCULE-2627761655 [0,1,0,0,0,0|1,1,1]=4 1437 B7R0.13 C[C@@](N)(CS)C(=O)O MCULE-2887268414 [0,1,0,0,0,0|1,1,1]=4 1438 B7R0.13 C[C@@](N)(CS)C(=O)O MCULE-6190318443 [0,1,0,0,0,0|1,1,1]=4 1439 B7R0.13 C[C@@](N)(CS)C(=O)O MCULE-8033021501 [0,1,0,0,0,0|1,1,1]=4 1440 B7R0.13 C[C@](N)(CO)C(=O)O MCULE-2760852916 [0,1,0,0,0,0|1,0,1]=3 1441 B7R0.13 C[C@](N)(CO)C(=O)O MCULE-4734633152 [0,1,0,0,0,0|1,0,1]=3 1442 B7R0.13 C[C@](N)(CS)C(=O)O MCULE-1527310768 [0,1,0,0,0,0|1,1,1]=4 1443 B7R0.13 C[C@](N)(CS)C(=O)O MCULE-4351926054 [0,1,0,0,0,0|1,1,1]=4 1444 B7R0.13 C[C@](N)(CS)C(=O)O MCULE-6261566257 [0,1,0,0,0,0|1,1,1]=4 1445 B7R0.13 C[C@](N)(CS)C(=O)O MCULE-9035242130 [0,1,0,0,0,0|1,1,1]=4 1446 B7R0.13 O=C(O)C(F)(F)CO MCULE-4913704401 [0,1,0,0,0,0|2,0,1]=4 1447 B7R0.13 OCC(F)(F)C(F)F MCULE-7521368673 [0,1,0,0,0,0|3,0,0]=4 1448 B7R0.14 C#CC(N)C(C)(C)C MCULE-2706228782 [0,1,0,0,0,0|2,0,1]=4 1449 B7R0.14 C#CC(N)C(C)(C)C MCULE-9194263850 [0,1,0,0,0,0|2,0,1]=4 1450 B7R0.14 C/C(=N\O)/C(C)(C)O MCULE-4351772949 [0,1,0,0,0,0|2,0,1]=4 1451 B7R0.14 C=CC(C)C(C)(C)O MCULE-5525082295 [0,1,0,0,0,0|2,0,1]=4 1452 B7R0.14 CC(=NO)C(C)(C)O MCULE-8500175274 [0,1,0,0,0,0|2,0,1]=4 1453 B7R0.14 CC(C)(C)/C(=N/O)/N MCULE-2323239146 [0,1,0,0,0,0|2,0,1]=4 1454 B7R0.14 CC(C)(C)C(=O)CO MCULE-4134803818 [0,1,0,0,0,0|2,0,1]=4 1455 B7R0.14 CC(C)(C)C(N)C#N MCULE-5227647923 [0,1,0,0,0,0|2,0,1]=4 1456 B7R0.14 CC(C)(C)C(N)C#N MCULE-9610190767 [0,1,0,0,0,0|2,0,1]=4 1457 B7R0.14 CC(C)(C)C(N)CN MCULE-8180805916 [0,1,0,0,0,0|2,0,0]=3 1458 B7R0.14 CC(C)(C)C(N)CN MCULE-8277347683 [0,1,0,0,0,0|2,0,0]=3 1459 B7R0.14 CC(C)(C)C(N)CO MCULE-7753244981 [0,1,0,0,0,0|1,0,0]=2 1460 B7R0.14 CC(C)(C)C(N)CO MCULE-8719256669 [0,1,0,0,0,0|1,0,0]=2 1461 B7R0.14 CC(C)(C)C(O)CBr MCULE-7385281890 [0,1,0,0,0,0|3,0,0]=4 1462 B7R0.14 CC(C)(C)C(O)CCl MCULE-2463075191 [0,1,0,0,0,0|3,0,0]=4 1463 B7R0.14 CC(C)(C)C(O)CN MCULE-1008278452 [0,1,0,0,0,0|3,0,0]=4 1464 B7R0.14 CC(C)(C)C(O)CO MCULE-2952507658 [0,1,0,0,0,0|2,0,0]=3 1465 B7R0.14 CC(C)(C)[C@@H](N)CO MCULE-3982110596 [0,1,0,0,0,0|1,0,0]=2 1466 B7R0.14 CC(C)(C)[C@@H](N)CO MCULE-5537283120 [0,1,0,0,0,0|1,0,0]=2 1467 B7R0.14 CC(C)(C)[C@@H](N)CO MCULE-9278147798 [0,1,0,0,0,0|1,0,0]=2 1468 B7R0.14 CC(C)(C)[C@H](N)CO MCULE-2023958874 [0,1,0,0,0,0|1,0,0]=2 1469 B7R0.14 CC(C)(C)[C@H](N)CO MCULE-6480065609 [0,1,0,0,0,0|1,0,0]=2 1470 B7R0.14 CC(C)(O)C(=N)NO MCULE-3400813193 [0,1,0,0,0,0|1,0,2]=4 1471 B7R0.14 CC(C)(O)C(F)CN MCULE-4048927334 [0,1,0,0,0,0|2,0,0]=3 1472 B7R0.14 CC(C)(O)C(F)CN MCULE-5250059338 [0,1,0,0,0,0|2,0,0]=3 1473 B7R0.14 CC(C)(O)C(F)CN MCULE-6618174177 [0,1,0,0,0,0|2,0,0]=3 1474 B7R0.14 CC(C)(O)C(O)CN MCULE-5716430192 [0,1,0,0,0,0|2,0,0]=3 1475 B7R0.14 CC(C)(O)[C@@H](F)CN MCULE-4206986361 [0,1,0,0,0,0|2,0,0]=3 1476 B7R0.14 CC(C)(O)[C@@H](F)CN MCULE-4332950642 [0,1,0,0,0,0|2,0,0]=3 1477 B7R0.14 CC(C)(O)[C@@H](F)CN MCULE-5233683424 [0,1,0,0,0,0|2,0,0]=3 1478 B7R0.14 CC(C)(O)[C@@H](F)CN MCULE-9403366864 [0,1,0,0,0,0|2,0,0]=3 1479 B7R0.14 CC(C)(O)[C@H](F)CN MCULE-3837695935 [0,1,0,0,0,0|2,0,0]=3 1480 B7R0.14 CC(C)(O)[C@H](F)CN MCULE-5691809916 [0,1,0,0,0,0|2,0,0]=3 1481 B7R0.14 CC(C)(O)[C@H](F)CN MCULE-5910344650 [0,1,0,0,0,0|2,0,0]=3 1482 B7R0.14 CC(CBr)C(C)(C)C MCULE-6651711768 [0,1,0,0,0,0|3,0,0]=4 1483 B7R0.14 CC(CBr)C(C)(F)F MCULE-1127900198 [0,1,0,0,0,0|3,0,0]=4 1484 B7R0.14 CC(CCl)C(C)(C)C MCULE-3598136068 [0,1,0,0,0,0|3,0,0]=4 1485 B7R0.14 CC(CI)C(C)(C)C MCULE-7307944422 [0,1,0,0,0,0|3,0,0]=4 1486 B7R0.14 CC(CN)C(C)(C)C MCULE-9518533099 [0,1,0,0,0,0|3,0,0]=4 1487 B7R0.14 CC(CN)C(C)(C)C MCULE-9752514124 [0,1,0,0,0,0|3,0,0]=4 1488 B7R0.14 CC(CO)C(C)(C)C MCULE-7343676375 [0,1,0,0,0,0|2,0,0]=3 1489 B7R0.14 CC(CO)C(C)(C)O MCULE-8073024148 [0,1,0,0,0,0|1,0,0]=2 1490 B7R0.14 CC(CO)C(C)(F)F MCULE-3224311448 [0,1,0,0,0,0|2,0,0]=3 1491 B7R0.14 CC(CO)C(F)(F)F MCULE-9030047774 [0,1,0,0,0,0|3,0,0]=4 1492 B7R0.14 CCC(C)C(C)(C)C MCULE-9713655910 [0,1,0,0,0,0|3,0,0]=4 1493 B7R0.14 CCC(N)C(C)(C)O MCULE-2452246439 [0,1,0,0,0,0|1,0,0]=2 1494 B7R0.14 CCC(N)C(C)(C)O MCULE-3686970762 [0,1,0,0,0,0|1,0,0]=2 1495 B7R0.14 CCC(N)C(F)(F)F MCULE-4537932742 [0,1,0,0,0,0|3,0,0]=4 1496 B7R0.14 CCC(N)C(F)(F)F MCULE-6861875769 [0,1,0,0,0,0|3,0,0]=4 1497 B7R0.14 CCC(N)C(F)(F)F MCULE-8270390509 [0,1,0,0,0,0|3,0,0]=4 1498 B7R0.14 CCC(N)C(F)(F)F MCULE-9069293994 [0,1,0,0,0,0|3,0,0]=4 1499 B7R0.14 CCC(N)P(=O)(O)O MCULE-5746903883 [0,1,0,0,0,0|3,0,0]=4 1500 B7R0.14 CCC(O)C(C)(C)C MCULE-4883174975 [0,1,0,0,0,0|3,0,0]=4 1501 B7R0.14 CC[C@@H](N)C(C)(C)C MCULE-2279581739 [0,1,0,0,0,0|2,0,0]=3 1502 B7R0.14 CC[C@@H](N)C(C)(C)C MCULE-9333884063 [0,1,0,0,0,0|2,0,0]=3 1503 B7R0.14 CC[C@@H](N)C(C)(C)O MCULE-2250873384 [0,1,0,0,0,0|1,0,0]=2 1504 B7R0.14 CC[C@@H](N)C(C)(C)O MCULE-7069208023 [0,1,0,0,0,0|1,0,0]=2 1505 B7R0.14 CC[C@@H](N)C(F)(F)F MCULE-1171232831 [0,1,0,0,0,0|3,0,0]=4 1506 B7R0.14 CC[C@@H](N)C(F)(F)F MCULE-3783951874 [0,1,0,0,0,0|3,0,0]=4 1507 B7R0.14 CC[C@@H](N)C(F)(F)F MCULE-5352019658 [0,1,0,0,0,0|3,0,0]=4 1508 B7R0.14 CC[C@@H](N)C(F)(F)F MCULE-9183297198 [0,1,0,0,0,0|3,0,0]=4 1509 B7R0.14 CC[C@H](N)C(C)(C)O MCULE-6344226071 [0,1,0,0,0,0|1,0,0]=2 1510 B7R0.14 CC[C@H](N)C(C)(C)O MCULE-7677944024 [0,1,0,0,0,0|1,0,0]=2 1511 B7R0.14 CC[C@H](N)C(F)(F)F MCULE-1719690048 [0,1,0,0,0,0|3,0,0]=4 1512 B7R0.14 CC[C@H](N)C(F)(F)F MCULE-2919616585 [0,1,0,0,0,0|3,0,0]=4 1513 B7R0.14 CC[C@H](N)C(F)(F)F MCULE-4834979665 [0,1,0,0,0,0|3,0,0]=4 1514 B7R0.14 CC[C@H](N)C(F)(F)F MCULE-5697759277 [0,1,0,0,0,0|3,0,0]=4 1515 B7R0.14 CNC(C)C(C)(C)O MCULE-9520032279 [0,1,0,0,0,0|3,0,0]=4 1516 B7R0.14 C[C@@H](CO)C(C)(C)O MCULE-1478332547 [0,1,0,0,0,0|1,0,0]=2 1517 B7R0.14 C[C@@H](CO)C(C)(C)O MCULE-2286439441 [0,1,0,0,0,0|1,0,0]=2 1518 B7R0.14 C[C@@H](CO)C(F)(F)F MCULE-7511013445 [0,1,0,0,0,0|3,0,0]=4 1519 B7R0.14 NC(CO)C(F)(F)F MCULE-2641240928 [0,1,0,0,0,0|2,0,0]=3 1520 B7R0.14 NC(CO)C(F)(F)F MCULE-3260611956 [0,1,0,0,0,0|2,0,0]=3 1521 B7R0.14 NC(CO)C(F)(F)F MCULE-6521043262 [0,1,0,0,0,0|2,0,0]=3 1522 B7R0.14 NC(CO)C(F)(F)F MCULE-6855440763 [0,1,0,0,0,0|2,0,0]=3 1523 B7R0.14 NCC(N)C(F)(F)F MCULE-4962708380 [0,1,0,0,0,0|3,0,0]=4 1524 B7R0.14 NCC(N)C(F)(F)F MCULE-7876092837 [0,1,0,0,0,0|3,0,0]=4 1525 B7R0.14 NC[C@@H](N)C(F)(F)F MCULE-1982395976 [0,1,0,0,0,0|3,0,0]=4 1526 B7R0.14 NC[C@@H](N)C(F)(F)F MCULE-2582208735 [0,1,0,0,0,0|3,0,0]=4 1527 B7R0.14 NC[C@H](N)C(F)(F)F MCULE-1485698533 [0,1,0,0,0,0|3,0,0]=4 1528 B7R0.14 NC[C@H](N)C(F)(F)F MCULE-3228844452 [0,1,0,0,0,0|3,0,0]=4 1529 B7R0.14 NC[C@H](N)C(F)(F)F MCULE-3921882793 [0,1,0,0,0,0|3,0,0]=4 1530 B7R0.14 NC[C@H](N)C(F)(F)F MCULE-4215219248 [0,1,0,0,0,0|3,0,0]=4 1531 B7R0.14 NC[C@H](N)C(F)(F)F MCULE-9206152037 [0,1,0,0,0,0|3,0,0]=4 1532 B7R0.14 N[C@@H](CF)C(F)(F)F MCULE-4186877289 [0,1,0,0,0,0|3,0,0]=4 1533 B7R0.14 N[C@@H](CF)C(F)(F)F MCULE-8102425234 [0,1,0,0,0,0|3,0,0]=4 1534 B7R0.14 N[C@@H](CO)C(F)(F)F MCULE-1212649330 [0,1,0,0,0,0|2,0,0]=3 1535 B7R0.14 N[C@@H](CO)C(F)(F)F MCULE-2584311973 [0,1,0,0,0,0|2,0,0]=3 1536 B7R0.14 N[C@@H](CO)C(F)(F)F MCULE-4865641675 [0,1,0,0,0,0|2,0,0]=3 1537 B7R0.14 N[C@@H](CO)C(F)(F)F MCULE-9004262786 [0,1,0,0,0,0|2,0,0]=3 1538 B7R0.14 N[C@H](CF)C(F)(F)F MCULE-1345692525 [0,1,0,0,0,0|3,0,0]=4 1539 B7R0.14 N[C@H](CF)C(F)(F)F MCULE-2215766015 [0,1,0,0,0,0|3,0,0]=4 1540 B7R0.14 N[C@H](CO)C(F)(F)F MCULE-3648712449 [0,1,0,0,0,0|2,0,0]=3 1541 B7R0.14 N[C@H](CO)C(F)(F)F MCULE-4221707496 [0,1,0,0,0,0|2,0,0]=3 1542 B7R0.14 N[C@H](CO)C(F)(F)F MCULE-7828194741 [0,1,0,0,0,0|2,0,0]=3 1543 B7R0.14 N[C@H](CO)C(F)(F)F MCULE-8232441976 [0,1,0,0,0,0|2,0,0]=3 1544 B7R0.14 OCC(Br)C(F)(F)F MCULE-4760023988 [0,1,0,0,0,0|3,0,0]=4 1545 B7R0.14 OCC(F)C(F)(F)F MCULE-4650557310 [0,1,0,0,0,0|3,0,0]=4 1546 B7R0.14 OCC(O)C(F)(F)F MCULE-7099011877 [0,1,0,0,0,0|3,0,0]=4 1547 B7R0.14 OC[C@@H](O)C(F)(F)F MCULE-1547382437 [0,1,0,0,0,0|3,0,0]=4 1548 B7R0.14 [NH3+]C(CO)C(C)(C)C MCULE-6310162573 [0,1,0,0,0,0|1,0,1]=3 1549 B7R0.15 CC(=O)C(CO)CO MCULE-6408384667 [0,1,0,0,0,0|1,0,2]=4 1550 B7R0.15 CC(C)C(CN)CO MCULE-2517509906 [0,1,0,0,0,0|1,0,0]=2 1551 B7R0.15 CC(C)C(CO)CO MCULE-8569465631 [0,1,0,0,0,0|2,0,0]=3 1552 B7R0.15 CC(C)C(CO)ON MCULE-7037439016 [0,1,0,0,0,0|1,0,0]=2 1553 B7R0.15 CC(C)C(CO)ON MCULE-9325437885 [0,1,0,0,0,0|1,0,0]=2 1554 B7R0.15 CC(O)C(CO)CO MCULE-9986430379 [0,1,0,0,0,0|1,0,0]=2 1555 B7R0.15 CCC(C=O)C(C)C MCULE-4336481271 [0,1,0,0,0,0|3,0,0]=4 1556 B7R0.15 CCC(CC)C(C)C MCULE-3824081707 [0,1,0,0,0,0|3,0,0]=4 1557 B7R0.15 CCC(CC)C(C)N MCULE-1696057542 [0,1,0,0,0,0|3,0,0]=4 1558 B7R0.15 CCC(CC)C(C)O MCULE-9742014522 [0,1,0,0,0,0|2,0,0]=3 1559 B7R0.15 CCC(CN)C(=O)O MCULE-3795207054 [0,1,0,0,0,0|2,0,1]=4 1560 B7R0.15 CCC(CN)C(=O)O MCULE-3929048283 [0,1,0,0,0,0|2,0,1]=4 1561 B7R0.15 CCC(CN)C(C)C MCULE-1827845015 [0,1,0,0,0,0|2,0,0]=3 1562 B7R0.15 CCC(CN)N(C)C MCULE-3799974702 [0,1,0,0,0,0|3,0,0]=4 1563 B7R0.15 CCC(CN)N(C)C MCULE-4033411563 [0,1,0,0,0,0|3,0,0]=4 1564 B7R0.15 CCC(CO)C(=O)O MCULE-9435802738 [0,1,0,0,0,0|2,0,1]=4 1565 B7R0.15 CCC(CO)C(C)C MCULE-5089280337 [0,1,0,0,0,0|2,0,0]=3 1566 B7R0.15 CCC(CO)N(C)C MCULE-2812328375 [0,1,0,0,0,0|3,0,0]=4 1567 B7R0.15 CCC(NC)C(=O)O MCULE-4101988968 [0,1,0,0,0,0|2,0,1]=4 1568 B7R0.15 CCC(NC)C(=O)O MCULE-4491873969 [0,1,0,0,0,0|2,0,1]=4 1569 B7R0.15 CCC(NN)C(=O)O MCULE-8823684595 [0,1,0,0,0,0|2,0,1]=4 1570 B7R0.15 CCC(NO)C(=O)O MCULE-1962461048 [0,1,0,0,0,0|2,0,1]=4 1571 B7R0.15 CC[C@@H](CN)C(=O)O MCULE-3190659348 [0,1,0,0,0,0|2,0,1]=4 1572 B7R0.15 CC[C@@H](CN)C(=O)O MCULE-5613487575 [0,1,0,0,0,0|2,0,1]=4 1573 B7R0.15 CC[C@@H](CN)C(=O)O MCULE-6726398435 [0,1,0,0,0,0|2,0,1]=4 1574 B7R0.15 CC[C@H](CN)C(=O)O MCULE-2222410753 [0,1,0,0,0,0|2,0,1]=4 1575 B7R0.15 CC[C@H](CN)C(=O)O MCULE-3153536523 [0,1,0,0,0,0|2,0,1]=4 1576 B7R0.15 CC[C@H](CO)C(=O)O MCULE-3017159819 [0,1,0,0,0,0|2,0,1]=4 1577 B7R0.15 CN(C)C(CN)CO MCULE-6987208473 [0,1,0,0,0,0|2,0,0]=3 1578 B7R0.15 CN(C)C(CO)CO MCULE-6589056011 [0,1,0,0,0,0|3,0,0]=4 1579 B7R0.15 CNC(CO)C(=O)O MCULE-1439435474 [0,1,0,0,0,0|1,0,1]=3 1580 B7R0.15 CNC(CO)C(=O)O MCULE-7611211207 [0,1,0,0,0,0|1,0,1]=3 1581 B7R0.15 CNC(CO)C(C)C MCULE-5445088789 [0,1,0,0,0,0|1,0,0]=2 1582 B7R0.15 CNC(CS)C(=O)O MCULE-4817727684 [0,1,0,0,0,0|1,1,1]=4 1583 B7R0.15 CNC(CS)C(=O)O MCULE-5741984055 [0,1,0,0,0,0|1,1,1]=4 1584 B7R0.15 CN[C@@H](CN)C(=O)O MCULE-3196852022 [0,1,0,0,0,0|2,0,1]=4 1585 B7R0.15 CN[C@@H](CN)C(=O)O MCULE-3690177999 [0,1,0,0,0,0|2,0,1]=4 1586 B7R0.15 CN[C@@H](CO)C(=O)O MCULE-3320307572 [0,1,0,0,0,0|1,0,1]=3 1587 B7R0.15 CN[C@@H](CO)C(=O)O MCULE-5844994620 [0,1,0,0,0,0|1,0,1]=3 1588 B7R0.15 CN[C@@H](CO)C(=O)O MCULE-6293854138 [0,1,0,0,0,0|1,0,1]=3 1589 B7R0.15 CN[C@@H](CO)C(=O)O MCULE-6463850730 [0,1,0,0,0,0|1,0,1]=3 1590 B7R0.15 CN[C@@H](CS)C(=O)O MCULE-3043115433 [0,1,0,0,0,0|1,1,1]=4 1591 B7R0.15 CN[C@@H](CS)C(=O)O MCULE-8814760080 [0,1,0,0,0,0|1,1,1]=4 1592 B7R0.15 CN[C@H](CO)C(=O)O MCULE-1791141182 [0,1,0,0,0,0|1,0,1]=3 1593 B7R0.15 CN[C@H](CO)C(=O)O MCULE-9346314213 [0,1,0,0,0,0|1,0,1]=3 1594 B7R0.15 COC(CBr)C(C)C MCULE-2169119261 [0,1,0,0,0,0|3,0,0]=4 1595 B7R0.15 COC(CN)C(C)C MCULE-9651783224 [0,1,0,0,0,0|3,0,0]=4 1596 B7R0.15 COC(CO)C(C)Br MCULE-6071239484 [0,1,0,0,0,0|2,0,0]=3 1597 B7R0.15 COC(CO)C(C)C MCULE-8695619177 [0,1,0,0,0,0|2,0,0]=3 1598 B7R0.15 COC(CO)C(C)N MCULE-9816044841 [0,1,0,0,0,0|2,0,0]=3 1599 B7R0.15 COC(OC)C(C)O MCULE-9058387582 [0,1,0,0,0,0|3,0,0]=4 1600 B7R0.15 COC(OC)[C@@H](C)O MCULE-2524252240 [0,1,0,0,0,0|3,0,0]=4 1601 B7R0.15 COC(OC)[C@H](C)O MCULE-2577056762 [0,1,0,0,0,0|3,0,0]=4 1602 B7R0.15 CO[C@@H](CO)C(C)C MCULE-3676351737 [0,1,0,0,0,0|2,0,0]=3 1603 B7R0.15 CO[C@H](CO)C(C)C MCULE-2189146072 [0,1,0,0,0,0|2,0,0]=3 1604 B7R0.15 CSC(CO)C(C)N MCULE-6491195363 [0,1,0,0,0,0|2,0,0]=3 1605 B7R0.15 NCC(CO)C(=O)O MCULE-5510878508 [0,1,0,0,0,0|1,0,1]=3 1606 B7R0.15 NCC(CO)C(=O)O MCULE-9991285445 [0,1,0,0,0,0|1,0,1]=3 1607 B7R0.15 NC[C@@H](CO)C(=O)O MCULE-4607648703 [0,1,0,0,0,0|1,0,1]=3 1608 B7R0.15 NC[C@@H](CO)C(=O)O MCULE-8943978569 [0,1,0,0,0,0|1,0,1]=3 1609 B7R0.15 NC[C@H](CO)C(=O)O MCULE-8459713640 [0,1,0,0,0,0|1,0,1]=3 1610 B7R0.15 O=C(O)[C@H](CO)NP MCULE-8418001133 [0,1,0,0,0,0|1,0,1]=3 1611 B7R0.16 C=C(C)C(N)C(=O)O MCULE-1815568719 [0,1,0,0,0,0|1,0,2]=4 1612 B7R0.16 C=C(C)C(N)C(=O)O MCULE-2839869274 [0,1,0,0,0,0|1,0,2]=4 1613 B7R0.16 C=C(C)C(N)C(=O)O MCULE-5015326828 [0,1,0,0,0,0|1,0,2]=4 1614 B7R0.16 C=C(C)C(N)C(=O)O MCULE-5043630144 [0,1,0,0,0,0|1,0,2]=4 1615 B7R0.16 C=C(C)[C@@H](N)C(=C)O MCULE-5278584348 [0,1,0,0,0,0|1,0,2]=4 1616 B7R0.16 C=C(C)[C@@H](N)C(=O)O MCULE-2007035571 [0,1,0,0,0,0|1,0,2]=4 1617 B7R0.16 C=C(C)[C@@H](N)C(=O)O MCULE-6240689602 [0,1,0,0,0,0|1,0,2]=4 1618 B7R0.16 C=C(C)[C@@H](N)C(=O)O MCULE-8025014656 [0,1,0,0,0,0|1,0,2]=4 1619 B7R0.16 C=C(C)[C@@H](N)C(=O)O MCULE-9704891439 [0,1,0,0,0,0|1,0,2]=4 1620 B7R0.16 CC(Br)C(Br)C(=O)O MCULE-8605068480 [0,1,0,0,0,0|2,0,1]=4 1621 B7R0.16 CC(Br)C(O)C(=O)O MCULE-8231714451 [0,1,0,0,0,0|2,0,1]=4 1622 B7R0.16 CC(C)C(Br)C(=O)O MCULE-7284929535 [0,1,0,0,0,0|2,0,1]=4 1623 B7R0.16 CC(C)C(Br)C(=O)O MCULE-8100016953 [0,1,0,0,0,0|2,0,1]=4 1624 B7R0.16 CC(C)C(C)C(=O)O MCULE-4998524686 [0,1,0,0,0,0|2,0,1]=4 1625 B7R0.16 CC(C)C(C)C(C)C MCULE-2831761094 [0,1,0,0,0,0|3,0,0]=4 1626 B7R0.16 CC(C)C(Cl)C(=O)O MCULE-8634615546 [0,1,0,0,0,0|2,0,1]=4 1627 B7R0.16 CC(C)C(F)C(=O)O MCULE-5644342535 [0,1,0,0,0,0|2,0,1]=4 1628 B7R0.16 CC(C)C(N)C(=O)N MCULE-5793065876 [0,1,0,0,0,0|1,0,2]=4 1629 B7R0.16 CC(C)C(N)C(=O)N MCULE-6836215171 [0,1,0,0,0,0|1,0,2]=4 1630 B7R0.16 CC(C)C(N)C(=O)O MCULE-8140660263 [0,1,0,0,0,0|1,0,1]=3 1631 B7R0.16 CC(C)C(N)C(=O)O MCULE-9199801639 [0,1,0,0,0,0|1,0,1]=3 1632 B7R0.16 CC(C)C(N)C(C)C MCULE-2164638983 [0,1,0,0,0,0|2,0,0]=3 1633 B7R0.16 CC(C)C(N)C(C)C MCULE-8563510082 [0,1,0,0,0,0|2,0,0]=3 1634 B7R0.16 CC(C)C(O)C(=O)O MCULE-6517225229 [0,1,0,0,0,0|2,0,1]=4 1635 B7R0.16 CC(C)C(O)C(=O)O MCULE-7748605101 [0,1,0,0,0,0|2,0,1]=4 1636 B7R0.16 CC(C)C(O)C(C)C MCULE-3471523029 [0,1,0,0,0,0|3,0,0]=4 1637 B7R0.16 CC(C)C(O)C(C)N MCULE-1856841813 [0,1,0,0,0,0|3,0,0]=4 1638 B7R0.16 CC(C)C(S)C(C)C MCULE-3605843125 [0,1,0,0,0,0|3,0,0]=4 1639 B7R0.16 CC(C)[C@@H](Br)C(=O)O MCULE-2705531785 [0,1,0,0,0,0|2,0,1]=4 1640 B7R0.16 CC(C)[C@@H](Br)C(=O)O MCULE-7570119486 [0,1,0,0,0,0|2,0,1]=4 1641 B7R0.16 CC(C)[C@@H](N)C(=O)N MCULE-2330575489 [0,1,0,0,0,0|1,0,2]=4 1642 B7R0.16 CC(C)[C@@H](N)C(=O)N MCULE-2653474443 [0,1,0,0,0,0|1,0,2]=4 1643 B7R0.16 CC(C)[C@@H](N)C(=O)N MCULE-3449326352 [0,1,0,0,0,0|1,0,2]=4 1644 B7R0.16 CC(C)[C@@H](N)C(=O)N MCULE-7409435805 [0,1,0,0,0,0|1,0,2]=4 1645 B7R0.16 CC(C)[C@@H](N)C(=O)O MCULE-1338052740 [0,1,0,0,0,0|1,0,1]=3 1646 B7R0.16 CC(C)[C@@H](N)C(=O)O MCULE-2459930572 [0,1,0,0,0,0|1,0,1]=3 1647 B7R0.16 CC(C)[C@@H](O)C(=O)O MCULE-7719048521 [0,1,0,0,0,0|2,0,1]=4 1648 B7R0.16 CC(C)[C@@H](O)C(=O)O MCULE-9864796653 [0,1,0,0,0,0|2,0,1]=4 1649 B7R0.16 CC(C)[C@H](Br)C(=O)O MCULE-4863317096 [0,1,0,0,0,0|2,0,1]=4 1650 B7R0.16 CC(C)[C@H](Br)C(=O)O MCULE-8695526864 [0,1,0,0,0,0|2,0,1]=4 1651 B7R0.16 CC(C)[C@H](C)C(=O)O MCULE-4413397700 [0,1,0,0,0,0|2,0,1]=4 1652 B7R0.16 CC(C)[C@H](C)C(=O)O MCULE-6269612306 [0,1,0,0,0,0|2,0,1]=4 1653 B7R0.16 CC(C)[C@H](Cl)C(=O)O MCULE-8084934210 [0,1,0,0,0,0|2,0,1]=4 1654 B7R0.16 CC(C)[C@H](Cl)C(=O)O MCULE-8307595659 [0,1,0,0,0,0|2,0,1]=4 1655 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-1415573194 [0,1,0,0,0,0|1,0,2]=4 1656 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-2742126302 [0,1,0,0,0,0|1,0,2]=4 1657 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-3124084676 [0,1,0,0,0,0|1,0,2]=4 1658 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-4854272542 [0,1,0,0,0,0|1,0,2]=4 1659 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-7430998836 [0,1,0,0,0,0|1,0,2]=4 1660 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-9899853579 [0,1,0,0,0,0|1,0,2]=4 1661 B7R0.16 CC(C)[C@H](N)C(=O)O MCULE-2507309072 [0,1,0,0,0,0|1,0,1]=3 1662 B7R0.16 CC(C)[C@H](N)C(=O)O MCULE-9143825935 [0,1,0,0,0,0|1,0,1]=3 1663 B7R0.16 CC(C)[C@H](O)C(=O)O MCULE-1975771806 [0,1,0,0,0,0|2,0,1]=4 1664 B7R0.16 CC(C)[C@H](O)C(=O)O MCULE-4070611738 [0,1,0,0,0,0|2,0,1]=4 1665 B7R0.16 CC(F)C(N)C(=O)O MCULE-8810968604 [0,1,0,0,0,0|1,0,1]=3 1666 B7R0.16 CC(N)C(C)C(=O)O MCULE-2921617741 [0,1,0,0,0,0|2,0,1]=4 1667 B7R0.16 CC(N)C(C)C(=O)O MCULE-8511267926 [0,1,0,0,0,0|2,0,1]=4 1668 B7R0.16 CC(N)C(O)C(=O)O MCULE-1086139043 [0,1,0,0,0,0|2,0,1]=4 1669 B7R0.16 CC(N)C(O)C(=O)O MCULE-6405300346 [0,1,0,0,0,0|2,0,1]=4 1670 B7R0.16 CC(O)C(C)C(=O)O MCULE-2499360516 [0,1,0,0,0,0|1,0,1]=3 1671 B7R0.16 CC(O)C(C)N(=O)=O MCULE-8190257217 [0,1,0,0,0,0|2,0,1]=4 1672 B7R0.16 CC(O)C(N)C(=O)N MCULE-1234785834 [0,1,0,0,0,0|0,0,2]=3 1673 B7R0.16 CC(O)C(N)C(=O)N MCULE-5867306342 [0,1,0,0,0,0|0,0,2]=3 1674 B7R0.16 CC(O)C(N)C(=O)O MCULE-1563595722 [0,1,0,0,0,0|0,0,1]=2 1675 B7R0.16 CC(O)C(N)C(=O)O MCULE-5581920538 [0,1,0,0,0,0|0,0,1]=2 1676 B7R0.16 C[C@@H](N)[C@@H](N)C(=O)O MCULE-5302456851 [0,1,0,0,0,0|1,0,1]=3 1677 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O MCULE-1663687439 [0,1,0,0,0,0|0,0,1]=2 1678 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O MCULE-3863591433 [0,1,0,0,0,0|0,0,1]=2 1679 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O MCULE-8080019797 [0,1,0,0,0,0|0,0,1]=2 1680 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O MCULE-9284411012 [0,1,0,0,0,0|0,0,1]=2 1681 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-1969228933 [0,1,0,0,0,0|0,0,2]=3 1682 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-3285041526 [0,1,0,0,0,0|0,0,2]=3 1683 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-5018319528 [0,1,0,0,0,0|0,0,2]=3 1684 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-6080625355 [0,1,0,0,0,0|0,0,2]=3 1685 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-9393787536 [0,1,0,0,0,0|0,0,2]=3 1686 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-9925689829 [0,1,0,0,0,0|0,0,2]=3 1687 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-2430667007 [0,1,0,0,0,0|0,0,1]=2 1688 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-2676185993 [0,1,0,0,0,0|0,0,1]=2 1689 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-5254477364 [0,1,0,0,0,0|0,0,1]=2 1690 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-5505393195 [0,1,0,0,0,0|0,0,1]=2 1691 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-7379719940 [0,1,0,0,0,0|0,0,1]=2 1692 B7R0.16 C[C@@H](O)[C@H](O)C(=O)O MCULE-9383777855 [0,1,0,0,0,0|1,0,1]=3 1693 B7R0.16 C[C@H](C(=O)O)[C@@H](C)N MCULE-2245171795 [0,1,0,0,0,0|2,0,1]=4 1694 B7R0.16 C[C@H](C(=O)O)[C@@H](C)N MCULE-2727261050 [0,1,0,0,0,0|2,0,1]=4 1695 B7R0.16 C[C@H](C(=O)O)[C@@H](C)O MCULE-8875933839 [0,1,0,0,0,0|1,0,1]=3 1696 B7R0.16 C[C@H](N)[C@@H](N)C(=O)O MCULE-9507122128 [0,1,0,0,0,0|1,0,1]=3 1697 B7R0.16 C[C@H](N)[C@@H](O)C(=O)O MCULE-2574349608 [0,1,0,0,0,0|2,0,1]=4 1698 B7R0.16 C[C@H](N)[C@@H](O)C(=O)O MCULE-6297204649 [0,1,0,0,0,0|2,0,1]=4 1699 B7R0.16 C[C@H](N)[C@H](N)C(=O)O MCULE-3178389621 [0,1,0,0,0,0|1,0,1]=3 1700 B7R0.16 C[C@H](O)C(N)C(=O)O MCULE-6661175670 [0,1,0,0,0,0|0,0,1]=2 1701 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O MCULE-6288272506 [0,1,0,0,0,0|0,0,1]=2 1702 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O MCULE-7203096302 [0,1,0,0,0,0|0,0,1]=2 1703 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O MCULE-9531951265 [0,1,0,0,0,0|0,0,1]=2 1704 B7R0.16 C[C@H](O)[C@H](N)C(=O)O MCULE-2246314901 [0,1,0,0,0,0|0,0,1]=2 1705 B7R0.16 C[C@H](O)[C@H](N)C(=O)O MCULE-9478987169 [0,1,0,0,0,0|0,0,1]=2 1706 B7R0.16 NC(C(=O)O)C(=O)O MCULE-6118746267 [0,1,0,0,0,0|1,0,2]=4 1707 B7R1.4 BrC1CCCC1Br MCULE-9172342979 [0,0,0,1,0,0|3,0,0]=4 1708 B7R1.4 Br[C@@H]1CCC[C@H]1Br MCULE-5523481790 [0,0,0,1,0,0|3,0,0]=4 1709 B7R1.4 C=C1CCCC1O MCULE-3026250203 [0,0,0,1,0,0|2,0,1]=4 1710 B7R1.4 C=C1COCC1N MCULE-4632261286 [0,0,0,1,0,0|1,0,1]=3 1711 B7R1.4 C=C1COCC1N MCULE-7153575301 [0,0,0,1,0,0|1,0,1]=3 1712 B7R1.4 CC1CCCC1Br MCULE-7816907673 [0,0,0,1,0,0|3,0,0]=4 1713 B7R1.4 CC1CCCC1N MCULE-4318156403 [0,0,0,1,0,0|2,0,0]=3 1714 B7R1.4 CC1CCCC1N MCULE-4434172193 [0,0,0,1,0,0|2,0,0]=3 1715 B7R1.4 CC1CCCC1O MCULE-1288711765 [0,0,0,1,0,0|2,0,0]=3 1716 B7R1.4 CC1CCNC1C MCULE-2184586167 [0,0,0,1,0,0|3,0,0]=4 1717 B7R1.4 CC1CNCC1C MCULE-5821391512 [0,0,0,1,0,0|3,0,0]=4 1718 B7R1.4 CC1CNCC1C MCULE-6626101399 [0,0,0,1,0,0|3,0,0]=4 1719 B7R1.4 CC1CNCC1F MCULE-4834888455 [0,0,0,1,0,0|3,0,0]=4 1720 B7R1.4 CC1CNCC1F MCULE-7766072724 [0,0,0,1,0,0|3,0,0]=4 1721 B7R1.4 CC1CNCC1N MCULE-2314973615 [0,0,0,1,0,0|2,0,0]=3 1722 B7R1.4 CC1CNCC1N MCULE-8542352354 [0,0,0,1,0,0|2,0,0]=3 1723 B7R1.4 CC1CNCC1O MCULE-3308447861 [0,0,0,1,0,0|2,0,0]=3 1724 B7R1.4 CC1CNCC1O MCULE-8526879323 [0,0,0,1,0,0|2,0,0]=3 1725 B7R1.4 CC1COCC1=O MCULE-8115238635 [0,0,0,1,0,0|1,0,2]=4 1726 B7R1.4 CC1COCC1N MCULE-5453471722 [0,0,0,1,0,0|1,0,0]=2 1727 B7R1.4 CC1COCC1N MCULE-6647217023 [0,0,0,1,0,0|1,0,0]=2 1728 B7R1.4 CC1COCC1O MCULE-5925280081 [0,0,0,1,0,0|1,0,0]=2 1729 B7R1.4 CC1CON=C1N MCULE-8845082604 [0,0,0,1,0,0|2,0,1]=4 1730 B7R1.4 CC1CSCC1N MCULE-5628200403 [0,0,0,1,0,0|1,1,0]=3 1731 B7R1.4 CC1NCCC1O MCULE-7936666458 [0,0,0,1,0,0|3,0,0]=4 1732 B7R1.4 CC1NCCC1O MCULE-8369948926 [0,0,0,1,0,0|3,0,0]=4 1733 B7R1.4 CC1OCCC1=O MCULE-8278816952 [0,0,0,1,0,0|2,0,1]=4 1734 B7R1.4 CC1OCCC1N MCULE-4343663724 [0,0,0,1,0,0|1,0,0]=2 1735 B7R1.4 CC1OCCC1N MCULE-9003879039 [0,0,0,1,0,0|1,0,0]=2 1736 B7R1.4 CC1OCCC1O MCULE-6904695721 [0,0,0,1,0,0|2,0,0]=3 1737 B7R1.4 CC1OCCC1S MCULE-9127694888 [0,0,0,1,0,0|2,0,0]=3 1738 B7R1.4 CC1OCOC1C MCULE-9497186094 [0,0,0,1,0,0|3,0,0]=4 1739 B7R1.4 CC1SCCC1N MCULE-5160182865 [0,0,0,1,0,0|1,1,0]=3 1740 B7R1.4 CC1SCCC1N MCULE-8827106279 [0,0,0,1,0,0|1,1,0]=3 1741 B7R1.4 CC1SCCC1O MCULE-4342593310 [0,0,0,1,0,0|2,1,0]=4 1742 B7R1.4 C[C@@H]1CCC[C@@H]1N MCULE-6206070680 [0,0,0,1,0,0|2,0,0]=3 1743 B7R1.4 C[C@@H]1CCC[C@@H]1N MCULE-9964938082 [0,0,0,1,0,0|2,0,0]=3 1744 B7R1.4 C[C@@H]1CCC[C@@H]1O MCULE-2617120620 [0,0,0,1,0,0|2,0,0]=3 1745 B7R1.4 C[C@@H]1CCC[C@H]1N MCULE-8385969474 [0,0,0,1,0,0|2,0,0]=3 1746 B7R1.4 C[C@@H]1CCC[C@H]1O MCULE-3398682980 [0,0,0,1,0,0|2,0,0]=3 1747 B7R1.4 C[C@@H]1CNC[C@@H]1C MCULE-4592161485 [0,0,0,1,0,0|3,0,0]=4 1748 B7R1.4 C[C@@H]1CNC[C@@H]1C MCULE-5506149631 [0,0,0,1,0,0|3,0,0]=4 1749 B7R1.4 C[C@@H]1CNC[C@@H]1F MCULE-4204399527 [0,0,0,1,0,0|3,0,0]=4 1750 B7R1.4 C[C@@H]1CNC[C@@H]1F MCULE-8451199903 [0,0,0,1,0,0|3,0,0]=4 1751 B7R1.4 C[C@@H]1CNC[C@@H]1N MCULE-2290594563 [0,0,0,1,0,0|2,0,0]=3 1752 B7R1.4 C[C@@H]1CNC[C@@H]1N MCULE-2611807697 [0,0,0,1,0,0|2,0,0]=3 1753 B7R1.4 C[C@@H]1CNC[C@@H]1N MCULE-3707409979 [0,0,0,1,0,0|2,0,0]=3 1754 B7R1.4 C[C@@H]1CNC[C@@H]1N MCULE-4317636252 [0,0,0,1,0,0|2,0,0]=3 1755 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-2015388080 [0,0,0,1,0,0|2,0,0]=3 1756 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-3625149028 [0,0,0,1,0,0|2,0,0]=3 1757 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-5773404554 [0,0,0,1,0,0|2,0,0]=3 1758 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-6014391902 [0,0,0,1,0,0|2,0,0]=3 1759 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-6476104556 [0,0,0,1,0,0|2,0,0]=3 1760 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-6537028059 [0,0,0,1,0,0|2,0,0]=3 1761 B7R1.4 C[C@@H]1CNC[C@H]1C MCULE-2567871968 [0,0,0,1,0,0|3,0,0]=4 1762 B7R1.4 C[C@@H]1CNC[C@H]1C MCULE-5626188867 [0,0,0,1,0,0|3,0,0]=4 1763 B7R1.4 C[C@@H]1CNC[C@H]1C MCULE-7438009663 [0,0,0,1,0,0|3,0,0]=4 1764 B7R1.4 C[C@@H]1CNC[C@H]1C MCULE-8649896095 [0,0,0,1,0,0|3,0,0]=4 1765 B7R1.4 C[C@@H]1CNC[C@H]1O MCULE-4207581523 [0,0,0,1,0,0|2,0,0]=3 1766 B7R1.4 C[C@@H]1CNC[C@H]1O MCULE-6158474994 [0,0,0,1,0,0|2,0,0]=3 1767 B7R1.4 C[C@@H]1CNC[C@H]1O MCULE-7380960276 [0,0,0,1,0,0|2,0,0]=3 1768 B7R1.4 C[C@@H]1CNC[C@H]1O MCULE-7589629864 [0,0,0,1,0,0|2,0,0]=3 1769 B7R1.4 C[C@@H]1COC[C@@H]1O MCULE-3198029643 [0,0,0,1,0,0|1,0,0]=2 1770 B7R1.4 C[C@@H]1COC[C@H]1N MCULE-1145772262 [0,0,0,1,0,0|1,0,0]=2 1771 B7R1.4 C[C@@H]1COC[C@H]1N MCULE-6639849267 [0,0,0,1,0,0|1,0,0]=2 1772 B7R1.4 C[C@@H]1COC[C@H]1N MCULE-9659959713 [0,0,0,1,0,0|1,0,0]=2 1773 B7R1.4 C[C@@H]1COC[C@H]1O MCULE-1967963278 [0,0,0,1,0,0|1,0,0]=2 1774 B7R1.4 C[C@@H]1NCC[C@@H]1O MCULE-1705265213 [0,0,0,1,0,0|3,0,0]=4 1775 B7R1.4 C[C@@H]1NCC[C@@H]1O MCULE-3395898129 [0,0,0,1,0,0|3,0,0]=4 1776 B7R1.4 C[C@@H]1NCC[C@@H]1O MCULE-5909894286 [0,0,0,1,0,0|3,0,0]=4 1777 B7R1.4 C[C@@H]1NCC[C@@H]1O MCULE-9998480727 [0,0,0,1,0,0|3,0,0]=4 1778 B7R1.4 C[C@@H]1NCC[C@H]1O MCULE-1101330824 [0,0,0,1,0,0|3,0,0]=4 1779 B7R1.4 C[C@@H]1NCC[C@H]1O MCULE-3326131093 [0,0,0,1,0,0|3,0,0]=4 1780 B7R1.4 C[C@@H]1NCC[C@H]1O MCULE-3941456644 [0,0,0,1,0,0|3,0,0]=4 1781 B7R1.4 C[C@@H]1NCC[C@H]1O MCULE-8944150043 [0,0,0,1,0,0|3,0,0]=4 1782 B7R1.4 C[C@@H]1OCC[C@H]1N MCULE-5910807847 [0,0,0,1,0,0|1,0,0]=2 1783 B7R1.4 C[C@@H]1OCC[C@H]1N MCULE-7586038907 [0,0,0,1,0,0|1,0,0]=2 1784 B7R1.4 C[C@H]1CCC[C@@H]1N MCULE-4150988023 [0,0,0,1,0,0|2,0,0]=3 1785 B7R1.4 C[C@H]1CCC[C@@H]1O MCULE-5212653059 [0,0,0,1,0,0|2,0,0]=3 1786 B7R1.4 C[C@H]1CCC[C@@H]1O MCULE-7997646273 [0,0,0,1,0,0|2,0,0]=3 1787 B7R1.4 C[C@H]1CCC[C@H]1N MCULE-3329868072 [0,0,0,1,0,0|2,0,0]=3 1788 B7R1.4 C[C@H]1CCC[C@H]1N MCULE-4186145172 [0,0,0,1,0,0|2,0,0]=3 1789 B7R1.4 C[C@H]1CCC[C@H]1O MCULE-3291842365 [0,0,0,1,0,0|2,0,0]=3 1790 B7R1.4 C[C@H]1CCC[C@H]1O MCULE-7570125274 [0,0,0,1,0,0|2,0,0]=3 1791 B7R1.4 C[C@H]1CCN[C@@H]1C MCULE-7622265949 [0,0,0,1,0,0|3,0,0]=4 1792 B7R1.4 C[C@H]1CCN[C@@H]1C MCULE-7686056776 [0,0,0,1,0,0|3,0,0]=4 1793 B7R1.4 C[C@H]1CNC[C@@H]1C MCULE-2214344957 [0,0,0,1,0,0|3,0,0]=4 1794 B7R1.4 C[C@H]1CNC[C@@H]1C MCULE-2877312650 [0,0,0,1,0,0|3,0,0]=4 1795 B7R1.4 C[C@H]1CNC[C@@H]1O MCULE-2282810666 [0,0,0,1,0,0|2,0,0]=3 1796 B7R1.4 C[C@H]1CNC[C@@H]1O MCULE-2772361871 [0,0,0,1,0,0|2,0,0]=3 1797 B7R1.4 C[C@H]1CNC[C@@H]1O MCULE-3274154422 [0,0,0,1,0,0|2,0,0]=3 1798 B7R1.4 C[C@H]1CNC[C@@H]1O MCULE-3608199633 [0,0,0,1,0,0|2,0,0]=3 1799 B7R1.4 C[C@H]1CNC[C@H]1N MCULE-6069899229 [0,0,0,1,0,0|2,0,0]=3 1800 B7R1.4 C[C@H]1CNC[C@H]1N MCULE-8539137579 [0,0,0,1,0,0|2,0,0]=3 1801 B7R1.4 C[C@H]1CNC[C@H]1O MCULE-1988679936 [0,0,0,1,0,0|2,0,0]=3 1802 B7R1.4 C[C@H]1CNC[C@H]1O MCULE-3451477960 [0,0,0,1,0,0|2,0,0]=3 1803 B7R1.4 C[C@H]1CNC[C@H]1O MCULE-4396463600 [0,0,0,1,0,0|2,0,0]=3 1804 B7R1.4 C[C@H]1CNC[C@H]1O MCULE-7975653844 [0,0,0,1,0,0|2,0,0]=3 1805 B7R1.4 C[C@H]1COC[C@@H]1O MCULE-3765921602 [0,0,0,1,0,0|1,0,0]=2 1806 B7R1.4 C[C@H]1COC[C@@H]1O MCULE-5201903195 [0,0,0,1,0,0|1,0,0]=2 1807 B7R1.4 C[C@H]1COC[C@H]1O MCULE-2974083166 [0,0,0,1,0,0|1,0,0]=2 1808 B7R1.4 C[C@H]1COC[C@H]1O MCULE-6725207001 [0,0,0,1,0,0|1,0,0]=2 1809 B7R1.4 C[C@H]1NCC[C@@H]1O MCULE-5499798144 [0,0,0,1,0,0|3,0,0]=4 1810 B7R1.4 C[C@H]1NCC[C@@H]1O MCULE-7401004387 [0,0,0,1,0,0|3,0,0]=4 1811 B7R1.4 C[C@H]1NCC[C@H]1O MCULE-7469942077 [0,0,0,1,0,0|3,0,0]=4 1812 B7R1.4 C[C@H]1NCC[C@H]1O MCULE-9976903585 [0,0,0,1,0,0|3,0,0]=4 1813 B7R1.4 C[C@H]1OCC[C@H]1N MCULE-1432785321 [0,0,0,1,0,0|1,0,0]=2 1814 B7R1.4 C[C@H]1OCC[C@H]1N MCULE-3008045787 [0,0,0,1,0,0|1,0,0]=2 1815 B7R1.4 C[C@H]1OCC[C@H]1N MCULE-7656776924 [0,0,0,1,0,0|1,0,0]=2 1816 B7R1.4 C[C@H]1OCC[C@H]1N MCULE-8087379612 [0,0,0,1,0,0|1,0,0]=2 1817 B7R1.4 ClC1CCCC1Cl MCULE-1176916477 [0,0,0,1,0,0|3,0,0]=4 1818 B7R1.4 ClC1CCOC1Cl MCULE-1186010832 [0,0,0,1,0,0|3,0,0]=4 1819 B7R1.4 FC1CNCC1F MCULE-2795759224 [0,0,0,1,0,0|3,0,0]=4 1820 B7R1.4 FC1CNCC1F MCULE-4642260114 [0,0,0,1,0,0|3,0,0]=4 1821 B7R1.4 F[C@@H]1CNC[C@H]1F MCULE-1572445063 [0,0,0,1,0,0|3,0,0]=4 1822 B7R1.4 F[C@@H]1CNC[C@H]1F MCULE-4177562777 [0,0,0,1,0,0|3,0,0]=4 1823 B7R1.4 F[C@@H]1CNC[C@H]1F MCULE-4519639793 [0,0,0,1,0,0|3,0,0]=4 1824 B7R1.4 F[C@@H]1CNC[C@H]1F MCULE-5389552975 [0,0,0,1,0,0|3,0,0]=4 1825 B7R1.4 F[C@@H]1CNC[C@H]1F MCULE-6385794790 [0,0,0,1,0,0|3,0,0]=4 1826 B7R1.4 F[C@@H]1CNC[C@H]1F MCULE-7723721112 [0,0,0,1,0,0|3,0,0]=4 1827 B7R1.4 F[C@H]1CNC[C@@H]1F MCULE-1910510712 [0,0,0,1,0,0|3,0,0]=4 1828 B7R1.4 F[C@H]1CNC[C@@H]1F MCULE-1939514822 [0,0,0,1,0,0|3,0,0]=4 1829 B7R1.4 F[C@H]1CNC[C@@H]1F MCULE-7688312295 [0,0,0,1,0,0|3,0,0]=4 1830 B7R1.4 F[C@H]1CNC[C@@H]1F MCULE-9195313321 [0,0,0,1,0,0|3,0,0]=4 1831 B7R1.4 F[C@H]1CNC[C@H]1F MCULE-1191772323 [0,0,0,1,0,0|3,0,0]=4 1832 B7R1.4 F[C@H]1CNC[C@H]1F MCULE-1441165331 [0,0,0,1,0,0|3,0,0]=4 1833 B7R1.4 F[C@H]1CNC[C@H]1F MCULE-2941635831 [0,0,0,1,0,0|3,0,0]=4 1834 B7R1.4 NC1CCCC1=O MCULE-3654949473 [0,0,0,1,0,0|1,0,2]=4 1835 B7R1.4 NC1CCCC1=O MCULE-6579965788 [0,0,0,1,0,0|1,0,2]=4 1836 B7R1.4 NC1CCCC1F MCULE-2221939717 [0,0,0,1,0,0|2,0,0]=3 1837 B7R1.4 NC1CCCC1F MCULE-7473190715 [0,0,0,1,0,0|2,0,0]=3 1838 B7R1.4 NC1CCCC1N MCULE-5161769230 [0,0,0,1,0,0|2,0,0]=3 1839 B7R1.4 NC1CCCC1N MCULE-7834445190 [0,0,0,1,0,0|2,0,0]=3 1840 B7R1.4 NC1CCCC1O MCULE-1657591641 [0,0,0,1,0,0|1,0,0]=2 1841 B7R1.4 NC1CCCC1O MCULE-6248992494 [0,0,0,1,0,0|1,0,0]=2 1842 B7R1.4 NC1CCOC1=O MCULE-1011670330 [0,0,0,1,0,0|2,0,1]=4 1843 B7R1.4 NC1CCOC1=O MCULE-1366805966 [0,0,0,1,0,0|2,0,1]=4 1844 B7R1.4 NC1CCOC1=O MCULE-1874490478 [0,0,0,1,0,0|2,0,1]=4 1845 B7R1.4 NC1CCOC1=O MCULE-4434379753 [0,0,0,1,0,0|2,0,1]=4 1846 B7R1.4 NC1CCOC1=O MCULE-7302633352 [0,0,0,1,0,0|2,0,1]=4 1847 B7R1.4 NC1CCOC1=O MCULE-8009953591 [0,0,0,1,0,0|2,0,1]=4 1848 B7R1.4 NC1CNCC1F MCULE-1177091135 [0,0,0,1,0,0|2,0,0]=3 1849 B7R1.4 NC1CNCC1F MCULE-8259596061 [0,0,0,1,0,0|2,0,0]=3 1850 B7R1.4 NC1COCC1Br MCULE-5821692966 [0,0,0,1,0,0|1,0,0]=2 1851 B7R1.4 NC1COCC1F MCULE-5032224318 [0,0,0,1,0,0|1,0,0]=2 1852 B7R1.4 NC1COCC1F MCULE-8302920845 [0,0,0,1,0,0|1,0,0]=2 1853 B7R1.4 NC1COCC1N MCULE-1202195361 [0,0,0,1,0,0|1,0,0]=2 1854 B7R1.4 NC1COCC1N MCULE-4117465167 [0,0,0,1,0,0|1,0,0]=2 1855 B7R1.4 NC1COCC1O MCULE-3115911209 [0,0,0,1,0,0|0,0,0]=1 1856 B7R1.4 NC1COCC1O MCULE-9837103399 [0,0,0,1,0,0|0,0,0]=1 1857 B7R1.4 NC1CONC1=O MCULE-3118867985 [0,0,0,1,0,0|1,0,2]=4 1858 B7R1.4 NC1CONC1=O MCULE-3159218372 [0,0,0,1,0,0|1,0,2]=4 1859 B7R1.4 NC1CSCC1O MCULE-4474934833 [0,0,0,1,0,0|0,1,0]=2 1860 B7R1.4 NC1CSCC1O MCULE-5059305463 [0,0,0,1,0,0|0,1,0]=2 1861 B7R1.4 NC1CSCC1O MCULE-8633680588 [0,0,0,1,0,0|0,1,0]=2 1862 B7R1.4 N[C@@H]1CCC[C@@H]1F MCULE-5918995947 [0,0,0,1,0,0|2,0,0]=3 1863 B7R1.4 N[C@@H]1CCC[C@@H]1O MCULE-3619202671 [0,0,0,1,0,0|1,0,0]=2 1864 B7R1.4 N[C@@H]1CCC[C@@H]1O MCULE-5588562063 [0,0,0,1,0,0|1,0,0]=2 1865 B7R1.4 N[C@@H]1CCC[C@@H]1O MCULE-8937650915 [0,0,0,1,0,0|1,0,0]=2 1866 B7R1.4 N[C@@H]1CCC[C@@H]1O MCULE-9550479411 [0,0,0,1,0,0|1,0,0]=2 1867 B7R1.4 N[C@@H]1CCC[C@@H]1O MCULE-9908988904 [0,0,0,1,0,0|1,0,0]=2 1868 B7R1.4 N[C@@H]1CCC[C@H]1F MCULE-1389039924 [0,0,0,1,0,0|2,0,0]=3 1869 B7R1.4 N[C@@H]1CCC[C@H]1F MCULE-2197861570 [0,0,0,1,0,0|2,0,0]=3 1870 B7R1.4 N[C@@H]1CCC[C@H]1F MCULE-3318849776 [0,0,0,1,0,0|2,0,0]=3 1871 B7R1.4 N[C@@H]1CCC[C@H]1F MCULE-5395257521 [0,0,0,1,0,0|2,0,0]=3 1872 B7R1.4 N[C@@H]1CCC[C@H]1F MCULE-8318262942 [0,0,0,1,0,0|2,0,0]=3 1873 B7R1.4 N[C@@H]1CCC[C@H]1F MCULE-9877401480 [0,0,0,1,0,0|2,0,0]=3 1874 B7R1.4 N[C@@H]1CCC[C@H]1N MCULE-1630250066 [0,0,0,1,0,0|2,0,0]=3 1875 B7R1.4 N[C@@H]1CCC[C@H]1N MCULE-5738867214 [0,0,0,1,0,0|2,0,0]=3 1876 B7R1.4 N[C@@H]1CCC[C@H]1N MCULE-5794367720 [0,0,0,1,0,0|2,0,0]=3 1877 B7R1.4 N[C@@H]1CCC[C@H]1N MCULE-6079002018 [0,0,0,1,0,0|2,0,0]=3 1878 B7R1.4 N[C@@H]1CCC[C@H]1N MCULE-7332231839 [0,0,0,1,0,0|2,0,0]=3 1879 B7R1.4 N[C@@H]1CCC[C@H]1N MCULE-7604406385 [0,0,0,1,0,0|2,0,0]=3 1880 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-2283352070 [0,0,0,1,0,0|1,0,0]=2 1881 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-3279782742 [0,0,0,1,0,0|1,0,0]=2 1882 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-6823698796 [0,0,0,1,0,0|1,0,0]=2 1883 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-7752087047 [0,0,0,1,0,0|1,0,0]=2 1884 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-8823714511 [0,0,0,1,0,0|1,0,0]=2 1885 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-9789739251 [0,0,0,1,0,0|1,0,0]=2 1886 B7R1.4 N[C@@H]1CCOC1=O MCULE-1027751896 [0,0,0,1,0,0|2,0,1]=4 1887 B7R1.4 N[C@@H]1CCOC1=O MCULE-4034349263 [0,0,0,1,0,0|2,0,1]=4 1888 B7R1.4 N[C@@H]1CCOC1=O MCULE-8790782772 [0,0,0,1,0,0|2,0,1]=4 1889 B7R1.4 N[C@@H]1CCOC1=O MCULE-9300265861 [0,0,0,1,0,0|2,0,1]=4 1890 B7R1.4 N[C@@H]1CNC[C@H]1F MCULE-1708344428 [0,0,0,1,0,0|2,0,0]=3 1891 B7R1.4 N[C@@H]1CNC[C@H]1F MCULE-3614628548 [0,0,0,1,0,0|2,0,0]=3 1892 B7R1.4 N[C@@H]1CNC[C@H]1F MCULE-5868430910 [0,0,0,1,0,0|2,0,0]=3 1893 B7R1.4 N[C@@H]1CNC[C@H]1F MCULE-9283549047 [0,0,0,1,0,0|2,0,0]=3 1894 B7R1.4 N[C@@H]1COC[C@@H]1F MCULE-1582887664 [0,0,0,1,0,0|1,0,0]=2 1895 B7R1.4 N[C@@H]1COC[C@@H]1F MCULE-3978694929 [0,0,0,1,0,0|1,0,0]=2 1896 B7R1.4 N[C@@H]1COC[C@@H]1F MCULE-4503972605 [0,0,0,1,0,0|1,0,0]=2 1897 B7R1.4 N[C@@H]1COC[C@@H]1F MCULE-6640537480 [0,0,0,1,0,0|1,0,0]=2 1898 B7R1.4 N[C@@H]1COC[C@@H]1N MCULE-5625344145 [0,0,0,1,0,0|1,0,0]=2 1899 B7R1.4 N[C@@H]1COC[C@@H]1N MCULE-5743565778 [0,0,0,1,0,0|1,0,0]=2 1900 B7R1.4 N[C@@H]1COC[C@@H]1N MCULE-7916026303 [0,0,0,1,0,0|1,0,0]=2 1901 B7R1.4 N[C@@H]1COC[C@@H]1O MCULE-2891920420 [0,0,0,1,0,0|0,0,0]=1 1902 B7R1.4 N[C@@H]1COC[C@@H]1O MCULE-5764643856 [0,0,0,1,0,0|0,0,0]=1 1903 B7R1.4 N[C@@H]1COC[C@H]1F MCULE-3183837574 [0,0,0,1,0,0|1,0,0]=2 1904 B7R1.4 N[C@@H]1COC[C@H]1F MCULE-3329511858 [0,0,0,1,0,0|1,0,0]=2 1905 B7R1.4 N[C@@H]1COC[C@H]1N MCULE-3234416434 [0,0,0,1,0,0|1,0,0]=2 1906 B7R1.4 N[C@@H]1COC[C@H]1N MCULE-3421021007 [0,0,0,1,0,0|1,0,0]=2 1907 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-1399984261 [0,0,0,1,0,0|0,0,0]=1 1908 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-2321912677 [0,0,0,1,0,0|0,0,0]=1 1909 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-4422404071 [0,0,0,1,0,0|0,0,0]=1 1910 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-7801515292 [0,0,0,1,0,0|0,0,0]=1 1911 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-9112718041 [0,0,0,1,0,0|0,0,0]=1 1912 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-9447703783 [0,0,0,1,0,0|0,0,0]=1 1913 B7R1.4 N[C@@H]1CONC1=O MCULE-4212827696 [0,0,0,1,0,0|1,0,2]=4 1914 B7R1.4 N[C@@H]1CONC1=O MCULE-6014142329 [0,0,0,1,0,0|1,0,2]=4 1915 B7R1.4 N[C@@H]1CSC[C@@H]1O MCULE-4507133192 [0,0,0,1,0,0|0,1,0]=2 1916 B7R1.4 N[C@@H]1CSC[C@@H]1O MCULE-9327920188 [0,0,0,1,0,0|0,1,0]=2 1917 B7R1.4 N[C@@H]1CSC[C@H]1O MCULE-5323319055 [0,0,0,1,0,0|0,1,0]=2 1918 B7R1.4 N[C@@H]1CSC[C@H]1O MCULE-8008053411 [0,0,0,1,0,0|0,1,0]=2 1919 B7R1.4 N[C@H]1CCC[C@@H]1O MCULE-6629056296 [0,0,0,1,0,0|1,0,0]=2 1920 B7R1.4 N[C@H]1CCC[C@@H]1O MCULE-7682114350 [0,0,0,1,0,0|1,0,0]=2 1921 B7R1.4 N[C@H]1CCC[C@@H]1O MCULE-8554796061 [0,0,0,1,0,0|1,0,0]=2 1922 B7R1.4 N[C@H]1CCC[C@@H]1O MCULE-9329258920 [0,0,0,1,0,0|1,0,0]=2 1923 B7R1.4 N[C@H]1CCC[C@H]1N MCULE-1361897949 [0,0,0,1,0,0|2,0,0]=3 1924 B7R1.4 N[C@H]1CCC[C@H]1N MCULE-4545374374 [0,0,0,1,0,0|2,0,0]=3 1925 B7R1.4 N[C@H]1CCC[C@H]1O MCULE-1156997833 [0,0,0,1,0,0|1,0,0]=2 1926 B7R1.4 N[C@H]1CCC[C@H]1O MCULE-2524879699 [0,0,0,1,0,0|1,0,0]=2 1927 B7R1.4 N[C@H]1CCC[C@H]1O MCULE-7034968971 [0,0,0,1,0,0|1,0,0]=2 1928 B7R1.4 N[C@H]1CCC[C@H]1O MCULE-9262461574 [0,0,0,1,0,0|1,0,0]=2 1929 B7R1.4 N[C@H]1CCC[C@H]1O MCULE-9904485750 [0,0,0,1,0,0|1,0,0]=2 1930 B7R1.4 N[C@H]1CCOC1=O MCULE-4393293388 [0,0,0,1,0,0|2,0,1]=4 1931 B7R1.4 N[C@H]1CCOC1=O MCULE-4751602783 [0,0,0,1,0,0|2,0,1]=4 1932 B7R1.4 N[C@H]1CCOC1=O MCULE-7924572479 [0,0,0,1,0,0|2,0,1]=4 1933 B7R1.4 N[C@H]1CCOC1=O MCULE-8545644747 [0,0,0,1,0,0|2,0,1]=4 1934 B7R1.4 N[C@H]1CCOC1=O MCULE-8634641228 [0,0,0,1,0,0|2,0,1]=4 1935 B7R1.4 N[C@H]1COC[C@@H]1F MCULE-1031359839 [0,0,0,1,0,0|1,0,0]=2 1936 B7R1.4 N[C@H]1COC[C@@H]1F MCULE-6239060869 [0,0,0,1,0,0|1,0,0]=2 1937 B7R1.4 N[C@H]1COC[C@@H]1N MCULE-4495433095 [0,0,0,1,0,0|1,0,0]=2 1938 B7R1.4 N[C@H]1COC[C@@H]1N MCULE-6217406845 [0,0,0,1,0,0|1,0,0]=2 1939 B7R1.4 N[C@H]1COC[C@@H]1N MCULE-9762071646 [0,0,0,1,0,0|1,0,0]=2 1940 B7R1.4 N[C@H]1COC[C@@H]1O MCULE-1604156911 [0,0,0,1,0,0|0,0,0]=1 1941 B7R1.4 N[C@H]1COC[C@@H]1O MCULE-3157811195 [0,0,0,1,0,0|0,0,0]=1 1942 B7R1.4 N[C@H]1COC[C@@H]1O MCULE-4377495223 [0,0,0,1,0,0|0,0,0]=1 1943 B7R1.4 N[C@H]1COC[C@@H]1O MCULE-8412403655 [0,0,0,1,0,0|0,0,0]=1 1944 B7R1.4 N[C@H]1COC[C@H]1F MCULE-7980939593 [0,0,0,1,0,0|1,0,0]=2 1945 B7R1.4 N[C@H]1COC[C@H]1F MCULE-8990550970 [0,0,0,1,0,0|1,0,0]=2 1946 B7R1.4 N[C@H]1COC[C@H]1O MCULE-5907972681 [0,0,0,1,0,0|0,0,0]=1 1947 B7R1.4 N[C@H]1COC[C@H]1O MCULE-7502895716 [0,0,0,1,0,0|0,0,0]=1 1948 B7R1.4 N[C@H]1COC[C@H]1O MCULE-8985833831 [0,0,0,1,0,0|0,0,0]=1 1949 B7R1.4 N[C@H]1COC[C@H]1O MCULE-9971794275 [0,0,0,1,0,0|0,0,0]=1 1950 B7R1.4 N[C@H]1CONC1=O MCULE-4286940154 [0,0,0,1,0,0|1,0,2]=4 1951 B7R1.4 N[C@H]1CONC1=O MCULE-9925977120 [0,0,0,1,0,0|1,0,2]=4 1952 B7R1.4 O=C1CCCC1O MCULE-6795188798 [0,0,0,1,0,0|2,0,1]=4 1953 B7R1.4 OC1CCCC1Br MCULE-9027030471 [0,0,0,1,0,0|2,0,0]=3 1954 B7R1.4 OC1CCCC1Cl MCULE-5561130140 [0,0,0,1,0,0|2,0,0]=3 1955 B7R1.4 OC1CCCC1F MCULE-9111039481 [0,0,0,1,0,0|2,0,0]=3 1956 B7R1.4 OC1CCCC1O MCULE-2003945768 [0,0,0,1,0,0|2,0,0]=3 1957 B7R1.4 OC1CNCC1Br MCULE-1241091506 [0,0,0,1,0,0|2,0,0]=3 1958 B7R1.4 OC1CNCC1Br MCULE-4889737174 [0,0,0,1,0,0|2,0,0]=3 1959 B7R1.4 OC1CNCC1F MCULE-3412240528 [0,0,0,1,0,0|2,0,0]=3 1960 B7R1.4 OC1CNCC1F MCULE-7214807363 [0,0,0,1,0,0|2,0,0]=3 1961 B7R1.4 OC1CNCC1O MCULE-4416566731 [0,0,0,1,0,0|2,0,0]=3 1962 B7R1.4 OC1CNCC1O MCULE-7287658845 [0,0,0,1,0,0|2,0,0]=3 1963 B7R1.4 OC1COCC1Br MCULE-8642236751 [0,0,0,1,0,0|1,0,0]=2 1964 B7R1.4 OC1COCC1F MCULE-3255803142 [0,0,0,1,0,0|1,0,0]=2 1965 B7R1.4 OC1COCC1O MCULE-2982401803 [0,0,0,1,0,0|1,0,0]=2 1966 B7R1.4 O[C@@H]1CCC[C@H]1Cl MCULE-5851051143 [0,0,0,1,0,0|2,0,0]=3 1967 B7R1.4 O[C@@H]1CCC[C@H]1Cl MCULE-6816188915 [0,0,0,1,0,0|2,0,0]=3 1968 B7R1.4 O[C@@H]1CCC[C@H]1F MCULE-6825738824 [0,0,0,1,0,0|2,0,0]=3 1969 B7R1.4 O[C@@H]1CCC[C@H]1O MCULE-3171045763 [0,0,0,1,0,0|2,0,0]=3 1970 B7R1.4 O[C@@H]1CCC[C@H]1O MCULE-4369287998 [0,0,0,1,0,0|2,0,0]=3 1971 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-4544085940 [0,0,0,1,0,0|2,0,0]=3 1972 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-6356393045 [0,0,0,1,0,0|2,0,0]=3 1973 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-7332143154 [0,0,0,1,0,0|2,0,0]=3 1974 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-8032995983 [0,0,0,1,0,0|2,0,0]=3 1975 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-8052505932 [0,0,0,1,0,0|2,0,0]=3 1976 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-8564653401 [0,0,0,1,0,0|2,0,0]=3 1977 B7R1.4 O[C@@H]1CNC[C@H]1F MCULE-2691246784 [0,0,0,1,0,0|2,0,0]=3 1978 B7R1.4 O[C@@H]1CNC[C@H]1F MCULE-7250968554 [0,0,0,1,0,0|2,0,0]=3 1979 B7R1.4 O[C@@H]1CNC[C@H]1F MCULE-8439784112 [0,0,0,1,0,0|2,0,0]=3 1980 B7R1.4 O[C@@H]1CNC[C@H]1F MCULE-8682802807 [0,0,0,1,0,0|2,0,0]=3 1981 B7R1.4 O[C@@H]1CNC[C@H]1O MCULE-2199886254 [0,0,0,1,0,0|2,0,0]=3 1982 B7R1.4 O[C@@H]1CNC[C@H]1O MCULE-3341203076 [0,0,0,1,0,0|2,0,0]=3 1983 B7R1.4 O[C@@H]1CNC[C@H]1O MCULE-5521619072 [0,0,0,1,0,0|2,0,0]=3 1984 B7R1.4 O[C@@H]1COC[C@H]1F MCULE-2460253154 [0,0,0,1,0,0|1,0,0]=2 1985 B7R1.4 O[C@@H]1COC[C@H]1F MCULE-3624406213 [0,0,0,1,0,0|1,0,0]=2 1986 B7R1.4 O[C@@H]1COC[C@H]1O MCULE-5846282762 [0,0,0,1,0,0|1,0,0]=2 1987 B7R1.4 O[C@H]1CCC[C@@H]1F MCULE-5487297072 [0,0,0,1,0,0|2,0,0]=3 1988 B7R1.4 O[C@H]1CCC[C@@H]1O MCULE-4051443060 [0,0,0,1,0,0|2,0,0]=3 1989 B7R1.4 O[C@H]1CCC[C@@H]1O MCULE-4644231649 [0,0,0,1,0,0|2,0,0]=3 1990 B7R1.4 O[C@H]1CCC[C@@H]1O MCULE-6847877597 [0,0,0,1,0,0|2,0,0]=3 1991 B7R1.4 O[C@H]1CCC[C@H]1Br MCULE-2758354858 [0,0,0,1,0,0|2,0,0]=3 1992 B7R1.4 O[C@H]1CCC[C@H]1Cl MCULE-6157730443 [0,0,0,1,0,0|2,0,0]=3 1993 B7R1.4 O[C@H]1CCC[C@H]1Cl MCULE-8785327416 [0,0,0,1,0,0|2,0,0]=3 1994 B7R1.4 O[C@H]1CCC[C@H]1O MCULE-7305350842 [0,0,0,1,0,0|2,0,0]=3 1995 B7R1.4 O[C@H]1CNC[C@@H]1F MCULE-3839318633 [0,0,0,1,0,0|2,0,0]=3 1996 B7R1.4 O[C@H]1CNC[C@@H]1F MCULE-4218821429 [0,0,0,1,0,0|2,0,0]=3 1997 B7R1.4 O[C@H]1CNC[C@@H]1F MCULE-7845583982 [0,0,0,1,0,0|2,0,0]=3 1998 B7R1.4 O[C@H]1CNC[C@@H]1F MCULE-9325791348 [0,0,0,1,0,0|2,0,0]=3 1999 B7R1.4 O[C@H]1CNC[C@@H]1O MCULE-5585016580 [0,0,0,1,0,0|2,0,0]=3 2000 B7R1.4 O[C@H]1CNC[C@@H]1O MCULE-6252837981 [0,0,0,1,0,0|2,0,0]=3 2001 B7R1.4 O[C@H]1CNC[C@@H]1O MCULE-7474807017 [0,0,0,1,0,0|2,0,0]=3 2002 B7R1.4 O[C@H]1CNC[C@@H]1O MCULE-8814174366 [0,0,0,1,0,0|2,0,0]=3 2003 B7R1.4 O[C@H]1CNC[C@@H]1O MCULE-9936814184 [0,0,0,1,0,0|2,0,0]=3 2004 B7R1.4 O[C@H]1CNC[C@H]1F MCULE-2104048645 [0,0,0,1,0,0|2,0,0]=3 2005 B7R1.4 O[C@H]1CNC[C@H]1F MCULE-5086480017 [0,0,0,1,0,0|2,0,0]=3 2006 B7R1.4 O[C@H]1CNC[C@H]1F MCULE-5328004683 [0,0,0,1,0,0|2,0,0]=3 2007 B7R1.4 O[C@H]1CNC[C@H]1F MCULE-5990996560 [0,0,0,1,0,0|2,0,0]=3 2008 B7R1.4 O[C@H]1CNC[C@H]1O MCULE-8087937166 [0,0,0,1,0,0|2,0,0]=3 2009 B7R1.4 O[C@H]1CNC[C@H]1O MCULE-9522092804 [0,0,0,1,0,0|2,0,0]=3 2010 B7R1.4 O[C@H]1COC[C@@H]1F MCULE-7724910066 [0,0,0,1,0,0|1,0,0]=2 2011 B7R1.4 O[C@H]1COC[C@@H]1O MCULE-2140544466 [0,0,0,1,0,0|1,0,0]=2 2012 B7R1.4 O[C@H]1COC[C@@H]1O MCULE-9526811966 [0,0,0,1,0,0|1,0,0]=2 2013 B7R1.4 O[C@H]1COC[C@H]1O MCULE-2862505352 [0,0,0,1,0,0|1,0,0]=2 2014 B7R1.4 [C@@H]1(CCC[C@H]1N)C MCULE-2430440513 [0,0,0,1,0,0|2,0,0]=3 2015 B7R1.4 [C@@H]1(CCC[C@H]1N)C MCULE-8503171996 [0,0,0,1,0,0|2,0,0]=3 2016 B7R1.4 [C@@H]1(CCC[C@H]1N)F MCULE-5545998720 [0,0,0,1,0,0|2,0,0]=3 2017 B7R1.4 [C@@H]1(CNC[C@@H]1O)O MCULE-2661544949 [0,0,0,1,0,0|2,0,0]=3 2018 B7R1.4 [C@@H]1(COC[C@@H]1F)N MCULE-3635591654 [0,0,0,1,0,0|1,0,0]=2 2019 B7R1.4 [C@@H]1(COC[C@@H]1F)N MCULE-5914925477 [0,0,0,1,0,0|1,0,0]=2 2020 B7R1.4 [C@@H]1(COC[C@@H]1N)N MCULE-4324328112 [0,0,0,1,0,0|1,0,0]=2 2021 B7R1.4 [C@H]1(CNC[C@H]1F)O MCULE-1484680203 [0,0,0,1,0,0|2,0,0]=3 2022 B7R1.4 [C@H]1(CNC[C@H]1F)O MCULE-7754900549 [0,0,0,1,0,0|2,0,0]=3 2023 B7R1.4 [C@H]1(COC[C@H]1N)C MCULE-5920046767 [0,0,0,1,0,0|1,0,0]=2 2024 B7R1.4 [C@H]1(COC[C@H]1N)C MCULE-6282053067 [0,0,0,1,0,0|1,0,0]=2 2025 B7R1.4 [C@H]1(COC[C@H]1N)C MCULE-8432332245 [0,0,0,1,0,0|1,0,0]=2 2026 B7R1.4 [NH3+][C@@H]1CSC[C@@H]1O MCULE-5747970201 [0,0,0,1,0,0|0,1,1]=3 2027 B7R1.4 [NH3+][C@@H]1CSC[C@H]1O MCULE-4897701746 [0,0,0,1,0,0|0,1,1]=3 2028 B7R1.8 CC1CCC1CO MCULE-4677269341 [0,0,0,1,0,0|2,0,0]=3 2029 B7R1.8 CN1CCC1CO MCULE-3475629266 [0,0,0,1,0,0|3,0,0]=4 2030 B7R1.8 CN1CC[C@@H]1CO MCULE-2590783241 [0,0,0,1,0,0|3,0,0]=4 2031 B7R1.8 CN1CC[C@@H]1CO MCULE-9683847113 [0,0,0,1,0,0|3,0,0]=4 2032 B7R1.8 CN1CC[C@H]1CO MCULE-6507300625 [0,0,0,1,0,0|3,0,0]=4 2033 B7R1.8 CN1CC[C@H]1CO MCULE-9641004134 [0,0,0,1,0,0|3,0,0]=4 2034 B7R1.8 CN[C@H]1CC[C@@H]1O MCULE-4638367588 [0,0,0,1,0,0|3,0,0]=4 2035 B7R1.8 NCC1CCC1F MCULE-6621673772 [0,0,0,1,0,0|3,0,0]=4 2036 B7R1.8 NCC1CCC1F MCULE-8982565541 [0,0,0,1,0,0|3,0,0]=4 2037 B7R1.8 O=C1CCC1CO MCULE-5501600764 [0,0,0,1,0,0|1,0,2]=4 2038 B7R1.8 O=C1CC[C@@H]1CO MCULE-9840363539 [0,0,0,1,0,0|1,0,2]=4 2039 B7R1.8 OCC1CCC1F MCULE-2481035584 [0,0,0,1,0,0|2,0,0]=3 2040 B7R1.8 OCC1CCC1O MCULE-9764745395 [0,0,0,1,0,0|1,0,0]=2 2041 B7R1.8 OC[C@@H]1CC[C@H]1O MCULE-5043281368 [0,0,0,1,0,0|1,0,0]=2 2042 B7R1.8 OC[C@H]1CC[C@H]1O MCULE-1536326248 [0,0,0,1,0,0|1,0,0]=2 2043 B7R1.12 CC(C)[C@@H]1C[C@H]1N MCULE-1713655941 [0,0,0,1,0,0|3,0,0]=4 2044 B7R1.12 CC(C)[C@@H]1C[C@H]1N MCULE-5926317826 [0,0,0,1,0,0|3,0,0]=4 2045 B7R1.15 C[C@@H]1NC(=O)[C@H]1N MCULE-2032555036 [0,0,0,1,0,0|1,0,2]=4 2046 B7R1.15 C[C@@H]1NC(=O)[C@H]1N MCULE-2738127555 [0,0,0,1,0,0|1,0,2]=4 2047 B7R1.15 C[C@@H]1NC(=O)[C@H]1N MCULE-5044901082 [0,0,0,1,0,0|1,0,2]=4 2048 B7R1.15 C[C@@H]1NC(=O)[C@H]1N MCULE-7632990759 [0,0,0,1,0,0|1,0,2]=4 2049 B7R1.17 CC1(CCC1Br)C MCULE-2707590334 [0,0,0,1,0,0|3,0,0]=4 2050 B7R1.17 CC1(CCC1N)C MCULE-3143969489 [0,0,0,1,0,0|2,0,0]=3 2051 B7R1.17 CC1(CCC1N)C MCULE-7719131610 [0,0,0,1,0,0|2,0,0]=3 2052 B7R1.17 CC1(CCC1O)C MCULE-7385359414 [0,0,0,1,0,0|3,0,0]=4 2053 B7R1.17 CC1(CC[C@@H]1O)C MCULE-9766955692 [0,0,0,1,0,0|3,0,0]=4 2054 B7R1.17 CC1(NCC1O)C MCULE-5840741801 [0,0,0,1,0,0|3,0,0]=4 2055 B7R1.17 CC1(NCC1O)C MCULE-7044413523 [0,0,0,1,0,0|3,0,0]=4 2056 B7R1.17 CC1(OCC1=O)C MCULE-5758313494 [0,0,0,1,0,0|2,0,1]=4 2057 B7R1.17 CC1(OCC1N)C MCULE-2792085100 [0,0,0,1,0,0|1,0,0]=2 2058 B7R1.17 CC1(OCC1O)C MCULE-4679216060 [0,0,0,1,0,0|2,0,0]=3 2059 B7R1.17 CC1(OC[C@@H]1N)C MCULE-1806722832 [0,0,0,1,0,0|1,0,0]=2 2060 B7R1.17 CC1(SCC1N)C MCULE-2967285527 [0,0,0,1,0,0|1,1,0]=3 2061 B7R1.17 CC1(SCC1N)C MCULE-3093982180 [0,0,0,1,0,0|1,1,0]=3 2062 B7R1.17 NC1CCC1(F)F MCULE-4486749666 [0,0,0,1,0,0|3,0,0]=4 2063 B7R1.17 NC1CCC1(F)F MCULE-4755825201 [0,0,0,1,0,0|3,0,0]=4 2064 B7R1.17 N[C@@H]1CCC1(F)F MCULE-1150459129 [0,0,0,1,0,0|3,0,0]=4 2065 B7R1.17 N[C@@H]1CCC1(F)F MCULE-4191148082 [0,0,0,1,0,0|3,0,0]=4 2066 B7R1.17 N[C@H]1CCC1(F)F MCULE-7199799736 [0,0,0,1,0,0|3,0,0]=4 2067 B7R1.18 C1(CCN1)C(=O)O MCULE-9324355017 [0,0,0,1,0,0|2,0,1]=4 2068 B7R1.18 CC(=O)C1COC1 MCULE-3416774210 [0,0,0,1,0,0|1,0,2]=4 2069 B7R1.18 CC(C)C1CNC1 MCULE-4830353053 [0,0,0,1,0,0|3,0,0]=4 2070 B7R1.18 CC(C)C1CNC1 MCULE-7304386148 [0,0,0,1,0,0|3,0,0]=4 2071 B7R1.18 CC(N)C1CCC1 MCULE-1055775237 [0,0,0,1,0,0|3,0,0]=4 2072 B7R1.18 CC(N)C1CCC1 MCULE-4303681430 [0,0,0,1,0,0|3,0,0]=4 2073 B7R1.18 CC(N)C1COC1 MCULE-1380624257 [0,0,0,1,0,0|2,0,0]=3 2074 B7R1.18 CC(N)C1CSC1 MCULE-5095506053 [0,0,0,1,0,0|2,1,0]=4 2075 B7R1.18 CC(O)C1CCC1 MCULE-7846963519 [0,0,0,1,0,0|2,0,0]=3 2076 B7R1.18 CC(O)C1CNC1 MCULE-1265886795 [0,0,0,1,0,0|2,0,0]=3 2077 B7R1.18 CC(O)C1CNC1 MCULE-5108259269 [0,0,0,1,0,0|2,0,0]=3 2078 B7R1.18 CC(O)C1CNC1 MCULE-8265279011 [0,0,0,1,0,0|2,0,0]=3 2079 B7R1.18 CC(O)C1COC1 MCULE-4981198639 [0,0,0,1,0,0|1,0,0]=2 2080 B7R1.18 C[C@@H](N)C1CCC1 MCULE-4670161237 [0,0,0,1,0,0|3,0,0]=4 2081 B7R1.18 C[C@@H](N)C1CCC1 MCULE-6520272933 [0,0,0,1,0,0|3,0,0]=4 2082 B7R1.18 C[C@@H](N)C1CCC1 MCULE-8342688572 [0,0,0,1,0,0|3,0,0]=4 2083 B7R1.18 C[C@@H](N)C1CCC1 MCULE-9076983662 [0,0,0,1,0,0|3,0,0]=4 2084 B7R1.18 C[C@@H](N)C1COC1 MCULE-7669553866 [0,0,0,1,0,0|2,0,0]=3 2085 B7R1.18 C[C@@H](O)C1CCC1 MCULE-6990873960 [0,0,0,1,0,0|2,0,0]=3 2086 B7R1.18 C[C@@H](O)C1COC1 MCULE-5223611242 [0,0,0,1,0,0|1,0,0]=2 2087 B7R1.18 C[C@@H](O)C1COC1 MCULE-5819578881 [0,0,0,1,0,0|1,0,0]=2 2088 B7R1.18 C[C@H](N)C1CCC1 MCULE-2555280675 [0,0,0,1,0,0|3,0,0]=4 2089 B7R1.18 C[C@H](N)C1CCC1 MCULE-3888125434 [0,0,0,1,0,0|3,0,0]=4 2090 B7R1.18 C[C@H](N)C1CCC1 MCULE-6963105805 [0,0,0,1,0,0|3,0,0]=4 2091 B7R1.18 C[C@H](N)C1CCC1 MCULE-7483270694 [0,0,0,1,0,0|3,0,0]=4 2092 B7R1.18 C[C@H](N)C1COC1 MCULE-8337949293 [0,0,0,1,0,0|2,0,0]=3 2093 B7R1.18 C[C@H](O)C1CCC1 MCULE-5072123772 [0,0,0,1,0,0|2,0,0]=3 2094 B7R1.18 C[C@H](O)C1CCC1 MCULE-6701623925 [0,0,0,1,0,0|2,0,0]=3 2095 B7R1.18 C[C@H](O)C1CNC1 MCULE-4694154501 [0,0,0,1,0,0|2,0,0]=3 2096 B7R1.18 C[C@H](O)C1CNC1 MCULE-5870270724 [0,0,0,1,0,0|2,0,0]=3 2097 B7R1.18 C[C@H](O)C1COC1 MCULE-1396791034 [0,0,0,1,0,0|1,0,0]=2 2098 B7R1.18 C[C@H](O)C1COC1 MCULE-8805369596 [0,0,0,1,0,0|1,0,0]=2 2099 B7R1.18 FC(F)C1CCN1 MCULE-3910207881 [0,0,0,1,0,0|3,0,0]=4 2100 B7R1.18 FC(F)C1CCN1 MCULE-5707260715 [0,0,0,1,0,0|3,0,0]=4 2101 B7R1.18 FC(F)[C@@H]1CCN1 MCULE-1910962420 [0,0,0,1,0,0|3,0,0]=4 2102 B7R1.18 FC(F)[C@@H]1CCN1 MCULE-6835685852 [0,0,0,1,0,0|3,0,0]=4 2103 B7R1.18 FC(F)[C@H]1CCN1 MCULE-1770896469 [0,0,0,1,0,0|3,0,0]=4 2104 B7R1.18 FC(F)[C@H]1CCN1 MCULE-5057191247 [0,0,0,1,0,0|3,0,0]=4 2105 B7R1.18 FC(F)[C@H]1CCN1 MCULE-7880065029 [0,0,0,1,0,0|3,0,0]=4 2106 B7R1.18 FC(F)[C@H]1CCN1 MCULE-8422110066 [0,0,0,1,0,0|3,0,0]=4 2107 B7R1.18 O=C(O)C1CCN1 MCULE-1336085891 [0,0,0,1,0,0|2,0,1]=4 2108 B7R1.18 O=C(O)C1CCN1 MCULE-6501890131 [0,0,0,1,0,0|2,0,1]=4 2109 B7R1.18 O=C(O)C1CCN1 MCULE-7647115314 [0,0,0,1,0,0|2,0,1]=4 2110 B7R1.18 O=C(O)C1COC1 MCULE-2530431165 [0,0,0,1,0,0|2,0,1]=4 2111 B7R1.18 O=C(O)[C@@H]1CCN1 MCULE-2126306157 [0,0,0,1,0,0|2,0,1]=4 2112 B7R1.18 O=C(O)[C@@H]1CCN1 MCULE-2597576629 [0,0,0,1,0,0|2,0,1]=4 2113 B7R1.18 O=C(O)[C@@H]1CCN1 MCULE-6006656004 [0,0,0,1,0,0|2,0,1]=4 2114 B7R1.18 O=C(O)[C@@H]1CCN1 MCULE-7241612713 [0,0,0,1,0,0|2,0,1]=4 2115 B7R1.18 O=C(O)[C@H]1CCN1 MCULE-3254184046 [0,0,0,1,0,0|2,0,1]=4 2116 B7R1.18 O=C(O)[C@H]1CCN1 MCULE-5162570273 [0,0,0,1,0,0|2,0,1]=4 2117 B7R1.18 O=C(O)[C@H]1CCN1 MCULE-5488052558 [0,0,0,1,0,0|2,0,1]=4 2118 B7R1.18 O=C(O)[C@H]1CCN1 MCULE-8240936495 [0,0,0,1,0,0|2,0,1]=4 2119 B7R1.19 CC(=O)C1(CC1)N MCULE-2138315633 [0,0,0,1,0,0|1,0,2]=4 2120 B7R1.19 CC(=O)C1(CC1)N MCULE-4094057841 [0,0,0,1,0,0|1,0,2]=4 2121 B7R1.19 CC(=O)C1(CO1)C MCULE-3263824467 [0,0,0,1,0,0|1,0,2]=4 2122 B7R1.19 CC(C)C1(CC1)N MCULE-4070811283 [0,0,0,1,0,0|2,0,0]=3 2123 B7R1.19 CC(C)C1(CC1)N MCULE-8353733005 [0,0,0,1,0,0|2,0,0]=3 2124 B7R1.19 CC(C)C1(CC1)O MCULE-3516849541 [0,0,0,1,0,0|3,0,0]=4 2125 B7R1.19 CC(C)C1(CO1)C MCULE-6945955143 [0,0,0,1,0,0|2,0,0]=3 2126 B7R1.19 CC(N)C1(CC1)C MCULE-5748183771 [0,0,0,1,0,0|3,0,0]=4 2127 B7R1.19 CC(N)C1(CC1)C MCULE-5829560197 [0,0,0,1,0,0|3,0,0]=4 2128 B7R1.19 CC(N)C1(CC1)O MCULE-9318031577 [0,0,0,1,0,0|3,0,0]=4 2129 B7R1.19 CC(O)C1(CC1)C MCULE-6644959738 [0,0,0,1,0,0|2,0,0]=3 2130 B7R1.19 CC(O)C1(CC1)N MCULE-7865299177 [0,0,0,1,0,0|1,0,0]=2 2131 B7R1.19 CC1(CO1)C(=O)O MCULE-9344660544 [0,0,0,1,0,0|2,0,1]=4 2132 B7R1.19 CC1(CO1)C(F)F MCULE-3665337434 [0,0,0,1,0,0|3,0,0]=4 2133 B7R1.19 NC1(CC1)C(=O)O MCULE-8718774934 [0,0,0,1,0,0|2,0,1]=4 2134 B7R1.19 NC1(CC1)C(=O)O MCULE-8788149299 [0,0,0,1,0,0|2,0,1]=4 2135 B7R1.19 NC1(CC1)C(F)F MCULE-3563388458 [0,0,0,1,0,0|3,0,0]=4 2136 B7R1.19 NC1(CC1)C(F)F MCULE-3701462806 [0,0,0,1,0,0|3,0,0]=4 2137 B7R1.22 C#CC(N)C1CC1 MCULE-5601339686 [0,0,0,1,0,0|2,0,1]=4 2138 B7R1.22 C#CC(N)C1CC1 MCULE-6581743000 [0,0,0,1,0,0|2,0,1]=4 2139 B7R1.22 C=C[C@H](O)[C@H]1CO1 MCULE-8949250499 [0,0,0,1,0,0|2,0,1]=4 2140 B7R1.22 CC(CBr)C1CC1 MCULE-6817011252 [0,0,0,1,0,0|3,0,0]=4 2141 B7R1.22 CC(CN)C1CC1 MCULE-8672047249 [0,0,0,1,0,0|3,0,0]=4 2142 B7R1.22 CC(CN)C1CC1 MCULE-9115092780 [0,0,0,1,0,0|3,0,0]=4 2143 B7R1.22 CC(CO)C1CC1 MCULE-8325587009 [0,0,0,1,0,0|2,0,0]=3 2144 B7R1.22 CCC(N)C1CC1 MCULE-2935155085 [0,0,0,1,0,0|2,0,0]=3 2145 B7R1.22 CCC(N)C1CC1 MCULE-7295156418 [0,0,0,1,0,0|2,0,0]=3 2146 B7R1.22 CCC(O)C1CC1 MCULE-5753196768 [0,0,0,1,0,0|3,0,0]=4 2147 B7R1.22 CC[C@@H](N)C1CC1 MCULE-8184175332 [0,0,0,1,0,0|2,0,0]=3 2148 B7R1.22 CC[C@H](N)C1CC1 MCULE-5395953598 [0,0,0,1,0,0|2,0,0]=3 2149 B7R1.22 CC[C@H](N)C1CC1 MCULE-6843001585 [0,0,0,1,0,0|2,0,0]=3 2150 B7R1.22 CC[C@H](N)C1CC1 MCULE-8773009184 [0,0,0,1,0,0|2,0,0]=3 2151 B7R1.22 ClCC(Cl)C1CO1 MCULE-4739045871 [0,0,0,1,0,0|2,0,0]=3 2152 B7R1.22 N#CC(N)C1CC1 MCULE-4442457605 [0,0,0,1,0,0|2,0,1]=4 2153 B7R1.22 N#CC(N)C1CC1 MCULE-7666876984 [0,0,0,1,0,0|2,0,1]=4 2154 B7R1.22 N/C(=N\O)/C1CC1 MCULE-1839060575 [0,0,0,1,0,0|2,0,1]=4 2155 B7R1.22 N/C(=N\O)/C1CC1 MCULE-7991254390 [0,0,0,1,0,0|2,0,1]=4 2156 B7R1.22 NC(CO)C1CC1 MCULE-5154854421 [0,0,0,1,0,0|1,0,0]=2 2157 B7R1.22 NC(CO)C1CC1 MCULE-8775546228 [0,0,0,1,0,0|1,0,0]=2 2158 B7R1.22 NCC(N)C1CC1 MCULE-9464810605 [0,0,0,1,0,0|2,0,0]=3 2159 B7R1.22 NCC(O)C1CC1 MCULE-4953920778 [0,0,0,1,0,0|3,0,0]=4 2160 B7R1.22 NCC(O)C1CC1 MCULE-5905916662 [0,0,0,1,0,0|3,0,0]=4 2161 B7R1.22 NC[C@@H](N)C1CC1 MCULE-3450570705 [0,0,0,1,0,0|2,0,0]=3 2162 B7R1.22 NC[C@@H](N)C1CC1 MCULE-4753758413 [0,0,0,1,0,0|2,0,0]=3 2163 B7R1.22 NC[C@@H](N)C1CC1 MCULE-4823446729 [0,0,0,1,0,0|2,0,0]=3 2164 B7R1.22 NC[C@@H](N)C1CC1 MCULE-7123860849 [0,0,0,1,0,0|2,0,0]=3 2165 B7R1.22 N[C@@H](CO)C1CC1 MCULE-5231249344 [0,0,0,1,0,0|1,0,0]=2 2166 B7R1.22 N[C@@H](CO)C1CC1 MCULE-5233980282 [0,0,0,1,0,0|1,0,0]=2 2167 B7R1.22 N[C@@H](CO)C1CC1 MCULE-9664157108 [0,0,0,1,0,0|1,0,0]=2 2168 B7R1.22 N[C@@H](CO)C1CC1 MCULE-9941605288 [0,0,0,1,0,0|1,0,0]=2 2169 B7R1.22 N[C@H](CO)C1CC1 MCULE-3523450080 [0,0,0,1,0,0|1,0,0]=2 2170 B7R1.22 N[C@H](CO)C1CC1 MCULE-6097147899 [0,0,0,1,0,0|1,0,0]=2 2171 B7R1.22 N[C@H](CO)C1CC1 MCULE-9050007019 [0,0,0,1,0,0|1,0,0]=2 2172 B7R1.22 N[C@H](CO)C1CC1 MCULE-9945100855 [0,0,0,1,0,0|1,0,0]=2 2173 B7R1.22 O=C(CO)C1CC1 MCULE-4276266642 [0,0,0,1,0,0|2,0,1]=4 2174 B7R1.22 OC(CBr)C1CC1 MCULE-1163924206 [0,0,0,1,0,0|3,0,0]=4 2175 B7R1.22 OCC(O)C1CC1 MCULE-9694056700 [0,0,0,1,0,0|2,0,0]=3 2176 B7R1.23 CC1(CC1CN)C MCULE-5243006209 [0,0,0,1,0,0|3,0,0]=4 2177 B7R1.23 CC1(CC1CN)C MCULE-8803769775 [0,0,0,1,0,0|3,0,0]=4 2178 B7R1.23 CC1(CC1CO)Br MCULE-1246890004 [0,0,0,1,0,0|2,0,0]=3 2179 B7R1.23 CC1(CC1CO)C MCULE-3855230422 [0,0,0,1,0,0|2,0,0]=3 2180 B7R1.23 CC1(C[C@@H]1CO)C MCULE-2771980454 [0,0,0,1,0,0|2,0,0]=3 2181 B7R1.23 CC1(C[C@H]1CO)C MCULE-7876524457 [0,0,0,1,0,0|2,0,0]=3 2182 B7R1.23 CC1(OC1CBr)C MCULE-1797899499 [0,0,0,1,0,0|3,0,0]=4 2183 B7R1.23 CC1(OC1CCl)C MCULE-6494110934 [0,0,0,1,0,0|3,0,0]=4 2184 B7R1.23 CC1(OC1CO)C MCULE-5147602353 [0,0,0,1,0,0|2,0,0]=3 2185 B7R1.23 OCC1CC1(Br)Br MCULE-7089012177 [0,0,0,1,0,0|3,0,0]=4 2186 B7R1.23 OCC1CC1(Cl)Cl MCULE-7270696266 [0,0,0,1,0,0|3,0,0]=4 2187 B7R1.23 OCC1CC1(F)F MCULE-7947011827 [0,0,0,1,0,0|3,0,0]=4 2188 B7R1.23 OCC1CC1(F)F MCULE-8758794887 [0,0,0,1,0,0|3,0,0]=4 2189 B7R1.23 OC[C@@H]1CC1(F)F MCULE-7341169417 [0,0,0,1,0,0|3,0,0]=4 2190 B7R1.23 OC[C@@H]1CC1(F)F MCULE-8085476948 [0,0,0,1,0,0|3,0,0]=4 2191 B7R1.23 OC[C@H]1CC1(F)F MCULE-4517768682 [0,0,0,1,0,0|3,0,0]=4 2192 B7R1.23 OC[C@H]1CC1(F)F MCULE-7100712334 [0,0,0,1,0,0|3,0,0]=4 2193 B7R1.27 CC1(CC1Br)CN MCULE-1556714007 [0,0,0,1,0,0|3,0,0]=4 2194 B7R1.27 CC1(CC1Br)CN MCULE-5280385523 [0,0,0,1,0,0|3,0,0]=4 2195 B7R1.27 CC1(CC1Br)CO MCULE-5286402958 [0,0,0,1,0,0|2,0,0]=3 2196 B7R1.27 CC1(CC1F)CO MCULE-9626513813 [0,0,0,1,0,0|2,0,0]=3 2197 B7R1.27 CCC1(CC1N)C MCULE-2073505141 [0,0,0,1,0,0|3,0,0]=4 2198 B7R1.27 CCC1(CC1N)C MCULE-3927183672 [0,0,0,1,0,0|3,0,0]=4 2199 B7R0.2 C=C(C)CC(N)CO MCULE-9114906744 [0,0,0,0,0,1|1,0,1]=3 2200 B7R0.2 CC(=O)NC(C)CO MCULE-9455210462 [0,0,0,0,0,1|1,0,2]=4 2201 B7R0.2 CC(=O)N[C@H](C)CO MCULE-2174899443 [0,0,0,0,0,1|1,0,2]=4 2202 B7R0.2 CC(=O)N[C@H](C)CO MCULE-5097293473 [0,0,0,0,0,1|1,0,2]=4 2203 B7R0.2 CC(C)/C=C(\F)/CO MCULE-5089231546 [0,0,0,0,0,1|2,0,1]=4 2204 B7R0.2 CC(C)C/C(=N/O)/N MCULE-1815154611 [0,0,0,0,0,1|2,0,1]=4 2205 B7R0.2 CC(C)CC(C)CBr MCULE-6800285380 [0,0,0,0,0,1|3,0,0]=4 2206 B7R0.2 CC(C)CC(C)CO MCULE-5856507691 [0,0,0,0,0,1|2,0,0]=3 2207 B7R0.2 CC(C)CC(N)C#N MCULE-6709039264 [0,0,0,0,0,1|2,0,1]=4 2208 B7R0.2 CC(C)CC(N)C#N MCULE-7842524393 [0,0,0,0,0,1|2,0,1]=4 2209 B7R0.2 CC(C)CC(N)CF MCULE-3937400151 [0,0,0,0,0,1|2,0,0]=3 2210 B7R0.2 CC(C)CC(N)CF MCULE-7951827838 [0,0,0,0,0,1|2,0,0]=3 2211 B7R0.2 CC(C)CC(N)CN MCULE-3441513735 [0,0,0,0,0,1|2,0,0]=3 2212 B7R0.2 CC(C)CC(N)CO MCULE-6347344178 [0,0,0,0,0,1|1,0,0]=2 2213 B7R0.2 CC(C)CC(N)CO MCULE-7024759986 [0,0,0,0,0,1|1,0,0]=2 2214 B7R0.2 CC(C)CC(N)CS MCULE-8932651812 [0,0,0,0,0,1|1,1,0]=3 2215 B7R0.2 CC(C)CC(O)CN MCULE-9414833333 [0,0,0,0,0,1|3,0,0]=4 2216 B7R0.2 CC(C)CC(O)CN MCULE-9784331526 [0,0,0,0,0,1|3,0,0]=4 2217 B7R0.2 CC(C)C[C@@H](N)CBr MCULE-4869966214 [0,0,0,0,0,1|2,0,0]=3 2218 B7R0.2 CC(C)C[C@@H](N)CO MCULE-1979401982 [0,0,0,0,0,1|1,0,0]=2 2219 B7R0.2 CC(C)C[C@@H](N)CO MCULE-3025407298 [0,0,0,0,0,1|1,0,0]=2 2220 B7R0.2 CC(C)C[C@H](N)C=O MCULE-3713415627 [0,0,0,0,0,1|1,0,2]=4 2221 B7R0.2 CC(C)C[C@H](N)CBr MCULE-4224057266 [0,0,0,0,0,1|2,0,0]=3 2222 B7R0.2 CC(C)C[C@H](N)CO MCULE-2790872575 [0,0,0,0,0,1|1,0,0]=2 2223 B7R0.2 CC(C)C[C@H](N)CO MCULE-9198147139 [0,0,0,0,0,1|1,0,0]=2 2224 B7R0.2 CC(C)NC(=O)CO MCULE-5386700783 [0,0,0,0,0,1|2,0,1]=4 2225 B7R0.2 CC(C)OC(=O)CO MCULE-4694316703 [0,0,0,0,0,1|2,0,1]=4 2226 B7R0.2 CC(CO)CC(F)F MCULE-1470130605 [0,0,0,0,0,1|3,0,0]=4 2227 B7R0.2 CC(CO)CN(C)C MCULE-3103307387 [0,0,0,0,0,1|3,0,0]=4 2228 B7R0.2 CC(O)CC(C)CN MCULE-3086796159 [0,0,0,0,0,1|2,0,0]=3 2229 B7R0.2 CCC(C)CC(C)C MCULE-9492683095 [0,0,0,0,0,1|3,0,0]=4 2230 B7R0.2 CCC(C)CC(C)N MCULE-2633957870 [0,0,0,0,0,1|3,0,0]=4 2231 B7R0.2 CCC(C)CC(C)N MCULE-5740038174 [0,0,0,0,0,1|3,0,0]=4 2232 B7R0.2 CCC(N)CC(=O)O MCULE-1744910444 [0,0,0,0,0,1|2,0,1]=4 2233 B7R0.2 CCC(N)CC(=O)O MCULE-5610499925 [0,0,0,0,0,1|2,0,1]=4 2234 B7R0.2 CCC(N)CC(C)O MCULE-1447243469 [0,0,0,0,0,1|1,0,0]=2 2235 B7R0.2 CCC(N)CN(C)C MCULE-7794272438 [0,0,0,0,0,1|3,0,0]=4 2236 B7R0.2 CCC(O)CC(C)O MCULE-3115543235 [0,0,0,0,0,1|2,0,0]=3 2237 B7R0.2 CC[C@@H](N)CC(=O)O MCULE-1158271004 [0,0,0,0,0,1|2,0,1]=4 2238 B7R0.2 CC[C@@H](N)CC(=O)O MCULE-2354820947 [0,0,0,0,0,1|2,0,1]=4 2239 B7R0.2 CC[C@@H](N)CC(=O)O MCULE-4284161835 [0,0,0,0,0,1|2,0,1]=4 2240 B7R0.2 CC[C@@H](N)CC(=O)O MCULE-9523089766 [0,0,0,0,0,1|2,0,1]=4 2241 B7R0.2 CC[C@@H](N)CN(C)C MCULE-4272885891 [0,0,0,0,0,1|3,0,0]=4 2242 B7R0.2 CC[C@@H](N)CN(C)C MCULE-8695009794 [0,0,0,0,0,1|3,0,0]=4 2243 B7R0.2 CC[C@H](N)CC(=O)O MCULE-1463536674 [0,0,0,0,0,1|2,0,1]=4 2244 B7R0.2 CC[C@H](N)CC(=O)O MCULE-2865599647 [0,0,0,0,0,1|2,0,1]=4 2245 B7R0.2 CC[C@H](N)CC(=O)O MCULE-4506847599 [0,0,0,0,0,1|2,0,1]=4 2246 B7R0.2 CC[C@H](N)CC(=O)O MCULE-4819674539 [0,0,0,0,0,1|2,0,1]=4 2247 B7R0.2 CC[C@H](N)CN(C)C MCULE-4335497059 [0,0,0,0,0,1|3,0,0]=4 2248 B7R0.2 CC[C@H](N)CN(C)C MCULE-5607250734 [0,0,0,0,0,1|3,0,0]=4 2249 B7R0.2 CN(C)CC(N)CO MCULE-2789134862 [0,0,0,0,0,1|2,0,0]=3 2250 B7R0.2 CN(C)CC(N)CO MCULE-4090276677 [0,0,0,0,0,1|2,0,0]=3 2251 B7R0.2 CN(C)CC(O)CO MCULE-3436894516 [0,0,0,0,0,1|3,0,0]=4 2252 B7R0.2 CN(C)C[C@@H](O)CO MCULE-7101033572 [0,0,0,0,0,1|3,0,0]=4 2253 B7R0.2 CN(C)C[C@H](O)CO MCULE-4297947949 [0,0,0,0,0,1|3,0,0]=4 2254 B7R0.2 COC(C)CC(C)O MCULE-3635789827 [0,0,0,0,0,1|3,0,0]=4 2255 B7R0.2 NC(CO)CC(=O)O MCULE-4749383822 [0,0,0,0,0,1|1,0,1]=3 2256 B7R0.2 NC(CO)CC(=O)O MCULE-7973334774 [0,0,0,0,0,1|1,0,1]=3 2257 B7R0.2 NC(CO)CC(=O)O MCULE-8406665261 [0,0,0,0,0,1|1,0,1]=3 2258 B7R0.2 NC(CO)CC(F)F MCULE-5033329865 [0,0,0,0,0,1|2,0,0]=3 2259 B7R0.2 NC(CO)CC(F)F MCULE-6986507912 [0,0,0,0,0,1|2,0,0]=3 2260 B7R0.2 NCC(N)CC(=O)O MCULE-5523883615 [0,0,0,0,0,1|2,0,1]=4 2261 B7R0.2 NCC(N)CC(=O)O MCULE-7594259237 [0,0,0,0,0,1|2,0,1]=4 2262 B7R0.2 NC[C@@H](N)CC(=O)O MCULE-6348974465 [0,0,0,0,0,1|2,0,1]=4 2263 B7R0.2 NC[C@@H](N)CC(=O)O MCULE-9397628218 [0,0,0,0,0,1|2,0,1]=4 2264 B7R0.2 NC[C@H](N)CC(=O)O MCULE-6133569516 [0,0,0,0,0,1|2,0,1]=4 2265 B7R0.2 NC[C@H](N)CC(=O)O MCULE-7098533469 [0,0,0,0,0,1|2,0,1]=4 2266 B7R0.2 N[C@@H](CO)CC(=O)O MCULE-1773927420 [0,0,0,0,0,1|1,0,1]=3 2267 B7R0.2 N[C@@H](CO)CC(=O)O MCULE-2797951743 [0,0,0,0,0,1|1,0,1]=3 2268 B7R0.2 N[C@@H](CO)CC(=O)O MCULE-3839766977 [0,0,0,0,0,1|1,0,1]=3 2269 B7R0.2 N[C@H](CO)CC(=O)O MCULE-4130106630 [0,0,0,0,0,1|1,0,1]=3 2270 B7R0.2 O=C(O)CC(O)CO MCULE-2851149196 [0,0,0,0,0,1|2,0,1]=4 2271 B7R0.2 O=C(O)C[C@H](O)CO MCULE-5671818548 [0,0,0,0,0,1|2,0,1]=4 2272 B4R0.1 C#CC(C)N MCULE-5174459541 [2,0,0,0,0,0|0,0,2]=4 2273 B4R0.1 C#CC(C)N MCULE-7552261137 [2,0,0,0,0,0|0,0,2]=4 2274 B4R0.1 C#CC(C)N MCULE-8458008104 [2,0,0,0,0,0|0,0,2]=4 2275 B4R0.1 C#CC(C)N MCULE-8872781976 [2,0,0,0,0,0|0,0,2]=4 2276 B4R0.1 C#CC(C)O MCULE-6692690957 [2,0,0,0,0,0|0,0,2]=4 2277 B4R0.1 C#CC(C)O MCULE-8115962170 [2,0,0,0,0,0|0,0,2]=4 2278 B4R0.1 C#C[C@@H](C)N MCULE-1688945745 [2,0,0,0,0,0|0,0,2]=4 2279 B4R0.1 C#C[C@@H](C)N MCULE-2648127023 [2,0,0,0,0,0|0,0,2]=4 2280 B4R0.1 C#C[C@@H](C)N MCULE-4450167680 [2,0,0,0,0,0|0,0,2]=4 2281 B4R0.1 C#C[C@@H](C)N MCULE-5940189329 [2,0,0,0,0,0|0,0,2]=4 2282 B4R0.1 C#C[C@@H](C)O MCULE-3014030718 [2,0,0,0,0,0|0,0,2]=4 2283 B4R0.1 C#C[C@@H](C)O MCULE-5925379513 [2,0,0,0,0,0|0,0,2]=4 2284 B4R0.1 C#C[C@H](C)N MCULE-1256303297 [2,0,0,0,0,0|0,0,2]=4 2285 B4R0.1 C#C[C@H](C)N MCULE-4223264163 [2,0,0,0,0,0|0,0,2]=4 2286 B4R0.1 C#C[C@H](C)N MCULE-9450573338 [2,0,0,0,0,0|0,0,2]=4 2287 B4R0.1 C#C[C@H](C)N MCULE-9795039145 [2,0,0,0,0,0|0,0,2]=4 2288 B4R0.1 C#C[C@H](C)O MCULE-3264536845 [2,0,0,0,0,0|0,0,2]=4 2289 B4R0.1 C(C)(N)CN MCULE-5877041140 [2,0,0,0,0,0|1,0,0]=3 2290 B4R0.1 C(C)(N)CO MCULE-5844242932 [2,0,0,0,0,0|0,0,0]=2 2291 B4R0.1 C/C(=N/O)/N MCULE-5595239824 [2,0,0,0,0,0|1,0,1]=4 2292 B4R0.1 C/C(=N\O)/N MCULE-8004142092 [2,0,0,0,0,0|1,0,1]=4 2293 B4R0.1 C=C(C)CN MCULE-1033495975 [2,0,0,0,0,0|1,0,1]=4 2294 B4R0.1 C=C(C)CN MCULE-8730181300 [2,0,0,0,0,0|1,0,1]=4 2295 B4R0.1 C=C(C)CO MCULE-8641288398 [2,0,0,0,0,0|1,0,1]=4 2296 B4R0.1 C=CC(C)N MCULE-5748048106 [2,0,0,0,0,0|0,0,2]=4 2297 B4R0.1 C=CC(C)N MCULE-6786590923 [2,0,0,0,0,0|0,0,2]=4 2298 B4R0.1 C=CC(C)O MCULE-4525368256 [2,0,0,0,0,0|0,0,2]=4 2299 B4R0.1 C=C[C@@H](C)N MCULE-4388444035 [2,0,0,0,0,0|0,0,2]=4 2300 B4R0.1 C=C[C@@H](C)N MCULE-6107415849 [2,0,0,0,0,0|0,0,2]=4 2301 B4R0.1 C=C[C@@H](C)N MCULE-6707490046 [2,0,0,0,0,0|0,0,2]=4 2302 B4R0.1 C=C[C@@H](C)N MCULE-9654995108 [2,0,0,0,0,0|0,0,2]=4 2303 B4R0.1 C=C[C@H](C)N MCULE-1396113041 [2,0,0,0,0,0|0,0,2]=4 2304 B4R0.1 C=C[C@H](C)N MCULE-2197513722 [2,0,0,0,0,0|0,0,2]=4 2305 B4R0.1 C=C[C@H](C)N MCULE-4698235480 [2,0,0,0,0,0|0,0,2]=4 2306 B4R0.1 C=C[C@H](C)N MCULE-8745929233 [2,0,0,0,0,0|0,0,2]=4 2307 B4R0.1 C=C[C@H](C)O MCULE-2251589245 [2,0,0,0,0,0|0,0,2]=4 2308 B4R0.1 CC(=O)CN MCULE-2715277783 [2,0,0,0,0,0|0,0,2]=4 2309 B4R0.1 CC(=O)CN MCULE-6004541862 [2,0,0,0,0,0|0,0,2]=4 2310 B4R0.1 CC(=O)CO MCULE-2989526028 [2,0,0,0,0,0|0,0,2]=4 2311 B4R0.1 CC(Br)CBr MCULE-6304574748 [2,0,0,0,0,0|2,0,0]=4 2312 B4R0.1 CC(Br)CCl MCULE-8021380791 [2,0,0,0,0,0|2,0,0]=4 2313 B4R0.1 CC(Br)CN MCULE-5214613046 [2,0,0,0,0,0|1,0,0]=3 2314 B4R0.1 CC(Br)CN MCULE-6326218362 [2,0,0,0,0,0|1,0,0]=3 2315 B4R0.1 CC(Br)CO MCULE-8344365003 [2,0,0,0,0,0|1,0,0]=3 2316 B4R0.1 CC(C)CBr MCULE-6039420480 [2,0,0,0,0,0|2,0,0]=4 2317 B4R0.1 CC(C)CCl MCULE-6524976746 [2,0,0,0,0,0|2,0,0]=4 2318 B4R0.1 CC(C)CI MCULE-5280589461 [2,0,0,0,0,0|2,0,0]=4 2319 B4R0.1 CC(C)CN MCULE-2158650588 [2,0,0,0,0,0|1,0,0]=3 2320 B4R0.1 CC(C)CN MCULE-6751437658 [2,0,0,0,0,0|1,0,0]=3 2321 B4R0.1 CC(C)CN MCULE-8319193456 [2,0,0,0,0,0|1,0,0]=3 2322 B4R0.1 CC(C)CN MCULE-8705657065 [2,0,0,0,0,0|1,0,0]=3 2323 B4R0.1 CC(C)CO MCULE-6294327194 [2,0,0,0,0,0|1,0,0]=3 2324 B4R0.1 CC(C)CP MCULE-3724358658 [2,0,0,0,0,0|1,1,0]=4 2325 B4R0.1 CC(C)CS MCULE-7978911055 [2,0,0,0,0,0|1,1,0]=4 2326 B4R0.1 CC(C)NN MCULE-4673953224 [2,0,0,0,0,0|2,0,0]=4 2327 B4R0.1 CC(C)NN MCULE-7901160798 [2,0,0,0,0,0|2,0,0]=4 2328 B4R0.1 CC(C)NN MCULE-9473118288 [2,0,0,0,0,0|2,0,0]=4 2329 B4R0.1 CC(C)NO MCULE-6516566403 [2,0,0,0,0,0|2,0,0]=4 2330 B4R0.1 CC(C)NO MCULE-8545146035 [2,0,0,0,0,0|2,0,0]=4 2331 B4R0.1 CC(C)ON MCULE-4063407094 [2,0,0,0,0,0|2,0,0]=4 2332 B4R0.1 CC(C)ON MCULE-9108231771 [2,0,0,0,0,0|2,0,0]=4 2333 B4R0.1 CC(Cl)CBr MCULE-8474943880 [2,0,0,0,0,0|2,0,0]=4 2334 B4R0.1 CC(Cl)CCl MCULE-1548912109 [2,0,0,0,0,0|2,0,0]=4 2335 B4R0.1 CC(Cl)CN MCULE-2637316379 [2,0,0,0,0,0|1,0,0]=3 2336 B4R0.1 CC(Cl)CN MCULE-5591419030 [2,0,0,0,0,0|1,0,0]=3 2337 B4R0.1 CC(Cl)CO MCULE-3857255988 [2,0,0,0,0,0|1,0,0]=3 2338 B4R0.1 CC(Cl)CO MCULE-7538548427 [2,0,0,0,0,0|1,0,0]=3 2339 B4R0.1 CC(F)CN MCULE-6584490651 [2,0,0,0,0,0|1,0,0]=3 2340 B4R0.1 CC(F)CN MCULE-9499916116 [2,0,0,0,0,0|1,0,0]=3 2341 B4R0.1 CC(F)CO MCULE-6006763378 [2,0,0,0,0,0|1,0,0]=3 2342 B4R0.1 CC(N)C#N MCULE-4008524363 [2,0,0,0,0,0|1,0,1]=4 2343 B4R0.1 CC(N)C#N MCULE-8654767875 [2,0,0,0,0,0|1,0,1]=4 2344 B4R0.1 CC(N)C=O MCULE-3421118418 [2,0,0,0,0,0|0,0,2]=4 2345 B4R0.1 CC(N)CBr MCULE-1783493149 [2,0,0,0,0,0|1,0,0]=3 2346 B4R0.1 CC(N)CBr MCULE-2775398297 [2,0,0,0,0,0|1,0,0]=3 2347 B4R0.1 CC(N)CCl MCULE-8652434595 [2,0,0,0,0,0|1,0,0]=3 2348 B4R0.1 CC(N)CCl MCULE-9580466630 [2,0,0,0,0,0|1,0,0]=3 2349 B4R0.1 CC(N)CF MCULE-1603143200 [2,0,0,0,0,0|1,0,0]=3 2350 B4R0.1 CC(N)CF MCULE-3787216870 [2,0,0,0,0,0|1,0,0]=3 2351 B4R0.1 CC(N)CF MCULE-4138869746 [2,0,0,0,0,0|1,0,0]=3 2352 B4R0.1 CC(N)CF MCULE-8611760275 [2,0,0,0,0,0|1,0,0]=3 2353 B4R0.1 CC(N)CN MCULE-2119036110 [2,0,0,0,0,0|1,0,0]=3 2354 B4R0.1 CC(N)CN MCULE-6286216576 [2,0,0,0,0,0|1,0,0]=3 2355 B4R0.1 CC(N)CN MCULE-9919433465 [2,0,0,0,0,0|1,0,0]=3 2356 B4R0.1 CC(N)CO MCULE-1361379423 [2,0,0,0,0,0|0,0,0]=2 2357 B4R0.1 CC(N)CO MCULE-2098440985 [2,0,0,0,0,0|0,0,0]=2 2358 B4R0.1 CC(N)CS MCULE-1396853557 [2,0,0,0,0,0|0,1,0]=3 2359 B4R0.1 CC(N)CS MCULE-4094732666 [2,0,0,0,0,0|0,1,0]=3 2360 B4R0.1 CC(O)C#N MCULE-3166802314 [2,0,0,0,0,0|0,0,2]=4 2361 B4R0.1 CC(O)CBr MCULE-7835094737 [2,0,0,0,0,0|1,0,0]=3 2362 B4R0.1 CC(O)CCl MCULE-9140807958 [2,0,0,0,0,0|1,0,0]=3 2363 B4R0.1 CC(O)CF MCULE-1023052065 [2,0,0,0,0,0|1,0,0]=3 2364 B4R0.1 CC(O)CN MCULE-4370440652 [2,0,0,0,0,0|0,0,0]=2 2365 B4R0.1 CC(O)CN MCULE-5694317743 [2,0,0,0,0,0|0,0,0]=2 2366 B4R0.1 CC(O)CN MCULE-6406041538 [2,0,0,0,0,0|0,0,0]=2 2367 B4R0.1 CC(O)CN MCULE-6636652305 [2,0,0,0,0,0|0,0,0]=2 2368 B4R0.1 CC(O)CO MCULE-5574440784 [2,0,0,0,0,0|0,0,0]=2 2369 B4R0.1 CC(O)CO MCULE-8743139013 [2,0,0,0,0,0|0,0,0]=2 2370 B4R0.1 CC(O)CS MCULE-7881083356 [2,0,0,0,0,0|0,1,0]=3 2371 B4R0.1 CC(O)C[NH3+] MCULE-6871369474 [2,0,0,0,0,0|0,0,1]=3 2372 B4R0.1 CC(S)CN MCULE-1957568322 [2,0,0,0,0,0|0,1,0]=3 2373 B4R0.1 CC(S)CN MCULE-7469442412 [2,0,0,0,0,0|0,1,0]=3 2374 B4R0.1 CC(S)CO MCULE-5090908062 [2,0,0,0,0,0|0,1,0]=3 2375 B4R0.1 CC(S)CS MCULE-9264694858 [2,0,0,0,0,0|0,2,0]=4 2376 B4R0.1 CCB(O)O MCULE-1650960999 [2,0,0,0,0,0|2,0,0]=4 2377 B4R0.1 CCC(=N)N MCULE-1856575742 [2,0,0,0,0,0|1,0,1]=4 2378 B4R0.1 CCC(=N)N MCULE-2534386807 [2,0,0,0,0,0|1,0,1]=4 2379 B4R0.1 CCC(=O)C MCULE-8276670748 [2,0,0,0,0,0|0,0,2]=4 2380 B4R0.1 CCC(=O)N MCULE-3730796130 [2,0,0,0,0,0|0,0,2]=4 2381 B4R0.1 CCC(=O)O MCULE-2199051150 [2,0,0,0,0,0|1,0,1]=4 2382 B4R0.1 CCC(=O)O MCULE-9800054040 [2,0,0,0,0,0|1,0,1]=4 2383 B4R0.1 CCC(=S)N MCULE-3921479699 [2,0,0,0,0,0|0,1,1]=4 2384 B4R0.1 CCC(C)Br MCULE-9661620259 [2,0,0,0,0,0|1,0,0]=3 2385 B4R0.1 CCC(C)C MCULE-5376105936 [2,0,0,0,0,0|1,0,0]=3 2386 B4R0.1 CCC(C)Cl MCULE-2954418486 [2,0,0,0,0,0|1,0,0]=3 2387 B4R0.1 CCC(C)I MCULE-5239699587 [2,0,0,0,0,0|1,0,0]=3 2388 B4R0.1 CCC(C)N MCULE-5041676035 [2,0,0,0,0,0|0,0,0]=2 2389 B4R0.1 CCC(C)N MCULE-5835091553 [2,0,0,0,0,0|0,0,0]=2 2390 B4R0.1 CCC(C)N MCULE-6631606230 [2,0,0,0,0,0|0,0,0]=2 2391 B4R0.1 CCC(C)N MCULE-8165681721 [2,0,0,0,0,0|0,0,0]=2 2392 B4R0.1 CCC(C)O MCULE-4099350806 [2,0,0,0,0,0|0,0,0]=2 2393 B4R0.1 CCC(C)O MCULE-5005120003 [2,0,0,0,0,0|0,0,0]=2 2394 B4R0.1 CCC(C)S MCULE-4988033753 [2,0,0,0,0,0|0,1,0]=3 2395 B4R0.1 CCN(C)C MCULE-5825033552 [2,0,0,0,0,0|2,0,0]=4 2396 B4R0.1 CCN(C)N MCULE-2279492356 [2,0,0,0,0,0|1,0,0]=3 2397 B4R0.1 CCN(C)N MCULE-5660338703 [2,0,0,0,0,0|1,0,0]=3 2398 B4R0.1 CCN(C)N MCULE-9839987578 [2,0,0,0,0,0|1,0,0]=3 2399 B4R0.1 CCS(=O)C MCULE-4400935745 [2,0,0,0,0,0|1,0,1]=4 2400 B4R0.1 CCS(=O)O MCULE-9872932319 [2,0,0,0,0,0|2,0,0]=4 2401 B4R0.1 CC[C@@H](C)N MCULE-2017255826 [2,0,0,0,0,0|0,0,0]=2 2402 B4R0.1 CC[C@@H](C)N MCULE-3555707512 [2,0,0,0,0,0|0,0,0]=2 2403 B4R0.1 CC[C@@H](C)N MCULE-6783735598 [2,0,0,0,0,0|0,0,0]=2 2404 B4R0.1 CC[C@@H](C)N MCULE-7004219201 [2,0,0,0,0,0|0,0,0]=2 2405 B4R0.1 CC[C@@H](C)O MCULE-2661481448 [2,0,0,0,0,0|0,0,0]=2 2406 B4R0.1 CC[C@@H](C)O MCULE-6785232833 [2,0,0,0,0,0|0,0,0]=2 2407 B4R0.1 CC[C@H](C)N MCULE-2450201533 [2,0,0,0,0,0|0,0,0]=2 2408 B4R0.1 CC[C@H](C)N MCULE-2998961427 [2,0,0,0,0,0|0,0,0]=2 2409 B4R0.1 CC[C@H](C)N MCULE-6692190471 [2,0,0,0,0,0|0,0,0]=2 2410 B4R0.1 CC[C@H](C)N MCULE-6904795465 [2,0,0,0,0,0|0,0,0]=2 2411 B4R0.1 CC[C@H](C)O MCULE-3700911573 [2,0,0,0,0,0|0,0,0]=2 2412 B4R0.1 CC[C@H](C)O MCULE-6063716138 [2,0,0,0,0,0|0,0,0]=2 2413 B4R0.1 CNC(C)C MCULE-3849513543 [2,0,0,0,0,0|2,0,0]=4 2414 B4R0.1 COC(C)Cl MCULE-9043930044 [2,0,0,0,0,0|2,0,0]=4 2415 B4R0.1 CSC(C)C MCULE-5932565699 [2,0,0,0,0,0|2,0,0]=4 2416 B4R0.1 C[C@@H](Cl)CO MCULE-4834664531 [2,0,0,0,0,0|1,0,0]=3 2417 B4R0.1 C[C@@H](Cl)CO MCULE-8797955903 [2,0,0,0,0,0|1,0,0]=3 2418 B4R0.1 C[C@@H](F)CO MCULE-3312305972 [2,0,0,0,0,0|1,0,0]=3 2419 B4R0.1 C[C@@H](F)CO MCULE-4754825872 [2,0,0,0,0,0|1,0,0]=3 2420 B4R0.1 C[C@@H](N)C#N MCULE-4366493733 [2,0,0,0,0,0|1,0,1]=4 2421 B4R0.1 C[C@@H](N)C#N MCULE-4475438132 [2,0,0,0,0,0|1,0,1]=4 2422 B4R0.1 C[C@@H](N)C#N MCULE-8152568021 [2,0,0,0,0,0|1,0,1]=4 2423 B4R0.1 C[C@@H](N)C#N MCULE-9327848803 [2,0,0,0,0,0|1,0,1]=4 2424 B4R0.1 C[C@@H](N)CF MCULE-2227343602 [2,0,0,0,0,0|1,0,0]=3 2425 B4R0.1 C[C@@H](N)CF MCULE-2283243747 [2,0,0,0,0,0|1,0,0]=3 2426 B4R0.1 C[C@@H](N)CF MCULE-6326763354 [2,0,0,0,0,0|1,0,0]=3 2427 B4R0.1 C[C@@H](N)CF MCULE-6630824972 [2,0,0,0,0,0|1,0,0]=3 2428 B4R0.1 C[C@@H](N)CN MCULE-5207840256 [2,0,0,0,0,0|1,0,0]=3 2429 B4R0.1 C[C@@H](N)CN MCULE-5332214014 [2,0,0,0,0,0|1,0,0]=3 2430 B4R0.1 C[C@@H](N)CN MCULE-7816211809 [2,0,0,0,0,0|1,0,0]=3 2431 B4R0.1 C[C@@H](N)CN MCULE-7982492466 [2,0,0,0,0,0|1,0,0]=3 2432 B4R0.1 C[C@@H](N)CO MCULE-5655560645 [2,0,0,0,0,0|0,0,0]=2 2433 B4R0.1 C[C@@H](N)CO MCULE-8066658004 [2,0,0,0,0,0|0,0,0]=2 2434 B4R0.1 C[C@@H](O)C=O MCULE-5921136435 [2,0,0,0,0,0|0,0,2]=4 2435 B4R0.1 C[C@@H](O)CCl MCULE-4669677883 [2,0,0,0,0,0|1,0,0]=3 2436 B4R0.1 C[C@@H](O)CCl MCULE-7670590902 [2,0,0,0,0,0|1,0,0]=3 2437 B4R0.1 C[C@@H](O)CN MCULE-9301041927 [2,0,0,0,0,0|0,0,0]=2 2438 B4R0.1 C[C@@H](O)CO MCULE-4464598400 [2,0,0,0,0,0|0,0,0]=2 2439 B4R0.1 C[C@@H](O)CO MCULE-9914833832 [2,0,0,0,0,0|0,0,0]=2 2440 B4R0.1 C[C@@H](O)CS MCULE-8817452889 [2,0,0,0,0,0|0,1,0]=3 2441 B4R0.1 C[C@H](Cl)CO MCULE-6747279587 [2,0,0,0,0,0|1,0,0]=3 2442 B4R0.1 C[C@H](Cl)CO MCULE-8509218918 [2,0,0,0,0,0|1,0,0]=3 2443 B4R0.1 C[C@H](F)CO MCULE-1024261541 [2,0,0,0,0,0|1,0,0]=3 2444 B4R0.1 C[C@H](F)CO MCULE-7028098137 [2,0,0,0,0,0|1,0,0]=3 2445 B4R0.1 C[C@H](N)C#N MCULE-2449963253 [2,0,0,0,0,0|1,0,1]=4 2446 B4R0.1 C[C@H](N)C#N MCULE-3624286995 [2,0,0,0,0,0|1,0,1]=4 2447 B4R0.1 C[C@H](N)CF MCULE-1053227516 [2,0,0,0,0,0|1,0,0]=3 2448 B4R0.1 C[C@H](N)CF MCULE-4024916343 [2,0,0,0,0,0|1,0,0]=3 2449 B4R0.1 C[C@H](N)CF MCULE-6312285034 [2,0,0,0,0,0|1,0,0]=3 2450 B4R0.1 C[C@H](N)CF MCULE-7630744199 [2,0,0,0,0,0|1,0,0]=3 2451 B4R0.1 C[C@H](N)CN MCULE-2048837128 [2,0,0,0,0,0|1,0,0]=3 2452 B4R0.1 C[C@H](N)CN MCULE-4105152552 [2,0,0,0,0,0|1,0,0]=3 2453 B4R0.1 C[C@H](N)CN MCULE-7106390536 [2,0,0,0,0,0|1,0,0]=3 2454 B4R0.1 C[C@H](N)CN MCULE-9863306005 [2,0,0,0,0,0|1,0,0]=3 2455 B4R0.1 C[C@H](N)CO MCULE-2471107013 [2,0,0,0,0,0|0,0,0]=2 2456 B4R0.1 C[C@H](N)CO MCULE-5424195678 [2,0,0,0,0,0|0,0,0]=2 2457 B4R0.1 C[C@H](O)CCl MCULE-3018109825 [2,0,0,0,0,0|1,0,0]=3 2458 B4R0.1 C[C@H](O)CCl MCULE-5836677540 [2,0,0,0,0,0|1,0,0]=3 2459 B4R0.1 C[C@H](O)CN MCULE-3227371869 [2,0,0,0,0,0|0,0,0]=2 2460 B4R0.1 C[C@H](O)CN MCULE-5480489257 [2,0,0,0,0,0|0,0,0]=2 2461 B4R0.1 C[C@H](O)CO MCULE-6582852191 [2,0,0,0,0,0|0,0,0]=2 2462 B4R0.1 C[C@H](O)CO MCULE-8074793296 [2,0,0,0,0,0|0,0,0]=2 2463 B4R0.1 C[C@H](O)CS MCULE-9061842733 [2,0,0,0,0,0|0,1,0]=3 2464 B4R0.1 N=C(N)CO MCULE-5146395919 [2,0,0,0,0,0|1,0,1]=4 2465 B4R0.1 N=C(N)CO MCULE-8814507460 [2,0,0,0,0,0|1,0,1]=4 2466 B4R0.1 NC(=O)CO MCULE-2739878376 [2,0,0,0,0,0|0,0,2]=4 2467 B4R0.1 NC(=S)CO MCULE-9301705313 [2,0,0,0,0,0|0,1,1]=4 2468 B4R0.1 NCC(=O)O MCULE-2415764032 [2,0,0,0,0,0|1,0,1]=4 2469 B4R0.1 NCC(=O)O MCULE-3643110755 [2,0,0,0,0,0|1,0,1]=4 2470 B4R0.1 NCC(=O)O MCULE-4349255299 [2,0,0,0,0,0|1,0,1]=4 2471 B4R0.1 NCC(=O)O MCULE-9146223615 [2,0,0,0,0,0|1,0,1]=4 2472 B4R0.1 NCC(=O)O MCULE-9701991737 [2,0,0,0,0,0|1,0,1]=4 2473 B4R0.1 NCC(Cl)Cl MCULE-6022785182 [2,0,0,0,0,0|2,0,0]=4 2474 B4R0.1 NCC(Cl)Cl MCULE-8181626787 [2,0,0,0,0,0|2,0,0]=4 2475 B4R0.1 NCC(F)F MCULE-5562582586 [2,0,0,0,0,0|2,0,0]=4 2476 B4R0.1 NCC(F)F MCULE-9437628707 [2,0,0,0,0,0|2,0,0]=4 2477 B4R0.1 O=C(O)CO MCULE-9792551388 [2,0,0,0,0,0|1,0,1]=4 2478 B4R0.1 O=S(O)CO MCULE-4195832185 [2,0,0,0,0,0|2,0,0]=4 2479 B4R0.1 OCC(Cl)Cl MCULE-3279441180 [2,0,0,0,0,0|2,0,0]=4 2480 B4R0.1 OCC(F)Br MCULE-5466660542 [2,0,0,0,0,0|2,0,0]=4 2481 B4R0.1 OCC(F)F MCULE-3252378943 [2,0,0,0,0,0|2,0,0]=4 2482 B4R0.1 P(=O)(O)CN MCULE-5441171864 [2,0,0,0,0,0|2,0,0]=4 2483 B4R0.1 [C@@H](C)(O)C#C MCULE-8971134855 [2,0,0,0,0,0|0,0,2]=4 2484 B4R0.1 [C@H](C)(O)CN MCULE-8212000072 [2,0,0,0,0,0|0,0,0]=2 2485 B4R0.1 [NH3+]C(C)CC MCULE-3066898055 [2,0,0,0,0,0|0,0,1]=3 2486 B4R0.2 BrCCCBr MCULE-6500110480 [2,0,0,0,0,0|2,0,0]=4 2487 B4R0.2 BrCCCI MCULE-6470610840 [2,0,0,0,0,0|2,0,0]=4 2488 B4R0.2 C#CCCC MCULE-1233806896 [2,0,0,0,0,0|1,0,1]=4 2489 B4R0.2 C#CCCO MCULE-1797559276 [2,0,0,0,0,0|0,0,2]=4 2490 B4R0.2 C#CCCO MCULE-8743964065 [2,0,0,0,0,0|0,0,2]=4 2491 B4R0.2 C/C=C/CO MCULE-2383161163 [2,0,0,0,0,0|0,0,2]=4 2492 B4R0.2 C/C=C\CO MCULE-5924662327 [2,0,0,0,0,0|0,0,2]=4 2493 B4R0.2 C=CCCC MCULE-8386546337 [2,0,0,0,0,0|1,0,1]=4 2494 B4R0.2 C=CCCO MCULE-4582400839 [2,0,0,0,0,0|0,0,2]=4 2495 B4R0.2 CC#CCO MCULE-5096552076 [2,0,0,0,0,0|0,0,2]=4 2496 B4R0.2 CC=CCO MCULE-7490725844 [2,0,0,0,0,0|0,0,2]=4 2497 B4R0.2 CCC=NO MCULE-9457280654 [2,0,0,0,0,0|1,0,1]=4 2498 B4R0.2 CCCC#N MCULE-8571076087 [2,0,0,0,0,0|1,0,1]=4 2499 B4R0.2 CCCC=O MCULE-8530391347 [2,0,0,0,0,0|0,0,2]=4 2500 B4R0.2 CCCCBr MCULE-3390217131 [2,0,0,0,0,0|1,0,0]=3 2501 B4R0.2 CCCCC MCULE-4643148765 [2,0,0,0,0,0|1,0,0]=3 2502 B4R0.2 CCCCCl MCULE-5329900290 [2,0,0,0,0,0|1,0,0]=3 2503 B4R0.2 CCCCF MCULE-7225760858 [2,0,0,0,0,0|1,0,0]=3 2504 B4R0.2 CCCCI MCULE-1160974720 [2,0,0,0,0,0|1,0,0]=3 2505 B4R0.2 CCCCN MCULE-1731874934 [2,0,0,0,0,0|1,0,0]=3 2506 B4R0.2 CCCCN MCULE-4233278050 [2,0,0,0,0,0|1,0,0]=3 2507 B4R0.2 CCCCN MCULE-5242069370 [2,0,0,0,0,0|1,0,0]=3 2508 B4R0.2 CCCCN MCULE-7343835253 [2,0,0,0,0,0|1,0,0]=3 2509 B4R0.2 CCCCO MCULE-1571156443 [2,0,0,0,0,0|0,0,0]=2 2510 B4R0.2 CCCCS MCULE-9441213933 [2,0,0,0,0,0|0,1,0]=3 2511 B4R0.2 CCCNC MCULE-2266616259 [2,0,0,0,0,0|2,0,0]=4 2512 B4R0.2 CCCNC MCULE-7722796872 [2,0,0,0,0,0|2,0,0]=4 2513 B4R0.2 CCCNN MCULE-4121438775 [2,0,0,0,0,0|2,0,0]=4 2514 B4R0.2 CCCNN MCULE-5875592228 [2,0,0,0,0,0|2,0,0]=4 2515 B4R0.2 CCCNN MCULE-9585694661 [2,0,0,0,0,0|2,0,0]=4 2516 B4R0.2 CCCOC MCULE-5854067718 [2,0,0,0,0,0|2,0,0]=4 2517 B4R0.2 CCCON MCULE-4800172637 [2,0,0,0,0,0|2,0,0]=4 2518 B4R0.2 CCCON MCULE-7988781002 [2,0,0,0,0,0|2,0,0]=4 2519 B4R0.2 CCCSC MCULE-8387041737 [2,0,0,0,0,0|2,0,0]=4 2520 B4R0.2 CCNCC MCULE-3395060353 [2,0,0,0,0,0|2,0,0]=4 2521 B4R0.2 CCNCC MCULE-4374609736 [2,0,0,0,0,0|2,0,0]=4 2522 B4R0.2 CCNCC MCULE-4555901025 [2,0,0,0,0,0|2,0,0]=4 2523 B4R0.2 CCNCC MCULE-6895602113 [2,0,0,0,0,0|2,0,0]=4 2524 B4R0.2 CCOCBr MCULE-6644755987 [2,0,0,0,0,0|2,0,0]=4 2525 B4R0.2 CCOCC MCULE-5665709021 [2,0,0,0,0,0|2,0,0]=4 2526 B4R0.2 CCOCCl MCULE-5087992840 [2,0,0,0,0,0|2,0,0]=4 2527 B4R0.2 CCSCC MCULE-6480710239 [2,0,0,0,0,0|2,0,0]=4 2528 B4R0.2 CCSCCl MCULE-3890542152 [2,0,0,0,0,0|2,0,0]=4 2529 B4R0.2 CC[NH2+]CC MCULE-9899430356 [2,0,0,0,0,0|2,0,0]=4 2530 B4R0.2 CNCCBr MCULE-3708780806 [2,0,0,0,0,0|2,0,0]=4 2531 B4R0.2 CNCCBr MCULE-6840755559 [2,0,0,0,0,0|2,0,0]=4 2532 B4R0.2 CNCCCl MCULE-1666345560 [2,0,0,0,0,0|2,0,0]=4 2533 B4R0.2 CNCCCl MCULE-8215813413 [2,0,0,0,0,0|2,0,0]=4 2534 B4R0.2 CNCCF MCULE-3719880423 [2,0,0,0,0,0|2,0,0]=4 2535 B4R0.2 CNCCF MCULE-3751701745 [2,0,0,0,0,0|2,0,0]=4 2536 B4R0.2 CNCCI MCULE-7026781832 [2,0,0,0,0,0|2,0,0]=4 2537 B4R0.2 CNCCI MCULE-8892686580 [2,0,0,0,0,0|2,0,0]=4 2538 B4R0.2 CNCCN MCULE-2881688448 [2,0,0,0,0,0|2,0,0]=4 2539 B4R0.2 CNCCN MCULE-7199403269 [2,0,0,0,0,0|2,0,0]=4 2540 B4R0.2 CNCCO MCULE-7051900771 [2,0,0,0,0,0|1,0,0]=3 2541 B4R0.2 CNCCO MCULE-7934732981 [2,0,0,0,0,0|1,0,0]=3 2542 B4R0.2 CNCCS MCULE-6430516369 [2,0,0,0,0,0|1,1,0]=4 2543 B4R0.2 COCCBr MCULE-8316331262 [2,0,0,0,0,0|2,0,0]=4 2544 B4R0.2 COCCCl MCULE-8886627413 [2,0,0,0,0,0|2,0,0]=4 2545 B4R0.2 COCCI MCULE-9391124374 [2,0,0,0,0,0|2,0,0]=4 2546 B4R0.2 COCCN MCULE-5051556646 [2,0,0,0,0,0|2,0,0]=4 2547 B4R0.2 COCCN MCULE-7519068386 [2,0,0,0,0,0|2,0,0]=4 2548 B4R0.2 COCCO MCULE-4751927883 [2,0,0,0,0,0|1,0,0]=3 2549 B4R0.2 COCCS MCULE-7803276094 [2,0,0,0,0,0|1,1,0]=4 2550 B4R0.2 CSCCBr MCULE-1684461541 [2,0,0,0,0,0|2,0,0]=4 2551 B4R0.2 CSCCCl MCULE-8593103756 [2,0,0,0,0,0|2,0,0]=4 2552 B4R0.2 CSCCN MCULE-5168245255 [2,0,0,0,0,0|2,0,0]=4 2553 B4R0.2 CSCCN MCULE-6275285732 [2,0,0,0,0,0|2,0,0]=4 2554 B4R0.2 CSCCO MCULE-9706874325 [2,0,0,0,0,0|1,0,0]=3 2555 B4R0.2 ClCCCBr MCULE-7937580875 [2,0,0,0,0,0|2,0,0]=4 2556 B4R0.2 ClCCCCl MCULE-6693270397 [2,0,0,0,0,0|2,0,0]=4 2557 B4R0.2 ClCCCI MCULE-1521526833 [2,0,0,0,0,0|2,0,0]=4 2558 B4R0.2 FCCCBr MCULE-5674735753 [2,0,0,0,0,0|2,0,0]=4 2559 B4R0.2 FCCCF MCULE-1803511350 [2,0,0,0,0,0|2,0,0]=4 2560 B4R0.2 FCCCI MCULE-9287814857 [2,0,0,0,0,0|2,0,0]=4 2561 B4R0.2 ICCCI MCULE-9849754168 [2,0,0,0,0,0|2,0,0]=4 2562 B4R0.2 N#CCCO MCULE-5098987368 [2,0,0,0,0,0|1,0,1]=4 2563 B4R0.2 NCCCBr MCULE-5485748003 [2,0,0,0,0,0|2,0,0]=4 2564 B4R0.2 NCCCBr MCULE-7072709972 [2,0,0,0,0,0|2,0,0]=4 2565 B4R0.2 NCCCCl MCULE-1324157004 [2,0,0,0,0,0|2,0,0]=4 2566 B4R0.2 NCCCCl MCULE-3667248190 [2,0,0,0,0,0|2,0,0]=4 2567 B4R0.2 NCCCF MCULE-5215746973 [2,0,0,0,0,0|2,0,0]=4 2568 B4R0.2 NCCCF MCULE-8077133369 [2,0,0,0,0,0|2,0,0]=4 2569 B4R0.2 NCCCI MCULE-3534892097 [2,0,0,0,0,0|2,0,0]=4 2570 B4R0.2 NCCCI MCULE-8010453546 [2,0,0,0,0,0|2,0,0]=4 2571 B4R0.2 NCCCN MCULE-4293255820 [2,0,0,0,0,0|2,0,0]=4 2572 B4R0.2 NCCCN MCULE-5041378433 [2,0,0,0,0,0|2,0,0]=4 2573 B4R0.2 NCCCN MCULE-6944452060 [2,0,0,0,0,0|2,0,0]=4 2574 B4R0.2 NCCCN MCULE-7375662153 [2,0,0,0,0,0|2,0,0]=4 2575 B4R0.2 NCCCN MCULE-8277465929 [2,0,0,0,0,0|2,0,0]=4 2576 B4R0.2 NCCCN MCULE-9929373126 [2,0,0,0,0,0|2,0,0]=4 2577 B4R0.2 NCCCO MCULE-2851278356 [2,0,0,0,0,0|1,0,0]=3 2578 B4R0.2 NCCCO MCULE-9698089092 [2,0,0,0,0,0|1,0,0]=3 2579 B4R0.2 NCCCS MCULE-3994478020 [2,0,0,0,0,0|1,1,0]=4 2580 B4R0.2 NCCCS MCULE-7730973866 [2,0,0,0,0,0|1,1,0]=4 2581 B4R0.2 NNCCO MCULE-1290652744 [2,0,0,0,0,0|2,0,0]=4 2582 B4R0.2 NOCCO MCULE-2545004367 [2,0,0,0,0,0|2,0,0]=4 2583 B4R0.2 O=CCCO MCULE-1685289763 [2,0,0,0,0,0|0,0,2]=4 2584 B4R0.2 OCCCBr MCULE-3450011527 [2,0,0,0,0,0|1,0,0]=3 2585 B4R0.2 OCCCCl MCULE-2319230957 [2,0,0,0,0,0|1,0,0]=3 2586 B4R0.2 OCCCF MCULE-2347934403 [2,0,0,0,0,0|1,0,0]=3 2587 B4R0.2 OCCCI MCULE-5200713967 [2,0,0,0,0,0|1,0,0]=3 2588 B4R0.2 OCCCO MCULE-5166824786 [2,0,0,0,0,0|0,0,0]=2 2589 B4R0.2 OCCCS MCULE-7930164048 [2,0,0,0,0,0|0,1,0]=3 2590 B4R0.2 PCCCP MCULE-6048146071 [2,0,0,0,0,0|2,0,0]=4 2591 B4R0.2 SCCCBr MCULE-4627341228 [2,0,0,0,0,0|1,1,0]=4 2592 B4R0.2 SCCCCl MCULE-6410389127 [2,0,0,0,0,0|1,1,0]=4 2593 B4R0.2 SCCCS MCULE-8220630729 [2,0,0,0,0,0|0,2,0]=4 2594 B4R0.2 [NH2+](CC)CC MCULE-1192179232 [2,0,0,0,0,0|2,0,0]=4 2595 B6R0.1 C#CC(O)CCC MCULE-6152066005 [1,1,0,0,0,0|1,0,1]=4 2596 B6R0.1 C#CCC(C)CO MCULE-6139260605 [1,1,0,0,0,0|1,0,1]=4 2597 B6R0.1 C#CCC(O)CC MCULE-8783941008 [1,1,0,0,0,0|1,0,1]=4 2598 B6R0.1 C=C(CC)CCO MCULE-5317656776 [1,1,0,0,0,0|1,0,1]=4 2599 B6R0.1 C=CC(C)CCC MCULE-2692803387 [1,1,0,0,0,0|2,0,0]=4 2600 B6R0.1 C=CC(C)CCO MCULE-2890369298 [1,1,0,0,0,0|1,0,0]=3 2601 B6R0.1 C=CC(N)CCO MCULE-7781906138 [1,1,0,0,0,0|1,0,1]=4 2602 B6R0.1 C=CC(O)CCC MCULE-3664453040 [1,1,0,0,0,0|1,0,1]=4 2603 B6R0.1 C=CC(O)CCN MCULE-9346205308 [1,1,0,0,0,0|1,0,1]=4 2604 B6R0.1 C=CCC(C)CO MCULE-9174943108 [1,1,0,0,0,0|1,0,1]=4 2605 B6R0.1 C=CCC(O)CC MCULE-1497539816 [1,1,0,0,0,0|1,0,1]=4 2606 B6R0.1 C=CCC(O)CN MCULE-8237489732 [1,1,0,0,0,0|1,0,1]=4 2607 B6R0.1 C=CC[C@@H](O)CC MCULE-3259102701 [1,1,0,0,0,0|1,0,1]=4 2608 B6R0.1 C=CC[C@H](O)CC MCULE-6527977219 [1,1,0,0,0,0|1,0,1]=4 2609 B6R0.1 CC(CN)CCN MCULE-2719332037 [1,1,0,0,0,0|2,0,0]=4 2610 B6R0.1 CC(CN)CCN MCULE-4200375624 [1,1,0,0,0,0|2,0,0]=4 2611 B6R0.1 CC(CN)CCO MCULE-5515163518 [1,1,0,0,0,0|1,0,0]=3 2612 B6R0.1 CC(CO)CCN MCULE-9900244005 [1,1,0,0,0,0|1,0,0]=3 2613 B6R0.1 CC(CO)CCO MCULE-5240961149 [1,1,0,0,0,0|0,0,0]=2 2614 B6R0.1 CC(CO)CCO MCULE-8678967805 [1,1,0,0,0,0|0,0,0]=2 2615 B6R0.1 CCC(C)CCBr MCULE-6033010731 [1,1,0,0,0,0|2,0,0]=4 2616 B6R0.1 CCC(C)CCCl MCULE-2069721626 [1,1,0,0,0,0|2,0,0]=4 2617 B6R0.1 CCC(C)CCN MCULE-4140800594 [1,1,0,0,0,0|2,0,0]=4 2618 B6R0.1 CCC(C)CCN MCULE-5509248218 [1,1,0,0,0,0|2,0,0]=4 2619 B6R0.1 CCC(C)CCO MCULE-6482427735 [1,1,0,0,0,0|1,0,0]=3 2620 B6R0.1 CCC(N)CCN MCULE-8956610037 [1,1,0,0,0,0|2,0,0]=4 2621 B6R0.1 CCC(N)CCO MCULE-1511155206 [1,1,0,0,0,0|1,0,0]=3 2622 B6R0.1 CCC(N)CCO MCULE-5525302643 [1,1,0,0,0,0|1,0,0]=3 2623 B6R0.1 CCC(O)CC#N MCULE-2542710031 [1,1,0,0,0,0|1,0,1]=4 2624 B6R0.1 CCC(O)CCN MCULE-5387303971 [1,1,0,0,0,0|1,0,0]=3 2625 B6R0.1 CCC(O)CCO MCULE-5156075792 [1,1,0,0,0,0|0,0,0]=2 2626 B6R0.1 CCC(O)CNC MCULE-2490431367 [1,1,0,0,0,0|2,0,0]=4 2627 B6R0.1 CCC(O)CNN MCULE-1038166714 [1,1,0,0,0,0|2,0,0]=4 2628 B6R0.1 CCC(O)CNN MCULE-6391104058 [1,1,0,0,0,0|2,0,0]=4 2629 B6R0.1 CCC(O)COC MCULE-6751000060 [1,1,0,0,0,0|2,0,0]=4 2630 B6R0.1 CCC(O)CSC MCULE-3582683720 [1,1,0,0,0,0|2,0,0]=4 2631 B6R0.1 CCC(S)CCO MCULE-4193788852 [1,1,0,0,0,0|0,1,0]=3 2632 B6R0.1 CCCC(=NO)C MCULE-6437787263 [1,1,0,0,0,0|1,0,1]=4 2633 B6R0.1 CCCC(Br)CC MCULE-9116433502 [1,1,0,0,0,0|2,0,0]=4 2634 B6R0.1 CCCC(C)C#N MCULE-2492294131 [1,1,0,0,0,0|2,0,0]=4 2635 B6R0.1 CCCC(C)C=O MCULE-9756444218 [1,1,0,0,0,0|1,0,1]=4 2636 B6R0.1 CCCC(C)CBr MCULE-3437352091 [1,1,0,0,0,0|2,0,0]=4 2637 B6R0.1 CCCC(C)CC MCULE-7082933967 [1,1,0,0,0,0|2,0,0]=4 2638 B6R0.1 CCCC(C)CCl MCULE-2381010454 [1,1,0,0,0,0|2,0,0]=4 2639 B6R0.1 CCCC(C)CN MCULE-9552289739 [1,1,0,0,0,0|2,0,0]=4 2640 B6R0.1 CCCC(C)CO MCULE-9777250826 [1,1,0,0,0,0|1,0,0]=3 2641 B6R0.1 CCCC(C)NC MCULE-1560121168 [1,1,0,0,0,0|2,0,0]=4 2642 B6R0.1 CCCC(C)NC MCULE-2169396338 [1,1,0,0,0,0|2,0,0]=4 2643 B6R0.1 CCCC(Cl)CC MCULE-1581617529 [1,1,0,0,0,0|2,0,0]=4 2644 B6R0.1 CCCC(Cl)CCl MCULE-9464139069 [1,1,0,0,0,0|2,0,0]=4 2645 B6R0.1 CCCC(N)CC MCULE-5349906741 [1,1,0,0,0,0|2,0,0]=4 2646 B6R0.1 CCCC(N)CC MCULE-7172418373 [1,1,0,0,0,0|2,0,0]=4 2647 B6R0.1 CCCC(N)CN MCULE-8606218569 [1,1,0,0,0,0|2,0,0]=4 2648 B6R0.1 CCCC(N)CO MCULE-3404967504 [1,1,0,0,0,0|2,0,0]=4 2649 B6R0.1 CCCC(N)CO MCULE-3802448518 [1,1,0,0,0,0|2,0,0]=4 2650 B6R0.1 CCCC(N)CO MCULE-4259078445 [1,1,0,0,0,0|2,0,0]=4 2651 B6R0.1 CCCC(N)CO MCULE-6425025734 [1,1,0,0,0,0|2,0,0]=4 2652 B6R0.1 CCCC(O)C#N MCULE-7017059503 [1,1,0,0,0,0|1,0,1]=4 2653 B6R0.1 CCCC(O)CBr MCULE-5186252424 [1,1,0,0,0,0|1,0,0]=3 2654 B6R0.1 CCCC(O)CC MCULE-9504041935 [1,1,0,0,0,0|1,0,0]=3 2655 B6R0.1 CCCC(O)CCl MCULE-4737360217 [1,1,0,0,0,0|1,0,0]=3 2656 B6R0.1 CCCC(O)CN MCULE-9402934997 [1,1,0,0,0,0|1,0,0]=3 2657 B6R0.1 CCCC(O)CO MCULE-5124107719 [1,1,0,0,0,0|1,0,0]=3 2658 B6R0.1 CCCC(S)CC MCULE-1322481338 [1,1,0,0,0,0|1,1,0]=4 2659 B6R0.1 CCC[C@@H](N)CF MCULE-4702552251 [1,1,0,0,0,0|2,0,0]=4 2660 B6R0.1 CCC[C@@H](N)CF MCULE-8118043624 [1,1,0,0,0,0|2,0,0]=4 2661 B6R0.1 CCC[C@@H](N)CO MCULE-3684308356 [1,1,0,0,0,0|2,0,0]=4 2662 B6R0.1 CCC[C@@H](N)CO MCULE-4573401915 [1,1,0,0,0,0|2,0,0]=4 2663 B6R0.1 CCC[C@@H](N)CO MCULE-5502830670 [1,1,0,0,0,0|2,0,0]=4 2664 B6R0.1 CCC[C@@H](O)CC MCULE-7377135785 [1,1,0,0,0,0|1,0,0]=3 2665 B6R0.1 CCC[C@H](N)CF MCULE-7192744944 [1,1,0,0,0,0|2,0,0]=4 2666 B6R0.1 CCC[C@H](N)CF MCULE-7441387613 [1,1,0,0,0,0|2,0,0]=4 2667 B6R0.1 CCC[C@H](N)CO MCULE-4293730307 [1,1,0,0,0,0|2,0,0]=4 2668 B6R0.1 CCC[C@H](N)CO MCULE-5185063577 [1,1,0,0,0,0|2,0,0]=4 2669 B6R0.1 CCC[C@H](N)CO MCULE-5836622975 [1,1,0,0,0,0|2,0,0]=4 2670 B6R0.1 CCC[C@H](N)CO MCULE-7340014196 [1,1,0,0,0,0|2,0,0]=4 2671 B6R0.1 CCC[C@H](O)CC MCULE-2229025348 [1,1,0,0,0,0|1,0,0]=3 2672 B6R0.1 CCN(C)CCO MCULE-5519271145 [1,1,0,0,0,0|2,0,0]=4 2673 B6R0.1 CCN(N)CCO MCULE-7988723724 [1,1,0,0,0,0|2,0,0]=4 2674 B6R0.1 CCNC(C)CO MCULE-4344397973 [1,1,0,0,0,0|2,0,0]=4 2675 B6R0.1 CCN[C@@H](C)CO MCULE-5648721449 [1,1,0,0,0,0|2,0,0]=4 2676 B6R0.1 CCN[C@H](C)CO MCULE-8047465405 [1,1,0,0,0,0|2,0,0]=4 2677 B6R0.1 CCOC(C)CO MCULE-1592146913 [1,1,0,0,0,0|2,0,0]=4 2678 B6R0.1 CCS(=O)CCO MCULE-8290368918 [1,1,0,0,0,0|1,0,1]=4 2679 B6R0.1 CC[C@@H](O)CC#N MCULE-5921416613 [1,1,0,0,0,0|1,0,1]=4 2680 B6R0.1 CC[C@@H](O)CC#N MCULE-8527710778 [1,1,0,0,0,0|1,0,1]=4 2681 B6R0.1 CC[C@H](C)CCO MCULE-1190203828 [1,1,0,0,0,0|1,0,0]=3 2682 B6R0.1 CC[C@H](C)CCO MCULE-8460710173 [1,1,0,0,0,0|1,0,0]=3 2683 B6R0.1 CN(C=O)CCO MCULE-3588371476 [1,1,0,0,0,0|1,0,1]=4 2684 B6R0.1 CN(CCO)N=O MCULE-3975606321 [1,1,0,0,0,0|1,0,1]=4 2685 B6R0.1 CNC(=O)CCO MCULE-3222339741 [1,1,0,0,0,0|0,0,2]=4 2686 B6R0.1 CNC(C)CCO MCULE-4722422254 [1,1,0,0,0,0|1,0,0]=3 2687 B6R0.1 CNCC(C)CO MCULE-6329429747 [1,1,0,0,0,0|2,0,0]=4 2688 B6R0.1 CNCC(C)OC MCULE-6977139114 [1,1,0,0,0,0|2,0,0]=4 2689 B6R0.1 CNCC(C)OC MCULE-8216810034 [1,1,0,0,0,0|2,0,0]=4 2690 B6R0.1 CNCC(O)CF MCULE-3368370486 [1,1,0,0,0,0|2,0,0]=4 2691 B6R0.1 CNCC(O)CN MCULE-1077260629 [1,1,0,0,0,0|2,0,0]=4 2692 B6R0.1 CNCC(O)CO MCULE-4566952448 [1,1,0,0,0,0|2,0,0]=4 2693 B6R0.1 CNC[C@H](O)CO MCULE-3410453252 [1,1,0,0,0,0|2,0,0]=4 2694 B6R0.1 COC(=N)CCO MCULE-1904978557 [1,1,0,0,0,0|1,0,1]=4 2695 B6R0.1 COC(=N)CCO MCULE-8146089973 [1,1,0,0,0,0|1,0,1]=4 2696 B6R0.1 COC(=O)CCO MCULE-8538834260 [1,1,0,0,0,0|0,0,2]=4 2697 B6R0.1 COC(C)CC=O MCULE-7243333697 [1,1,0,0,0,0|0,0,2]=4 2698 B6R0.1 COC(C)CCN MCULE-8081876282 [1,1,0,0,0,0|1,0,0]=3 2699 B6R0.1 COC(C)CCN MCULE-8892057529 [1,1,0,0,0,0|1,0,0]=3 2700 B6R0.1 COC(C)CCO MCULE-7396381165 [1,1,0,0,0,0|0,0,0]=2 2701 B6R0.1 COCC(C)CO MCULE-7663064542 [1,1,0,0,0,0|2,0,0]=4 2702 B6R0.1 COCC(C)OC MCULE-1583498700 [1,1,0,0,0,0|2,0,0]=4 2703 B6R0.1 COCC(O)CBr MCULE-6900294714 [1,1,0,0,0,0|2,0,0]=4 2704 B6R0.1 COCC(O)CCl MCULE-9314630227 [1,1,0,0,0,0|2,0,0]=4 2705 B6R0.1 COCC(O)CF MCULE-1938415887 [1,1,0,0,0,0|2,0,0]=4 2706 B6R0.1 COCC(O)CN MCULE-2044547388 [1,1,0,0,0,0|2,0,0]=4 2707 B6R0.1 COCC(O)CN MCULE-2145726384 [1,1,0,0,0,0|2,0,0]=4 2708 B6R0.1 COCC(O)CN MCULE-3637597204 [1,1,0,0,0,0|2,0,0]=4 2709 B6R0.1 COCC(O)CO MCULE-1154104224 [1,1,0,0,0,0|2,0,0]=4 2710 B6R0.1 COC[C@@H](O)CN MCULE-2116679841 [1,1,0,0,0,0|2,0,0]=4 2711 B6R0.1 COC[C@@H](O)CN MCULE-4198842123 [1,1,0,0,0,0|2,0,0]=4 2712 B6R0.1 COC[C@@H](O)CN MCULE-6330998296 [1,1,0,0,0,0|2,0,0]=4 2713 B6R0.1 COC[C@H](C)CO MCULE-3120475252 [1,1,0,0,0,0|2,0,0]=4 2714 B6R0.1 COC[C@H](O)CN MCULE-1962346446 [1,1,0,0,0,0|2,0,0]=4 2715 B6R0.1 COC[C@H](O)CN MCULE-6290984425 [1,1,0,0,0,0|2,0,0]=4 2716 B6R0.1 CON(C)CCN MCULE-9318319159 [1,1,0,0,0,0|2,0,0]=4 2717 B6R0.1 CSC(C)CCN MCULE-5474458753 [1,1,0,0,0,0|1,1,0]=4 2718 B6R0.1 CSC(C)CCO MCULE-4317600086 [1,1,0,0,0,0|0,1,0]=3 2719 B6R0.1 CSCC(C)CO MCULE-3842820579 [1,1,0,0,0,0|2,0,0]=4 2720 B6R0.1 CSCC(O)CO MCULE-6573013078 [1,1,0,0,0,0|2,0,0]=4 2721 B6R0.1 C[C@@H](CO)CCN MCULE-4422620011 [1,1,0,0,0,0|1,0,0]=3 2722 B6R0.1 C[C@@H](CO)CCN MCULE-7560169391 [1,1,0,0,0,0|1,0,0]=3 2723 B6R0.1 C[C@@H](CO)CCO MCULE-6545491289 [1,1,0,0,0,0|0,0,0]=2 2724 B6R0.1 C[C@H](CO)CCO MCULE-2543010074 [1,1,0,0,0,0|0,0,0]=2 2725 B6R0.1 C[C@H](CO)CCO MCULE-6036462418 [1,1,0,0,0,0|0,0,0]=2 2726 B6R0.1 ClCC(Cl)CCBr MCULE-2469656567 [1,1,0,0,0,0|2,0,0]=4 2727 B6R0.1 FC(CBr)CCBr MCULE-2311323533 [1,1,0,0,0,0|2,0,0]=4 2728 B6R0.1 N#CCC(O)CCl MCULE-8450875181 [1,1,0,0,0,0|1,0,1]=4 2729 B6R0.1 N#CCC(O)CCl MCULE-8948452380 [1,1,0,0,0,0|1,0,1]=4 2730 B6R0.1 N#CC[C@@H](O)CCl MCULE-6554781206 [1,1,0,0,0,0|1,0,1]=4 2731 B6R0.1 N#CC[C@@H](O)CCl MCULE-7510135915 [1,1,0,0,0,0|1,0,1]=4 2732 B6R0.1 N#CC[C@H](O)CCl MCULE-4155359829 [1,1,0,0,0,0|1,0,1]=4 2733 B6R0.1 N#CC[C@H](O)CCl MCULE-9172368545 [1,1,0,0,0,0|1,0,1]=4 2734 B6R0.1 N/C(=N\O)/CCO MCULE-1794050637 [1,1,0,0,0,0|1,0,1]=4 2735 B6R0.1 NC(CO)CCF MCULE-3691993352 [1,1,0,0,0,0|2,0,0]=4 2736 B6R0.1 NC(CO)CCO MCULE-3703088648 [1,1,0,0,0,0|1,0,0]=3 2737 B6R0.1 NC(CO)CCO MCULE-7609576462 [1,1,0,0,0,0|1,0,0]=3 2738 B6R0.1 NCC(N)CCO MCULE-2965554481 [1,1,0,0,0,0|1,0,0]=3 2739 B6R0.1 NCCC(F)CN MCULE-9478589176 [1,1,0,0,0,0|2,0,0]=4 2740 B6R0.1 NCCC(O)CN MCULE-9177974477 [1,1,0,0,0,0|1,0,0]=3 2741 B6R0.1 NCCC(O)CO MCULE-2556586168 [1,1,0,0,0,0|1,0,0]=3 2742 B6R0.1 N[C@@H](CO)CCO MCULE-4583236919 [1,1,0,0,0,0|1,0,0]=3 2743 B6R0.1 N[C@@H](CO)CCO MCULE-5489716742 [1,1,0,0,0,0|1,0,0]=3 2744 B6R0.1 N[C@H](CO)CCO MCULE-5338659573 [1,1,0,0,0,0|1,0,0]=3 2745 B6R0.1 N[C@H](CO)CCO MCULE-8998003003 [1,1,0,0,0,0|1,0,0]=3 2746 B6R0.1 N[C@H](CS)CCS MCULE-5846021725 [1,1,0,0,0,0|1,1,0]=4 2747 B6R0.1 N[C@H](CS)CCS MCULE-6871313350 [1,1,0,0,0,0|1,1,0]=4 2748 B6R0.1 N[C@H](CS)CCS MCULE-8095554848 [1,1,0,0,0,0|1,1,0]=4 2749 B6R0.1 N[C@H](CS)CCS MCULE-8177349504 [1,1,0,0,0,0|1,1,0]=4 2750 B6R0.1 O=CC[C@H](O)CCl MCULE-6385696769 [1,1,0,0,0,0|0,0,2]=4 2751 B6R0.1 OC(CBr)CCBr MCULE-5156583342 [1,1,0,0,0,0|1,0,0]=3 2752 B6R0.1 OC(CCl)CCCl MCULE-5495327725 [1,1,0,0,0,0|1,0,0]=3 2753 B6R0.1 OCCC(O)CCl MCULE-4752952606 [1,1,0,0,0,0|0,0,0]=2 2754 B6R0.1 OCCC(O)CO MCULE-6470178852 [1,1,0,0,0,0|0,0,0]=2 2755 B6R0.1 OCC[C@@H](Br)CO MCULE-4859199629 [1,1,0,0,0,0|1,0,0]=3 2756 B6R0.1 OCC[C@@H](O)CO MCULE-2312093276 [1,1,0,0,0,0|0,0,0]=2 2757 B6R0.1 OCC[C@@H](O)CO MCULE-4636748782 [1,1,0,0,0,0|0,0,0]=2 2758 B6R0.1 OCC[C@H](O)CBr MCULE-1990035925 [1,1,0,0,0,0|0,0,0]=2 2759 B6R0.1 OCC[C@H](O)CCl MCULE-4561806159 [1,1,0,0,0,0|0,0,0]=2 2760 B6R0.1 OCC[C@H](O)CCl MCULE-8582759529 [1,1,0,0,0,0|0,0,0]=2 2761 B6R0.1 OCC[C@H](O)CO MCULE-2265914374 [1,1,0,0,0,0|0,0,0]=2 2762 B6R0.1 OCC[C@H](O)CO MCULE-5459838421 [1,1,0,0,0,0|0,0,0]=2 2763 B6R0.1 O[C@@H](CBr)CCBr MCULE-2137750043 [1,1,0,0,0,0|1,0,0]=3 2764 B6R0.1 O[C@H](CBr)CCBr MCULE-2647046297 [1,1,0,0,0,0|1,0,0]=3 2765 B6R0.1 O[C@H](CBr)CCBr MCULE-5662911918 [1,1,0,0,0,0|1,0,0]=3 2766 B6R0.1 [NH3+]CCC(F)C[NH3+] MCULE-8320233584 [1,1,0,0,0,0|2,0,0]=4 2767 B6R0.2 C=C(C)C[C@@H](C)O MCULE-8518319636 [1,1,0,0,0,0|1,0,1]=4 2768 B6R0.2 C=C(C)C[C@H](C)O MCULE-7139115019 [1,1,0,0,0,0|1,0,1]=4 2769 B6R0.2 CC(=O)CC(C)O MCULE-5175367575 [1,1,0,0,0,0|0,0,2]=4 2770 B6R0.2 CC(Br)CC(=O)O MCULE-3353526571 [1,1,0,0,0,0|1,0,1]=4 2771 B6R0.2 CC(Br)CC(C)Br MCULE-1139583334 [1,1,0,0,0,0|2,0,0]=4 2772 B6R0.2 CC(C)CB(O)O MCULE-9748327681 [1,1,0,0,0,0|2,0,0]=4 2773 B6R0.2 CC(C)CC(=O)O MCULE-5805071360 [1,1,0,0,0,0|1,0,1]=4 2774 B6R0.2 CC(C)CC(C)Br MCULE-1549882864 [1,1,0,0,0,0|2,0,0]=4 2775 B6R0.2 CC(C)CC(C)C MCULE-1646863110 [1,1,0,0,0,0|2,0,0]=4 2776 B6R0.2 CC(C)CC(C)I MCULE-6965017338 [1,1,0,0,0,0|2,0,0]=4 2777 B6R0.2 CC(C)CC(C)N MCULE-1144229692 [1,1,0,0,0,0|2,0,0]=4 2778 B6R0.2 CC(C)CC(C)N MCULE-5992377656 [1,1,0,0,0,0|2,0,0]=4 2779 B6R0.2 CC(C)CC(C)O MCULE-9223768698 [1,1,0,0,0,0|1,0,0]=3 2780 B6R0.2 CC(C)C[C@@H](C)N MCULE-5902933285 [1,1,0,0,0,0|2,0,0]=4 2781 B6R0.2 CC(C)C[C@@H](C)N MCULE-7208228535 [1,1,0,0,0,0|2,0,0]=4 2782 B6R0.2 CC(C)C[C@@H](C)O MCULE-3150675602 [1,1,0,0,0,0|1,0,0]=3 2783 B6R0.2 CC(C)C[C@@H](C)O MCULE-4011042896 [1,1,0,0,0,0|1,0,0]=3 2784 B6R0.2 CC(Cl)CC(=O)O MCULE-1436146199 [1,1,0,0,0,0|1,0,1]=4 2785 B6R0.2 CC(F)CC(=O)O MCULE-9214258715 [1,1,0,0,0,0|1,0,1]=4 2786 B6R0.2 CC(N)CC(=O)O MCULE-2960589915 [1,1,0,0,0,0|1,0,1]=4 2787 B6R0.2 CC(N)CC(=O)O MCULE-5772407106 [1,1,0,0,0,0|1,0,1]=4 2788 B6R0.2 CC(N)CC(=O)O MCULE-7818257350 [1,1,0,0,0,0|1,0,1]=4 2789 B6R0.2 CC(N)CC(=O)O MCULE-7847644131 [1,1,0,0,0,0|1,0,1]=4 2790 B6R0.2 CC(N)CC(C)O MCULE-7772080010 [1,1,0,0,0,0|1,0,0]=3 2791 B6R0.2 CC(N)CC(F)F MCULE-9211292557 [1,1,0,0,0,0|2,0,0]=4 2792 B6R0.2 CC(N)CC(F)F MCULE-9693935594 [1,1,0,0,0,0|2,0,0]=4 2793 B6R0.2 CC(O)CC(=O)N MCULE-7442557911 [1,1,0,0,0,0|0,0,2]=4 2794 B6R0.2 CC(O)CC(=O)O MCULE-3566732882 [1,1,0,0,0,0|0,0,1]=3 2795 B6R0.2 CC(O)CC(=O)O MCULE-6537877725 [1,1,0,0,0,0|0,0,1]=3 2796 B6R0.2 CC(O)CC(=O)[O-] MCULE-1109368801 [1,1,0,0,0,0|0,0,2]=4 2797 B6R0.2 CC(O)CC(=O)[O-] MCULE-5681138302 [1,1,0,0,0,0|0,0,2]=4 2798 B6R0.2 CC(O)CC(C)O MCULE-1652556328 [1,1,0,0,0,0|0,0,0]=2 2799 B6R0.2 CC(O)CN(=O)=O MCULE-1592317283 [1,1,0,0,0,0|1,0,1]=4 2800 B6R0.2 CC(O)CN(C)C MCULE-6531222530 [1,1,0,0,0,0|2,0,0]=4 2801 B6R0.2 CC(O)CN(C)C MCULE-7127620454 [1,1,0,0,0,0|2,0,0]=4 2802 B6R0.2 CC(O)CN(C)N MCULE-6197492770 [1,1,0,0,0,0|2,0,0]=4 2803 B6R0.2 CC(O)CS(=O)C MCULE-2365161952 [1,1,0,0,0,0|1,0,1]=4 2804 B6R0.2 C[C@@H](N)CC(=O)O MCULE-2652696372 [1,1,0,0,0,0|1,0,1]=4 2805 B6R0.2 C[C@@H](N)CC(=O)O MCULE-7054489636 [1,1,0,0,0,0|1,0,1]=4 2806 B6R0.2 C[C@@H](N)CC(=O)O MCULE-7621851215 [1,1,0,0,0,0|1,0,1]=4 2807 B6R0.2 C[C@@H](N)CC(=O)O MCULE-8671397640 [1,1,0,0,0,0|1,0,1]=4 2808 B6R0.2 C[C@@H](O)CC(=O)O MCULE-2545577683 [1,1,0,0,0,0|0,0,1]=3 2809 B6R0.2 C[C@@H](O)CC(=O)O MCULE-4159227891 [1,1,0,0,0,0|0,0,1]=3 2810 B6R0.2 C[C@@H](O)CC(=O)[O-] MCULE-7081161048 [1,1,0,0,0,0|0,0,2]=4 2811 B6R0.2 C[C@@H](O)CC(=O)[O-] MCULE-7886150665 [1,1,0,0,0,0|0,0,2]=4 2812 B6R0.2 C[C@@H](O)CN(C)C MCULE-3114172439 [1,1,0,0,0,0|2,0,0]=4 2813 B6R0.2 C[C@@H](O)CN(C)C MCULE-9927679143 [1,1,0,0,0,0|2,0,0]=4 2814 B6R0.2 C[C@@H](O)C[C@@H](C)O MCULE-3504626196 [1,1,0,0,0,0|0,0,0]=2 2815 B6R0.2 C[C@@H](O)C[C@@H](C)O MCULE-4671148975 [1,1,0,0,0,0|0,0,0]=2 2816 B6R0.2 C[C@@H](O)C[C@@H](C)O MCULE-8345849773 [1,1,0,0,0,0|0,0,0]=2 2817 B6R0.2 C[C@H](Br)CC(=O)O MCULE-1601745040 [1,1,0,0,0,0|1,0,1]=4 2818 B6R0.2 C[C@H](Br)CC(=O)O MCULE-2894930407 [1,1,0,0,0,0|1,0,1]=4 2819 B6R0.2 C[C@H](N)CC(=O)O MCULE-2656839691 [1,1,0,0,0,0|1,0,1]=4 2820 B6R0.2 C[C@H](N)CC(=O)O MCULE-4695512293 [1,1,0,0,0,0|1,0,1]=4 2821 B6R0.2 C[C@H](N)CC(=O)O MCULE-5288044169 [1,1,0,0,0,0|1,0,1]=4 2822 B6R0.2 C[C@H](N)CC(=O)O MCULE-6641912058 [1,1,0,0,0,0|1,0,1]=4 2823 B6R0.2 C[C@H](O)CC(=O)O MCULE-2857686566 [1,1,0,0,0,0|0,0,1]=3 2824 B6R0.2 C[C@H](O)CC(=O)O MCULE-3362266278 [1,1,0,0,0,0|0,0,1]=3 2825 B6R0.2 C[C@H](O)CC(=O)[O-] MCULE-3624690550 [1,1,0,0,0,0|0,0,2]=4 2826 B6R0.2 C[C@H](O)CC(=O)[O-] MCULE-5550257128 [1,1,0,0,0,0|0,0,2]=4 2827 B6R0.2 C[C@H](O)CN(C)C MCULE-4542650002 [1,1,0,0,0,0|2,0,0]=4 2828 B6R0.2 C[C@H](O)CN(C)C MCULE-4717676519 [1,1,0,0,0,0|2,0,0]=4 2829 B6R0.2 C[C@H](O)C[C@H](C)O MCULE-1267135444 [1,1,0,0,0,0|0,0,0]=2 2830 B6R0.2 C[C@H](O)C[C@H](C)O MCULE-5878966333 [1,1,0,0,0,0|0,0,0]=2 2831 B6R0.4 C#CCCC(C)C MCULE-9613694830 [1,1,0,0,0,0|2,0,0]=4 2832 B6R0.4 C#CCCC(C)O MCULE-1476308263 [1,1,0,0,0,0|1,0,0]=3 2833 B6R0.4 C=C(C)CCCO MCULE-4629274490 [1,1,0,0,0,0|1,0,1]=4 2834 B6R0.4 C=CCCC(C)Br MCULE-5841356762 [1,1,0,0,0,0|2,0,0]=4 2835 B6R0.4 C=CCCC(C)C MCULE-7128249655 [1,1,0,0,0,0|2,0,0]=4 2836 B6R0.4 C=CCCC(C)O MCULE-3388106789 [1,1,0,0,0,0|1,0,0]=3 2837 B6R0.4 C=CCC[C@@H](C)O MCULE-1272820385 [1,1,0,0,0,0|1,0,0]=3 2838 B6R0.4 C=CCC[C@@H](C)O MCULE-8509867177 [1,1,0,0,0,0|1,0,0]=3 2839 B6R0.4 C=CCC[C@H](C)O MCULE-4371391667 [1,1,0,0,0,0|1,0,0]=3 2840 B6R0.4 CC(=CCCO)C MCULE-2493404466 [1,1,0,0,0,0|1,0,1]=4 2841 B6R0.4 CC(=CCCO)C MCULE-8497528596 [1,1,0,0,0,0|1,0,1]=4 2842 B6R0.4 CC(=O)CCCO MCULE-1335342150 [1,1,0,0,0,0|0,0,2]=4 2843 B6R0.4 CC(=O)NCCO MCULE-5968518415 [1,1,0,0,0,0|0,0,2]=4 2844 B6R0.4 CC(=O)OCCO MCULE-1251660436 [1,1,0,0,0,0|0,0,2]=4 2845 B6R0.4 CC(Br)CCC#N MCULE-7424967519 [1,1,0,0,0,0|2,0,0]=4 2846 B6R0.4 CC(Br)CCCBr MCULE-8808667049 [1,1,0,0,0,0|2,0,0]=4 2847 B6R0.4 CC(C)CCC#N MCULE-5503038837 [1,1,0,0,0,0|2,0,0]=4 2848 B6R0.4 CC(C)CCC=O MCULE-9664145623 [1,1,0,0,0,0|1,0,1]=4 2849 B6R0.4 CC(C)CCCBr MCULE-2045625937 [1,1,0,0,0,0|2,0,0]=4 2850 B6R0.4 CC(C)CCCCl MCULE-4841628592 [1,1,0,0,0,0|2,0,0]=4 2851 B6R0.4 CC(C)CCCI MCULE-4035616717 [1,1,0,0,0,0|2,0,0]=4 2852 B6R0.4 CC(C)CCCN MCULE-2232715676 [1,1,0,0,0,0|2,0,0]=4 2853 B6R0.4 CC(C)CCCN MCULE-7121372197 [1,1,0,0,0,0|2,0,0]=4 2854 B6R0.4 CC(C)CCCO MCULE-5797993948 [1,1,0,0,0,0|1,0,0]=3 2855 B6R0.4 CC(C)CCCS MCULE-8417191578 [1,1,0,0,0,0|1,1,0]=4 2856 B6R0.4 CC(C)CCNN MCULE-1163630283 [1,1,0,0,0,0|2,0,0]=4 2857 B6R0.4 CC(C)CCNN MCULE-2023326468 [1,1,0,0,0,0|2,0,0]=4 2858 B6R0.4 CC(C)CCNN MCULE-4572239737 [1,1,0,0,0,0|2,0,0]=4 2859 B6R0.4 CC(C)CCON MCULE-2653553816 [1,1,0,0,0,0|1,0,0]=3 2860 B6R0.4 CC(C)CCON MCULE-6468395078 [1,1,0,0,0,0|1,0,0]=3 2861 B6R0.4 CC(C)COCCl MCULE-2194640169 [1,1,0,0,0,0|2,0,0]=4 2862 B6R0.4 CC(C)CSCCl MCULE-5218455619 [1,1,0,0,0,0|2,0,0]=4 2863 B6R0.4 CC(C)NCCCl MCULE-1521398137 [1,1,0,0,0,0|2,0,0]=4 2864 B6R0.4 CC(C)NCCCl MCULE-2586914937 [1,1,0,0,0,0|2,0,0]=4 2865 B6R0.4 CC(C)NCCN MCULE-1003086359 [1,1,0,0,0,0|2,0,0]=4 2866 B6R0.4 CC(C)NCCN MCULE-5066931507 [1,1,0,0,0,0|2,0,0]=4 2867 B6R0.4 CC(C)NCCO MCULE-1749029105 [1,1,0,0,0,0|1,0,0]=3 2868 B6R0.4 CC(C)OCCBr MCULE-8869065375 [1,1,0,0,0,0|2,0,0]=4 2869 B6R0.4 CC(C)OCCCl MCULE-3848763715 [1,1,0,0,0,0|2,0,0]=4 2870 B6R0.4 CC(C)OCCI MCULE-8259612531 [1,1,0,0,0,0|2,0,0]=4 2871 B6R0.4 CC(C)OCCN MCULE-6140628944 [1,1,0,0,0,0|2,0,0]=4 2872 B6R0.4 CC(C)OCCN MCULE-7438591135 [1,1,0,0,0,0|2,0,0]=4 2873 B6R0.4 CC(C)OCCN MCULE-7614115649 [1,1,0,0,0,0|2,0,0]=4 2874 B6R0.4 CC(C)OCCO MCULE-8766149613 [1,1,0,0,0,0|1,0,0]=3 2875 B6R0.4 CC(C)SCCCl MCULE-4991548042 [1,1,0,0,0,0|2,0,0]=4 2876 B6R0.4 CC(C)SCCN MCULE-2838203545 [1,1,0,0,0,0|2,0,0]=4 2877 B6R0.4 CC(C)SCCN MCULE-6551225219 [1,1,0,0,0,0|2,0,0]=4 2878 B6R0.4 CC(C)SCCO MCULE-1467015400 [1,1,0,0,0,0|1,0,0]=3 2879 B6R0.4 CC(Cl)CCC#N MCULE-2064174419 [1,1,0,0,0,0|2,0,0]=4 2880 B6R0.4 CC(Cl)CCCCl MCULE-9382073752 [1,1,0,0,0,0|2,0,0]=4 2881 B6R0.4 CC(Cl)CCCO MCULE-2554250532 [1,1,0,0,0,0|1,0,0]=3 2882 B6R0.4 CC(N)CCCN MCULE-4857113826 [1,1,0,0,0,0|2,0,0]=4 2883 B6R0.4 CC(N)CCCN MCULE-4899798325 [1,1,0,0,0,0|2,0,0]=4 2884 B6R0.4 CC(N)CCCO MCULE-6629535696 [1,1,0,0,0,0|1,0,0]=3 2885 B6R0.4 CC(O)CCC#N MCULE-6350143710 [1,1,0,0,0,0|1,0,0]=3 2886 B6R0.4 CC(O)CCCBr MCULE-5477662754 [1,1,0,0,0,0|1,0,0]=3 2887 B6R0.4 CC(O)CCCCl MCULE-6993728810 [1,1,0,0,0,0|1,0,0]=3 2888 B6R0.4 CC(O)CCCN MCULE-3754805134 [1,1,0,0,0,0|1,0,0]=3 2889 B6R0.4 CC(O)CCCO MCULE-6580326052 [1,1,0,0,0,0|0,0,0]=2 2890 B6R0.4 CC(O)CN=N#N MCULE-3020215858 [1,1,0,0,0,0|2,0,0]=4 2891 B6R0.4 CCC#CC(C)O MCULE-6395334377 [1,1,0,0,0,0|1,0,1]=4 2892 B6R0.4 CCCCC(C)Br MCULE-3252474574 [1,1,0,0,0,0|2,0,0]=4 2893 B6R0.4 CCCCC(C)C MCULE-7568461039 [1,1,0,0,0,0|2,0,0]=4 2894 B6R0.4 CCCCC(C)Cl MCULE-4825682003 [1,1,0,0,0,0|2,0,0]=4 2895 B6R0.4 CCCCC(C)N MCULE-5349371506 [1,1,0,0,0,0|2,0,0]=4 2896 B6R0.4 CCCCC(C)N MCULE-6696490028 [1,1,0,0,0,0|2,0,0]=4 2897 B6R0.4 CCCCC(C)O MCULE-6558228722 [1,1,0,0,0,0|1,0,0]=3 2898 B6R0.4 CCCCC(C)S MCULE-4791681848 [1,1,0,0,0,0|1,1,0]=4 2899 B6R0.4 CCCC[C@@H](C)N MCULE-2673058676 [1,1,0,0,0,0|2,0,0]=4 2900 B6R0.4 CCCC[C@@H](C)N MCULE-7666196055 [1,1,0,0,0,0|2,0,0]=4 2901 B6R0.4 CCCC[C@@H](C)O MCULE-3149375333 [1,1,0,0,0,0|1,0,0]=3 2902 B6R0.4 CCCC[C@@H](C)O MCULE-5463481348 [1,1,0,0,0,0|1,0,0]=3 2903 B6R0.4 CCCC[C@H](C)N MCULE-6212068145 [1,1,0,0,0,0|2,0,0]=4 2904 B6R0.4 CCCC[C@H](C)N MCULE-7818513999 [1,1,0,0,0,0|2,0,0]=4 2905 B6R0.4 CCCC[C@H](C)O MCULE-1658952902 [1,1,0,0,0,0|1,0,0]=3 2906 B6R0.4 CCCC[C@H](C)O MCULE-7987243522 [1,1,0,0,0,0|1,0,0]=3 2907 B6R0.4 CCCNC(C)C MCULE-7475023734 [1,1,0,0,0,0|2,0,0]=4 2908 B6R0.4 CCCSC(C)C MCULE-2233656285 [1,1,0,0,0,0|2,0,0]=4 2909 B6R0.4 CCNCC(C)C MCULE-1625905125 [1,1,0,0,0,0|2,0,0]=4 2910 B6R0.4 CCNCC(C)C MCULE-3527739859 [1,1,0,0,0,0|2,0,0]=4 2911 B6R0.4 CCNCC(C)O MCULE-5078068369 [1,1,0,0,0,0|1,0,0]=3 2912 B6R0.4 CCNC[C@@H](C)O MCULE-4291219061 [1,1,0,0,0,0|1,0,0]=3 2913 B6R0.4 CCNC[C@@H](C)O MCULE-8603386701 [1,1,0,0,0,0|1,0,0]=3 2914 B6R0.4 CCNC[C@H](C)O MCULE-7173470231 [1,1,0,0,0,0|1,0,0]=3 2915 B6R0.4 CCNC[C@H](C)O MCULE-9651301254 [1,1,0,0,0,0|1,0,0]=3 2916 B6R0.4 CCOCC(C)C MCULE-7986128672 [1,1,0,0,0,0|2,0,0]=4 2917 B6R0.4 CCOCC(C)N MCULE-8540668261 [1,1,0,0,0,0|2,0,0]=4 2918 B6R0.4 CCOCC(C)N MCULE-8720228996 [1,1,0,0,0,0|2,0,0]=4 2919 B6R0.4 CCOCC(C)O MCULE-6224339526 [1,1,0,0,0,0|1,0,0]=3 2920 B6R0.4 CCOC[C@@H](C)N MCULE-7053460047 [1,1,0,0,0,0|2,0,0]=4 2921 B6R0.4 CCOC[C@@H](C)N MCULE-9865800502 [1,1,0,0,0,0|2,0,0]=4 2922 B6R0.4 CCOC[C@@H](C)O MCULE-9075407512 [1,1,0,0,0,0|1,0,0]=3 2923 B6R0.4 CCOC[C@H](C)N MCULE-2897416804 [1,1,0,0,0,0|2,0,0]=4 2924 B6R0.4 CCOC[C@H](C)N MCULE-6799267946 [1,1,0,0,0,0|2,0,0]=4 2925 B6R0.4 CCSCC(C)N MCULE-3399255190 [1,1,0,0,0,0|2,0,0]=4 2926 B6R0.4 CN(C)CCCO MCULE-7408728427 [1,1,0,0,0,0|2,0,0]=4 2927 B6R0.4 CN(C)CCON MCULE-1981169712 [1,1,0,0,0,0|2,0,0]=4 2928 B6R0.4 CN(C)CCON MCULE-6706970282 [1,1,0,0,0,0|2,0,0]=4 2929 B6R0.4 CNCCC(C)C MCULE-3679914556 [1,1,0,0,0,0|2,0,0]=4 2930 B6R0.4 CNCCC(C)C MCULE-9679972004 [1,1,0,0,0,0|2,0,0]=4 2931 B6R0.4 CNCCC(C)N MCULE-5955505029 [1,1,0,0,0,0|2,0,0]=4 2932 B6R0.4 CNCCC(C)N MCULE-8933967952 [1,1,0,0,0,0|2,0,0]=4 2933 B6R0.4 CNCCC(C)O MCULE-1615526002 [1,1,0,0,0,0|1,0,0]=3 2934 B6R0.4 CNCC[C@@H](C)N MCULE-6024494304 [1,1,0,0,0,0|2,0,0]=4 2935 B6R0.4 CNCC[C@H](C)N MCULE-5449372796 [1,1,0,0,0,0|2,0,0]=4 2936 B6R0.4 CNCC[C@H](C)N MCULE-8157402351 [1,1,0,0,0,0|2,0,0]=4 2937 B6R0.4 COCCC(=O)C MCULE-5939812376 [1,1,0,0,0,0|0,0,2]=4 2938 B6R0.4 COCCC(=O)O MCULE-3436347115 [1,1,0,0,0,0|1,0,1]=4 2939 B6R0.4 COCCC(C)Br MCULE-6529807745 [1,1,0,0,0,0|1,0,0]=3 2940 B6R0.4 COCCC(C)C MCULE-8727768886 [1,1,0,0,0,0|1,0,0]=3 2941 B6R0.4 COCCC(C)N MCULE-6183216923 [1,1,0,0,0,0|1,0,0]=3 2942 B6R0.4 COCCC(C)O MCULE-6536001437 [1,1,0,0,0,0|0,0,0]=2 2943 B6R0.4 COCCN(C)C MCULE-5323166567 [1,1,0,0,0,0|2,0,0]=4 2944 B6R0.4 COCCN(C)N MCULE-9480733049 [1,1,0,0,0,0|2,0,0]=4 2945 B6R0.4 COCC[C@H](C)N MCULE-6163336851 [1,1,0,0,0,0|1,0,0]=3 2946 B6R0.4 COCC[C@H](C)N MCULE-6363449253 [1,1,0,0,0,0|1,0,0]=3 2947 B6R0.4 CSCCC(C)N MCULE-3925048385 [1,1,0,0,0,0|1,1,0]=4 2948 B6R0.4 CSCCC(C)O MCULE-5934844952 [1,1,0,0,0,0|0,1,0]=3 2949 B6R0.4 C[C@@H](N)CCCO MCULE-8313291415 [1,1,0,0,0,0|1,0,0]=3 2950 B6R0.4 C[C@@H](O)CCCO MCULE-1658231016 [1,1,0,0,0,0|0,0,0]=2 2951 B6R0.4 NOCCC(=O)O MCULE-1529492904 [1,1,0,0,0,0|1,0,1]=4 2952 B6R0.4 NOCCC(=O)O MCULE-6297331357 [1,1,0,0,0,0|1,0,1]=4 2953 B6R0.4 O=C(O)CNCO MCULE-4092998319 [1,1,0,0,0,0|1,0,1]=4 2954 B6R0.4 OCCCC(F)F MCULE-2972867290 [1,1,0,0,0,0|2,0,0]=4 2955 B6R0.4 OCCOC(F)F MCULE-6004830165 [1,1,0,0,0,0|2,0,0]=4 2956 B6R0.5 C#CCC(C)(C)O MCULE-6680730908 [1,1,0,0,0,0|1,0,1]=4 2957 B6R0.5 C=CCC(C)(C)O MCULE-3560651758 [1,1,0,0,0,0|1,0,1]=4 2958 B6R0.5 CC(C)(Br)CCBr MCULE-9461856185 [1,1,0,0,0,0|2,0,0]=4 2959 B6R0.5 CC(C)(C)CCBr MCULE-6591692767 [1,1,0,0,0,0|2,0,0]=4 2960 B6R0.5 CC(C)(C)CCCl MCULE-6806888253 [1,1,0,0,0,0|2,0,0]=4 2961 B6R0.5 CC(C)(C)CCI MCULE-5455265220 [1,1,0,0,0,0|2,0,0]=4 2962 B6R0.5 CC(C)(C)CCN MCULE-6905943138 [1,1,0,0,0,0|2,0,0]=4 2963 B6R0.5 CC(C)(C)CCN MCULE-9954564734 [1,1,0,0,0,0|2,0,0]=4 2964 B6R0.5 CC(C)(C)CCO MCULE-3121776589 [1,1,0,0,0,0|1,0,0]=3 2965 B6R0.5 CC(C)(Cl)CCCl MCULE-1702128758 [1,1,0,0,0,0|2,0,0]=4 2966 B6R0.5 CC(C)(F)CCN MCULE-8439738647 [1,1,0,0,0,0|2,0,0]=4 2967 B6R0.5 CC(C)(F)CCN MCULE-9182730805 [1,1,0,0,0,0|2,0,0]=4 2968 B6R0.5 CC(C)(F)CCO MCULE-7157649991 [1,1,0,0,0,0|1,0,0]=3 2969 B6R0.5 CC(C)(I)CCO MCULE-2114317591 [1,1,0,0,0,0|1,0,0]=3 2970 B6R0.5 CC(C)(N)CCN MCULE-3524950958 [1,1,0,0,0,0|2,0,0]=4 2971 B6R0.5 CC(C)(N)CCN MCULE-9689616736 [1,1,0,0,0,0|2,0,0]=4 2972 B6R0.5 CC(C)(N)CCO MCULE-2300724181 [1,1,0,0,0,0|1,0,0]=3 2973 B6R0.5 CC(C)(N)CCO MCULE-7470688556 [1,1,0,0,0,0|1,0,0]=3 2974 B6R0.5 CC(C)(O)CC#N MCULE-9592545749 [1,1,0,0,0,0|1,0,1]=4 2975 B6R0.5 CC(C)(O)CCBr MCULE-5311251278 [1,1,0,0,0,0|1,0,0]=3 2976 B6R0.5 CC(C)(O)CCCl MCULE-2803507835 [1,1,0,0,0,0|1,0,0]=3 2977 B6R0.5 CC(C)(O)CCI MCULE-1822716730 [1,1,0,0,0,0|1,0,0]=3 2978 B6R0.5 CC(C)(O)CCN MCULE-1233177150 [1,1,0,0,0,0|1,0,0]=3 2979 B6R0.5 CC(C)(O)CCO MCULE-4723950851 [1,1,0,0,0,0|0,0,0]=2 2980 B6R0.5 CC(C)(O)CCS MCULE-5161173776 [1,1,0,0,0,0|0,1,0]=3 2981 B6R0.5 CC(C)(O)CNN MCULE-7127432403 [1,1,0,0,0,0|2,0,0]=4 2982 B6R0.5 CC(C)(O)CNN MCULE-8281516711 [1,1,0,0,0,0|2,0,0]=4 2983 B6R0.5 CC(C)(O)CON MCULE-1954965804 [1,1,0,0,0,0|2,0,0]=4 2984 B6R0.5 CC(C)(O)CON MCULE-9916686271 [1,1,0,0,0,0|2,0,0]=4 2985 B6R0.5 CC(C)(S)CCO MCULE-6218278668 [1,1,0,0,0,0|0,1,0]=3 2986 B6R0.5 CC(F)(F)CCBr MCULE-1559219051 [1,1,0,0,0,0|2,0,0]=4 2987 B6R0.5 CC(F)(F)CCN MCULE-2380721562 [1,1,0,0,0,0|2,0,0]=4 2988 B6R0.5 CC(F)(F)CCN MCULE-9299707465 [1,1,0,0,0,0|2,0,0]=4 2989 B6R0.5 CC(F)(F)CCO MCULE-6983720400 [1,1,0,0,0,0|1,0,0]=3 2990 B6R0.5 CCCC(C)(C)C MCULE-2309229328 [1,1,0,0,0,0|2,0,0]=4 2991 B6R0.5 CCCC(C)(C)Cl MCULE-1426018824 [1,1,0,0,0,0|2,0,0]=4 2992 B6R0.5 CCCC(C)(C)N MCULE-2670535144 [1,1,0,0,0,0|2,0,0]=4 2993 B6R0.5 CCCC(C)(C)N MCULE-4533125677 [1,1,0,0,0,0|2,0,0]=4 2994 B6R0.5 CCCC(C)(C)O MCULE-2647276101 [1,1,0,0,0,0|1,0,0]=3 2995 B6R0.5 CNCC(C)(C)O MCULE-8014545354 [1,1,0,0,0,0|2,0,0]=4 2996 B6R0.5 CNCC(C)(C)O MCULE-8693265107 [1,1,0,0,0,0|2,0,0]=4 2997 B6R0.5 COCC(C)(C)O MCULE-2480013758 [1,1,0,0,0,0|2,0,0]=4 2998 B6R0.5 CS(=N)(=O)CCO MCULE-8018746796 [1,1,0,0,0,0|1,0,1]=4 2999 B6R0.5 CS(=O)(=O)CCO MCULE-1589351176 [1,1,0,0,0,0|1,0,1]=4 3000 B6R0.5 C[N+](C)(C)CCO MCULE-3010919014 [1,1,0,0,0,0|2,0,0]=4 3001 B6R0.5 C[N+](C)(C)CCO MCULE-3528185452 [1,1,0,0,0,0|2,0,0]=4 3002 B6R0.5 C[N+](C)(C)CCO MCULE-4172409716 [1,1,0,0,0,0|2,0,0]=4 3003 B6R0.5 C[N+](C)(C)CCO MCULE-7472714268 [1,1,0,0,0,0|2,0,0]=4 3004 B6R0.5 C[N+](C)(C)CCO MCULE-7712564949 [1,1,0,0,0,0|2,0,0]=4 3005 B6R0.5 C[N+](C)(C)CCO MCULE-7734259295 [1,1,0,0,0,0|2,0,0]=4 3006 B6R0.5 C[N+](C)(C)CCO MCULE-8298385594 [1,1,0,0,0,0|2,0,0]=4 3007 B6R0.5 C[Si](C)(C)CCO MCULE-3912098564 [1,1,0,0,0,0|1,1,0]=4 3008 B6R0.5 O=P(O)(O)CCO MCULE-9752100956 [1,1,0,0,0,0|2,0,0]=4 3009 B6R0.5 O=S(=O)(O)CCO MCULE-8075949368 [1,1,0,0,0,0|2,0,0]=4 3010 B6R0.5 OCCC(F)(F)F MCULE-1784497575 [1,1,0,0,0,0|2,0,0]=4 3011 B6R0.8 C#CC(C)(N)CC MCULE-1327940404 [1,1,0,0,0,0|1,0,1]=4 3012 B6R0.8 C#CC(C)(N)CC MCULE-2834355427 [1,1,0,0,0,0|1,0,1]=4 3013 B6R0.8 C#CC(C)(N)CC MCULE-4013726030 [1,1,0,0,0,0|1,0,1]=4 3014 B6R0.8 C#CC(C)(N)CC MCULE-4630359970 [1,1,0,0,0,0|1,0,1]=4 3015 B6R0.8 CC(C)(CN)CO MCULE-5342400231 [1,1,0,0,0,0|2,0,0]=4 3016 B6R0.8 CC(C)(CO)CBr MCULE-5392401561 [1,1,0,0,0,0|2,0,0]=4 3017 B6R0.8 CC(C)(CO)CCl MCULE-4674403441 [1,1,0,0,0,0|2,0,0]=4 3018 B6R0.8 CC(C)(CO)CF MCULE-4462488929 [1,1,0,0,0,0|2,0,0]=4 3019 B6R0.8 CC(C)(CO)CO MCULE-3663555151 [1,1,0,0,0,0|1,0,0]=3 3020 B6R0.8 CC(C)(CO)CS MCULE-2478254611 [1,1,0,0,0,0|1,1,0]=4 3021 B6R0.8 CC(F)(CO)CO MCULE-6086305692 [1,1,0,0,0,0|1,0,0]=3 3022 B6R0.8 CC(N)(C#N)CO MCULE-2492555292 [1,1,0,0,0,0|1,0,1]=4 3023 B6R0.8 CC(N)(CO)CO MCULE-6546409175 [1,1,0,0,0,0|0,0,0]=2 3024 B6R0.8 CC(O)(CN)CO MCULE-2184919268 [1,1,0,0,0,0|2,0,0]=4 3025 B6R0.8 CC(O)(CO)CO MCULE-5281000424 [1,1,0,0,0,0|1,0,0]=3 3026 B6R0.8 CCC(C)(Br)CC MCULE-6306783726 [1,1,0,0,0,0|2,0,0]=4 3027 B6R0.8 CCC(C)(C)CC MCULE-7259470376 [1,1,0,0,0,0|2,0,0]=4 3028 B6R0.8 CCC(C)(C)CN MCULE-2321746087 [1,1,0,0,0,0|2,0,0]=4 3029 B6R0.8 CCC(C)(C)CN MCULE-9058132626 [1,1,0,0,0,0|2,0,0]=4 3030 B6R0.8 CCC(C)(C)CO MCULE-9731698451 [1,1,0,0,0,0|1,0,0]=3 3031 B6R0.8 CCC(C)(Cl)CC MCULE-2958469449 [1,1,0,0,0,0|2,0,0]=4 3032 B6R0.8 CCC(C)(N)C#N MCULE-3668256074 [1,1,0,0,0,0|1,0,1]=4 3033 B6R0.8 CCC(C)(N)C#N MCULE-8050998496 [1,1,0,0,0,0|1,0,1]=4 3034 B6R0.8 CCC(C)(N)CC MCULE-6775882748 [1,1,0,0,0,0|1,0,0]=3 3035 B6R0.8 CCC(C)(N)CC MCULE-8120212652 [1,1,0,0,0,0|1,0,0]=3 3036 B6R0.8 CCC(C)(N)CN MCULE-3477587448 [1,1,0,0,0,0|1,0,0]=3 3037 B6R0.8 CCC(C)(N)CO MCULE-3364837123 [1,1,0,0,0,0|0,0,0]=2 3038 B6R0.8 CCC(C)(N)CO MCULE-6671299764 [1,1,0,0,0,0|0,0,0]=2 3039 B6R0.8 CCC(C)(O)CC MCULE-2300322554 [1,1,0,0,0,0|2,0,0]=4 3040 B6R0.8 CCC(C)(O)CN MCULE-2912898926 [1,1,0,0,0,0|2,0,0]=4 3041 B6R0.8 CCC(C)(O)CO MCULE-7272709587 [1,1,0,0,0,0|1,0,0]=3 3042 B6R0.8 CCC(F)(F)CN MCULE-5083755501 [1,1,0,0,0,0|2,0,0]=4 3043 B6R0.8 CCC(F)(F)CO MCULE-9442155245 [1,1,0,0,0,0|1,0,0]=3 3044 B6R0.8 CNC(C)(C)CO MCULE-6733742999 [1,1,0,0,0,0|2,0,0]=4 3045 B6R0.8 CNC(C)(C)CO MCULE-8497514322 [1,1,0,0,0,0|2,0,0]=4 3046 B6R0.8 COC(C)(C)CO MCULE-2208581417 [1,1,0,0,0,0|2,0,0]=4 3047 B6R0.8 CSC(C)(C)CO MCULE-7955741611 [1,1,0,0,0,0|2,0,0]=4 3048 B6R0.8 C[C@](O)(CO)CBr MCULE-3211170790 [1,1,0,0,0,0|2,0,0]=4 3049 B6R0.8 NCC(F)(F)CO MCULE-1734067533 [1,1,0,0,0,0|2,0,0]=4 3050 B6R0.8 NCC(F)(F)CO MCULE-6456961834 [1,1,0,0,0,0|2,0,0]=4 3051 B6R0.8 OCC(F)(F)CO MCULE-8504062479 [1,1,0,0,0,0|1,0,0]=3 3052 B6R0.9 C#CC(CC)CC MCULE-6184220024 [1,1,0,0,0,0|2,0,0]=4 3053 B6R0.9 C/N=C(/CO)\NC MCULE-6025664069 [1,1,0,0,0,0|1,0,1]=4 3054 B6R0.9 CCC(C#N)CC MCULE-1817171032 [1,1,0,0,0,0|1,0,1]=4 3055 B6R0.9 CCC(C#N)NC MCULE-2518843235 [1,1,0,0,0,0|1,0,1]=4 3056 B6R0.9 CCC(C#N)NC MCULE-9562458353 [1,1,0,0,0,0|1,0,1]=4 3057 B6R0.9 CCC(C=O)CC MCULE-3529464122 [1,1,0,0,0,0|2,0,0]=4 3058 B6R0.9 CCC(CBr)CBr MCULE-6164388407 [1,1,0,0,0,0|2,0,0]=4 3059 B6R0.9 CCC(CBr)OC MCULE-1656817461 [1,1,0,0,0,0|2,0,0]=4 3060 B6R0.9 CCC(CC)CBr MCULE-7035205946 [1,1,0,0,0,0|2,0,0]=4 3061 B6R0.9 CCC(CC)CC MCULE-4259310191 [1,1,0,0,0,0|2,0,0]=4 3062 B6R0.9 CCC(CC)CI MCULE-7444274747 [1,1,0,0,0,0|2,0,0]=4 3063 B6R0.9 CCC(CC)CN MCULE-2344837203 [1,1,0,0,0,0|1,0,0]=3 3064 B6R0.9 CCC(CC)CN MCULE-5753995416 [1,1,0,0,0,0|1,0,0]=3 3065 B6R0.9 CCC(CC)CO MCULE-8799293985 [1,1,0,0,0,0|1,0,0]=3 3066 B6R0.9 CCC(CC)NC MCULE-5581389070 [1,1,0,0,0,0|1,0,0]=3 3067 B6R0.9 CCC(CC)NC MCULE-9713693117 [1,1,0,0,0,0|1,0,0]=3 3068 B6R0.9 CCC(CC)NN MCULE-2238567966 [1,1,0,0,0,0|1,0,0]=3 3069 B6R0.9 CCC(CC)NN MCULE-6799511276 [1,1,0,0,0,0|1,0,0]=3 3070 B6R0.9 CCC(CC)NN MCULE-7243313185 [1,1,0,0,0,0|1,0,0]=3 3071 B6R0.9 CCC(CN)CN MCULE-8523664234 [1,1,0,0,0,0|1,0,0]=3 3072 B6R0.9 CCC(CN)CO MCULE-5933181303 [1,1,0,0,0,0|0,0,0]=2 3073 B6R0.9 CCC(CN)OC MCULE-2981477258 [1,1,0,0,0,0|2,0,0]=4 3074 B6R0.9 CCC(CN)OC MCULE-5102774189 [1,1,0,0,0,0|2,0,0]=4 3075 B6R0.9 CCC(CO)CO MCULE-5204077076 [1,1,0,0,0,0|1,0,0]=3 3076 B6R0.9 CCC(CO)NC MCULE-4151180539 [1,1,0,0,0,0|0,0,0]=2 3077 B6R0.9 CCC(CO)OC MCULE-3822452142 [1,1,0,0,0,0|1,0,0]=3 3078 B6R0.9 CCN(CC)CO MCULE-9782453115 [1,1,0,0,0,0|2,0,0]=4 3079 B6R0.9 CC[C@@H](CO)NC MCULE-6281808613 [1,1,0,0,0,0|0,0,0]=2 3080 B6R0.9 CNC(CN)CO MCULE-7006149115 [1,1,0,0,0,0|1,0,0]=3 3081 B6R0.9 CNC(CO)CO MCULE-9323859576 [1,1,0,0,0,0|0,0,0]=2 3082 B6R0.9 COC(CN)CN MCULE-3870266689 [1,1,0,0,0,0|2,0,0]=4 3083 B6R0.9 COC(CN)CO MCULE-2486586573 [1,1,0,0,0,0|1,0,0]=3 3084 B6R0.9 COC(CN)CO MCULE-3908535917 [1,1,0,0,0,0|1,0,0]=3 3085 B6R0.9 COC(CO)CBr MCULE-4957036064 [1,1,0,0,0,0|2,0,0]=4 3086 B6R0.9 COC(CO)CO MCULE-4778743592 [1,1,0,0,0,0|1,0,0]=3 3087 B6R0.9 COC(CO)OC MCULE-1980066235 [1,1,0,0,0,0|2,0,0]=4 3088 B6R0.9 CO[C@H](CN)CO MCULE-6065862053 [1,1,0,0,0,0|1,0,0]=3 3089 B6R0.9 OCC(=NO)CO MCULE-1131100831 [1,1,0,0,0,0|0,0,2]=4 3090 B6R0.9 OCC(CBr)CBr MCULE-4153091765 [1,1,0,0,0,0|2,0,0]=4 3091 B6R0.9 OCC(CO)CO MCULE-7640074192 [1,1,0,0,0,0|1,0,0]=3 3092 B6R0.9 OCP(CO)CO MCULE-9792692156 [1,1,0,0,0,0|2,0,0]=4 3093 B6R0.7 CC(=O)C(C)(C)N MCULE-8236547032 [1,1,0,0,0,0|0,0,2]=4 3094 B6R0.7 CC(=O)C(C)(C)N MCULE-9736681939 [1,1,0,0,0,0|0,0,2]=4 3095 B6R0.7 CC(=O)C(C)(C)O MCULE-1535627387 [1,1,0,0,0,0|1,0,1]=4 3096 B6R0.7 CC(Br)C(C)(Br)Br MCULE-8291248982 [1,1,0,0,0,0|2,0,0]=4 3097 B6R0.7 CC(Br)C(C)(C)O MCULE-8852960455 [1,1,0,0,0,0|1,0,0]=3 3098 B6R0.7 CC(C)(N)C(=O)O MCULE-4254251799 [1,1,0,0,0,0|1,0,1]=4 3099 B6R0.7 CC(C)(N)C(=O)O MCULE-6175880842 [1,1,0,0,0,0|1,0,1]=4 3100 B6R0.7 CC(C)(N)C(F)F MCULE-3533657881 [1,1,0,0,0,0|2,0,0]=4 3101 B6R0.7 CC(C)(N)C(F)F MCULE-6482627990 [1,1,0,0,0,0|2,0,0]=4 3102 B6R0.7 CC(C)(O)C(=N)N MCULE-4499579707 [1,1,0,0,0,0|1,0,1]=4 3103 B6R0.7 CC(C)(O)C(=N)N MCULE-5382519131 [1,1,0,0,0,0|1,0,1]=4 3104 B6R0.7 CC(C)(O)C(=O)N MCULE-9151369011 [1,1,0,0,0,0|0,0,2]=4 3105 B6R0.7 CC(C)(O)C(=O)O MCULE-4093617756 [1,1,0,0,0,0|1,0,1]=4 3106 B6R0.7 CC(C)(O)C(F)F MCULE-8985905844 [1,1,0,0,0,0|2,0,0]=4 3107 B6R0.7 CC(C)C(C)(C)C MCULE-1812497972 [1,1,0,0,0,0|2,0,0]=4 3108 B6R0.7 CC(C)C(C)(C)Cl MCULE-8433683576 [1,1,0,0,0,0|2,0,0]=4 3109 B6R0.7 CC(C)C(C)(C)N MCULE-1087702564 [1,1,0,0,0,0|1,0,0]=3 3110 B6R0.7 CC(C)C(C)(C)N MCULE-7970243446 [1,1,0,0,0,0|1,0,0]=3 3111 B6R0.7 CC(C)C(C)(C)N MCULE-9070308251 [1,1,0,0,0,0|1,0,0]=3 3112 B6R0.7 CC(C)C(C)(C)N MCULE-9504763687 [1,1,0,0,0,0|1,0,0]=3 3113 B6R0.7 CC(C)C(C)(C)O MCULE-9552110431 [1,1,0,0,0,0|1,0,0]=3 3114 B6R0.7 CC(C)C(C)(C)S MCULE-2543562742 [1,1,0,0,0,0|1,1,0]=4 3115 B6R0.7 CC(I)C(C)(C)O MCULE-2789802208 [1,1,0,0,0,0|1,0,0]=3 3116 B6R0.7 CC(N)C(C)(C)C MCULE-1560445367 [1,1,0,0,0,0|1,0,0]=3 3117 B6R0.7 CC(N)C(C)(C)C MCULE-2502277340 [1,1,0,0,0,0|1,0,0]=3 3118 B6R0.7 CC(N)C(C)(C)C MCULE-2961240055 [1,1,0,0,0,0|1,0,0]=3 3119 B6R0.7 CC(N)C(C)(C)C MCULE-6247289312 [1,1,0,0,0,0|1,0,0]=3 3120 B6R0.7 CC(N)C(C)(C)O MCULE-4039964918 [1,1,0,0,0,0|0,0,0]=2 3121 B6R0.7 CC(N)C(C)(F)F MCULE-4707783981 [1,1,0,0,0,0|1,0,0]=3 3122 B6R0.7 CC(N)C(C)(F)F MCULE-4940930603 [1,1,0,0,0,0|1,0,0]=3 3123 B6R0.7 CC(N)C(F)(F)F MCULE-3262630519 [1,1,0,0,0,0|2,0,0]=4 3124 B6R0.7 CC(N)C(F)(F)F MCULE-5807700972 [1,1,0,0,0,0|2,0,0]=4 3125 B6R0.7 CC(N)C(F)(F)F MCULE-9059703170 [1,1,0,0,0,0|2,0,0]=4 3126 B6R0.7 CC(N)C(F)(F)F MCULE-9338683660 [1,1,0,0,0,0|2,0,0]=4 3127 B6R0.7 CC(N)P(=O)(O)O MCULE-6335375089 [1,1,0,0,0,0|2,0,0]=4 3128 B6R0.7 CC(O)C(C)(C)C MCULE-7642386536 [1,1,0,0,0,0|1,0,0]=3 3129 B6R0.7 CC(O)C(C)(C)N MCULE-3194936121 [1,1,0,0,0,0|0,0,0]=2 3130 B6R0.7 CC(O)C(C)(C)N MCULE-6694352146 [1,1,0,0,0,0|0,0,0]=2 3131 B6R0.7 CC(O)C(C)(C)O MCULE-6808101269 [1,1,0,0,0,0|1,0,0]=3 3132 B6R0.7 CC(O)C(Cl)(Cl)Cl MCULE-5935806357 [1,1,0,0,0,0|2,0,0]=4 3133 B6R0.7 CC(O)C(F)(F)F MCULE-7932621726 [1,1,0,0,0,0|2,0,0]=4 3134 B6R0.7 CC(O)C(F)(F)F MCULE-9204617232 [1,1,0,0,0,0|2,0,0]=4 3135 B6R0.7 C[C@@H](N)C(C)(C)C MCULE-4605264480 [1,1,0,0,0,0|1,0,0]=3 3136 B6R0.7 C[C@@H](N)C(C)(C)C MCULE-4749686394 [1,1,0,0,0,0|1,0,0]=3 3137 B6R0.7 C[C@@H](N)C(C)(C)C MCULE-6899493984 [1,1,0,0,0,0|1,0,0]=3 3138 B6R0.7 C[C@@H](N)C(C)(C)C MCULE-8453431428 [1,1,0,0,0,0|1,0,0]=3 3139 B6R0.7 C[C@@H](N)C(C)(C)O MCULE-3417639330 [1,1,0,0,0,0|0,0,0]=2 3140 B6R0.7 C[C@@H](N)C(C)(C)O MCULE-4565477059 [1,1,0,0,0,0|0,0,0]=2 3141 B6R0.7 C[C@@H](N)C(C)(C)O MCULE-6545041854 [1,1,0,0,0,0|0,0,0]=2 3142 B6R0.7 C[C@@H](N)C(C)(C)O MCULE-7923052614 [1,1,0,0,0,0|0,0,0]=2 3143 B6R0.7 C[C@@H](N)C(C)(F)F MCULE-2091512809 [1,1,0,0,0,0|1,0,0]=3 3144 B6R0.7 C[C@@H](N)C(C)(F)F MCULE-8739903384 [1,1,0,0,0,0|1,0,0]=3 3145 B6R0.7 C[C@@H](N)C(F)(F)F MCULE-4764078144 [1,1,0,0,0,0|2,0,0]=4 3146 B6R0.7 C[C@@H](N)C(F)(F)F MCULE-5519320185 [1,1,0,0,0,0|2,0,0]=4 3147 B6R0.7 C[C@@H](N)C(F)(F)F MCULE-6357974683 [1,1,0,0,0,0|2,0,0]=4 3148 B6R0.7 C[C@@H](N)C(F)(F)F MCULE-8361949262 [1,1,0,0,0,0|2,0,0]=4 3149 B6R0.7 C[C@@H](N)P(=O)(O)O MCULE-6555656905 [1,1,0,0,0,0|2,0,0]=4 3150 B6R0.7 C[C@@H](O)C(C)(C)C MCULE-7929838583 [1,1,0,0,0,0|1,0,0]=3 3151 B6R0.7 C[C@@H](O)C(F)(F)F MCULE-2563742748 [1,1,0,0,0,0|2,0,0]=4 3152 B6R0.7 C[C@H](N)C(C)(C)C MCULE-4139932684 [1,1,0,0,0,0|1,0,0]=3 3153 B6R0.7 C[C@H](N)C(C)(C)C MCULE-4860282434 [1,1,0,0,0,0|1,0,0]=3 3154 B6R0.7 C[C@H](N)C(C)(C)C MCULE-6310262013 [1,1,0,0,0,0|1,0,0]=3 3155 B6R0.7 C[C@H](N)C(C)(C)C MCULE-6777039869 [1,1,0,0,0,0|1,0,0]=3 3156 B6R0.7 C[C@H](N)C(C)(C)O MCULE-2544089301 [1,1,0,0,0,0|0,0,0]=2 3157 B6R0.7 C[C@H](N)C(C)(C)O MCULE-3586309450 [1,1,0,0,0,0|0,0,0]=2 3158 B6R0.7 C[C@H](N)C(C)(C)O MCULE-3878079754 [1,1,0,0,0,0|0,0,0]=2 3159 B6R0.7 C[C@H](N)C(C)(C)O MCULE-6958997632 [1,1,0,0,0,0|0,0,0]=2 3160 B6R0.7 C[C@H](N)C(C)(F)F MCULE-1126441542 [1,1,0,0,0,0|1,0,0]=3 3161 B6R0.7 C[C@H](N)C(C)(F)F MCULE-5528735738 [1,1,0,0,0,0|1,0,0]=3 3162 B6R0.7 C[C@H](N)C(C)(F)F MCULE-8435527625 [1,1,0,0,0,0|1,0,0]=3 3163 B6R0.7 C[C@H](N)C(C)(F)F MCULE-9214849722 [1,1,0,0,0,0|1,0,0]=3 3164 B6R0.7 C[C@H](N)C(F)(F)F MCULE-3362038134 [1,1,0,0,0,0|2,0,0]=4 3165 B6R0.7 C[C@H](N)C(F)(F)F MCULE-4246179222 [1,1,0,0,0,0|2,0,0]=4 3166 B6R0.7 C[C@H](N)C(F)(F)F MCULE-5429343374 [1,1,0,0,0,0|2,0,0]=4 3167 B6R0.7 C[C@H](N)C(F)(F)F MCULE-8647501380 [1,1,0,0,0,0|2,0,0]=4 3168 B6R0.7 C[C@H](N)P(=O)(O)O MCULE-8139992515 [1,1,0,0,0,0|2,0,0]=4 3169 B6R0.7 C[C@H](O)C(C)(C)C MCULE-8207064949 [1,1,0,0,0,0|1,0,0]=3 3170 B6R0.7 C[C@H](O)C(C)(C)O MCULE-5048641902 [1,1,0,0,0,0|1,0,0]=3 3171 B6R0.7 C[C@H](O)C(F)(F)F MCULE-2310271940 [1,1,0,0,0,0|2,0,0]=4 3172 B6R0.7 C[C@H](O)C(F)(F)F MCULE-8236579487 [1,1,0,0,0,0|2,0,0]=4 3173 B6R0.7 [C@H](C)(O)C(F)(F)F MCULE-3479344719 [1,1,0,0,0,0|2,0,0]=4 3174 B8R0.2 CCC(C)C(C)C(C)O MCULE-2099710154 [0,1,0,0,0,1|2,0,0]=4 3175 B8R0.2 CCC(N)C(O)C(C)C MCULE-1144815530 [0,1,0,0,0,1|2,0,0]=4 3176 B8R0.2 CCC(N)C(O)C(C)C MCULE-7062182958 [0,1,0,0,0,1|2,0,0]=4 3177 B8R0.5 CC(C)CC(C)CCO MCULE-4252029005 [0,1,0,0,0,1|2,0,0]=4 3178 B8R0.5 CC(C)CC(N)CCO MCULE-3556995407 [0,1,0,0,0,1|1,0,0]=3 3179 B8R0.5 CC(C)C[C@H](N)CCO MCULE-8336727873 [0,1,0,0,0,1|1,0,0]=3 3180 B8R0.5 CC(O)CC(O)CCO MCULE-4888514297 [0,1,0,0,0,1|1,0,0]=3 3181 B8R0.5 CC(O)CN(C)CCO MCULE-4977568845 [0,1,0,0,0,1|2,0,0]=4 3182 B8R0.5 CCCC(C)CC(C)O MCULE-3968478752 [0,1,0,0,0,1|2,0,0]=4 3183 B8R0.5 CN(C)CC(N)CCO MCULE-6705437586 [0,1,0,0,0,1|2,0,0]=4 3184 B8R0.5 CNCC(N)CC(C)C MCULE-2079953825 [0,1,0,0,0,1|2,0,0]=4 3185 B8R0.5 COCC(O)CC(C)C MCULE-8774838486 [0,1,0,0,0,1|2,0,0]=4 3186 B8R0.5 COC[C@H](N)CC(C)C MCULE-2740362594 [0,1,0,0,0,1|1,0,0]=3 3187 B8R0.16 CC(C)CC(CN)CO MCULE-7916297233 [0,1,0,0,0,1|1,0,0]=3 3188 B8R0.16 CCC(CO)CC(C)C MCULE-9608291376 [0,1,0,0,0,1|2,0,0]=4 3189 B8R0.16 CCC(CO)NC(C)C MCULE-8292737377 [0,1,0,0,0,1|2,0,0]=4 3190 B8R0.16 CN[C@H](CO)CC(C)C MCULE-6658701824 [0,1,0,0,0,1|1,0,0]=3 3191 B8R0.16 NCC(CO)CC(=O)O MCULE-2939268634 [0,1,0,0,0,1|1,0,1]=4 3192 B8R0.19 CC(CO)CC(C)CO MCULE-5101558507 [0,1,0,0,0,1|1,0,0]=3 3193 B8R0.19 CC(CO)NC(C)CO MCULE-9592229965 [0,1,0,0,0,1|1,0,0]=3 3194 B8R0.19 CC(CO)N[C@H](C)CO MCULE-4785692482 [0,1,0,0,0,1|1,0,0]=3 3195 B8R0.19 CC(CO)OC(C)CO MCULE-3894293331 [0,1,0,0,0,1|1,0,0]=3 3196 B8R0.19 CC(CO)OC(C)CO MCULE-7387498325 [0,1,0,0,0,1|1,0,0]=3 3197 B8R0.19 CCC(C)CC(C)CO MCULE-5737704972 [0,1,0,0,0,1|2,0,0]=4 3198 B8R0.19 CCC(C)CC(N)CO MCULE-5344165944 [0,1,0,0,0,1|1,0,0]=3 3199 B8R0.19 CCC(C)CC(N)CO MCULE-6408946943 [0,1,0,0,0,1|1,0,0]=3 3200 B8R0.19 CCC(C)CC(O)CC MCULE-9706306627 [0,1,0,0,0,1|2,0,0]=4 3201 B8R0.19 CCC(N)CC(C)CO MCULE-9757770228 [0,1,0,0,0,1|1,0,0]=3 3202 B8R0.19 CCC(O)OC(O)CC MCULE-9298226682 [0,1,0,0,0,1|2,0,0]=4 3203 B8R0.19 CC[C@@H](O)C[C@H](O)CC MCULE-8992338479 [0,1,0,0,0,1|2,0,0]=4 3204 B8R0.19 CC[C@H](O)C[C@@H](O)CC MCULE-4286526192 [0,1,0,0,0,1|2,0,0]=4 3205 B8R0.19 COC(=O)CC(N)CO MCULE-4803123890 [0,1,0,0,0,1|0,0,2]=4 3206 B8R0.19 COC(=O)CC(N)CO MCULE-5372024399 [0,1,0,0,0,1|0,0,2]=4 3207 B8R0.19 O=C(CO)CC(O)CO MCULE-2853556664 [0,1,0,0,0,1|1,0,1]=4 3208 B8R0.23 C(N)(CC(C)C)C(=O)O MCULE-7664540924 [0,1,0,0,0,1|1,0,1]=4 3209 B8R0.23 CC(C)CC(N)C(=O)O MCULE-2550986320 [0,1,0,0,0,1|1,0,1]=4 3210 B8R0.23 CC(C)CC(N)C(=O)O MCULE-7657212416 [0,1,0,0,0,1|1,0,1]=4 3211 B8R0.23 CC(C)C[C@@H](N)C(=O)O MCULE-3041792060 [0,1,0,0,0,1|1,0,1]=4 3212 B8R0.23 CC(C)C[C@@H](N)C(=O)O MCULE-8280206722 [0,1,0,0,0,1|1,0,1]=4 3213 B8R0.23 CC(C)C[C@H](N)C(=O)O MCULE-4718215038 [0,1,0,0,0,1|1,0,1]=4 3214 B8R0.23 CC(C)C[C@H](N)C(=O)O MCULE-4930237913 [0,1,0,0,0,1|1,0,1]=4 3215 B8R0.23 CC(C)C[C@H](N)C(=O)O MCULE-8722899457 [0,1,0,0,0,1|1,0,1]=4 3216 B8R0.23 CC(O)C(N)CC(=O)O MCULE-5161755443 [0,1,0,0,0,1|1,0,1]=4 3217 B8R0.23 CC(O)C(N)CC(=O)O MCULE-6370326858 [0,1,0,0,0,1|1,0,1]=4 3218 B8R0.23 CC(O)CC(O)C(C)C MCULE-5906290473 [0,1,0,0,0,1|2,0,0]=4 3219 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-1416044737 [0,1,0,0,0,1|1,0,1]=4 3220 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-2990511228 [0,1,0,0,0,1|1,0,1]=4 3221 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-3178455647 [0,1,0,0,0,1|1,0,1]=4 3222 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-4413833682 [0,1,0,0,0,1|1,0,1]=4 3223 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-7332826518 [0,1,0,0,0,1|1,0,1]=4 3224 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-7552978009 [0,1,0,0,0,1|1,0,1]=4 3225 B8R0.23 C[C@H](Cl)C[C@H](N)C(=O)O MCULE-5195061270 [0,1,0,0,0,1|1,0,1]=4 3226 B8R0.23 C[C@H](Cl)C[C@H](N)C(=O)O MCULE-5975065356 [0,1,0,0,0,1|1,0,1]=4 3227 B8R0.23 C[C@H](O)[C@@H](N)CC(=O)O MCULE-8673070329 [0,1,0,0,0,1|1,0,1]=4 3228 B8R0.24 CC(C)(C)CC(N)CN MCULE-6881989419 [0,1,0,0,0,1|2,0,0]=4 3229 B8R0.24 CC(C)(C)CC(N)CN MCULE-7272505216 [0,1,0,0,0,1|2,0,0]=4 3230 B8R0.24 CC(C)(C)CC(N)CO MCULE-6218529160 [0,1,0,0,0,1|1,0,0]=3 3231 B8R0.24 CC(C)(C)CC(N)CO MCULE-9260689415 [0,1,0,0,0,1|1,0,0]=3 3232 B8R0.24 CC(C)(C)C[C@@H](N)CO MCULE-2344272194 [0,1,0,0,0,1|1,0,0]=3 3233 B8R0.24 CC(C)(C)C[C@@H](N)CO MCULE-3422824651 [0,1,0,0,0,1|1,0,0]=3 3234 B8R0.24 CC(C)(C)C[C@H](N)CO MCULE-1162425709 [0,1,0,0,0,1|1,0,0]=3 3235 B8R0.24 CC(C)(C)C[C@H](N)CO MCULE-6072062398 [0,1,0,0,0,1|1,0,0]=3 3236 B8R0.24 CC(C)(C)C[C@H](N)CO MCULE-6096680571 [0,1,0,0,0,1|1,0,0]=3 3237 B8R0.24 CC(C)(C)C[C@H](N)CO MCULE-9054616581 [0,1,0,0,0,1|1,0,0]=3 3238 B8R0.24 CC(C)(F)C[C@H](N)CO MCULE-7714026743 [0,1,0,0,0,1|1,0,0]=3 3239 B8R0.24 CC(CO)CC(C)(C)C MCULE-7679389860 [0,1,0,0,0,1|2,0,0]=4 3240 B8R0.24 CC(CO)CC(C)(C)N MCULE-9841047592 [0,1,0,0,0,1|2,0,0]=4 3241 B8R0.24 NC(CO)CC(F)(F)F MCULE-3090885238 [0,1,0,0,0,1|2,0,0]=4 3242 B8R0.24 NC(CO)CC(F)(F)F MCULE-4254560087 [0,1,0,0,0,1|2,0,0]=4 3243 B8R0.24 N[C@@H](CO)CC(F)(F)F MCULE-4079551315 [0,1,0,0,0,1|2,0,0]=4 3244 B8R0.24 N[C@@H](CO)CC(F)(F)F MCULE-4677503041 [0,1,0,0,0,1|2,0,0]=4 3245 B8R0.24 N[C@H](CO)CC(F)(F)F MCULE-5598535614 [0,1,0,0,0,1|2,0,0]=4 3246 B8R0.24 N[C@H](CO)CC(F)(F)F MCULE-5682898201 [0,1,0,0,0,1|2,0,0]=4 3247 B8R0.34 CC(C)CC(C)(C)CO MCULE-1911437416 [0,1,0,0,0,1|2,0,0]=4 3248 B8R0.34 CC(C)CC(C)(N)CN MCULE-9134360621 [0,1,0,0,0,1|2,0,0]=4 3249 B8R0.34 CC(C)CC(C)(N)CO MCULE-1560730026 [0,1,0,0,0,1|1,0,0]=3 3250 B8R0.34 CC(C)CC(C)(N)CO MCULE-8993149220 [0,1,0,0,0,1|1,0,0]=3 3251 B8R0.34 CC(C)C[C@](C)(N)CO MCULE-2616396238 [0,1,0,0,0,1|1,0,0]=3 3252 B8R0.34 CC(C)C[C@](C)(N)CO MCULE-5663284805 [0,1,0,0,0,1|1,0,0]=3 3253 B8R0.34 CC(C)C[C@](C)(N)CO MCULE-8415395453 [0,1,0,0,0,1|1,0,0]=3 3254 B8R0.34 CC(C)C[C@](C)(N)CO MCULE-9763882430 [0,1,0,0,0,1|1,0,0]=3 3255 B8R0.34 CC(C)NC(C)(C)CO MCULE-1736424701 [0,1,0,0,0,1|2,0,0]=4 3256 B8R0.34 CC(O)CC(C)(C)CN MCULE-3349093711 [0,1,0,0,0,1|2,0,0]=4 3257 B8R0.34 CC(O)CC(C)(C)CN MCULE-7091343982 [0,1,0,0,0,1|2,0,0]=4 3258 B8R0.3 CCCC(=O)C(N)CO MCULE-4196745965 [0,2,0,0,0,0|0,0,2]=4 3259 B8R0.3 CCCC(=O)C(N)CO MCULE-9001126199 [0,2,0,0,0,0|0,0,2]=4 3260 B8R0.3 CCCC(C)C(N)CO MCULE-7204075039 [0,2,0,0,0,0|1,0,0]=3 3261 B8R0.3 CCCC(C)C(N)CO MCULE-9206965368 [0,2,0,0,0,0|1,0,0]=3 3262 B8R0.3 CCCC(C)C(O)CC MCULE-5128705007 [0,2,0,0,0,0|2,0,0]=4 3263 B8R0.3 CCCC(O)C(C)CC MCULE-5746279508 [0,2,0,0,0,0|2,0,0]=4 3264 B8R0.3 CCCC(O)C(N)CO MCULE-6983866986 [0,2,0,0,0,0|0,0,0]=2 3265 B8R0.3 CCOC(=O)C(N)CO MCULE-1666659750 [0,2,0,0,0,0|0,0,2]=4 3266 B8R0.3 CCOC(=O)C(N)CO MCULE-1998512614 [0,2,0,0,0,0|0,0,2]=4 3267 B8R0.3 CCOC(=O)C(N)CO MCULE-2382743439 [0,2,0,0,0,0|0,0,2]=4 3268 B8R0.3 CCOC(=O)C(N)CO MCULE-8735565522 [0,2,0,0,0,0|0,0,2]=4 3269 B8R0.3 CCOC(=O)[C@@H](N)CO MCULE-3922789205 [0,2,0,0,0,0|0,0,2]=4 3270 B8R0.3 CCOC(=O)[C@@H](N)CO MCULE-4123182744 [0,2,0,0,0,0|0,0,2]=4 3271 B8R0.3 CCOC(=O)[C@@H](N)CO MCULE-9348155020 [0,2,0,0,0,0|0,0,2]=4 3272 B8R0.3 CCOC(=O)[C@H](N)CO MCULE-5633972344 [0,2,0,0,0,0|0,0,2]=4 3273 B8R0.3 CCOC(=O)[C@H](N)CO MCULE-6411527516 [0,2,0,0,0,0|0,0,2]=4 3274 B8R0.3 CCOC(=O)[C@H](N)CO MCULE-9780267969 [0,2,0,0,0,0|0,0,2]=4 3275 B8R0.3 CCOC(=O)[C@H](N)CO MCULE-9929488925 [0,2,0,0,0,0|0,0,2]=4 3276 B8R0.3 CCOC(C)/C(=N/O)/N MCULE-2085332041 [0,2,0,0,0,0|1,0,1]=4 3277 B8R0.3 COC(=O)[C@H](N)CCO MCULE-1194830786 [0,2,0,0,0,0|0,0,2]=4 3278 B8R0.3 COC(=O)[C@H](N)CCO MCULE-2532522705 [0,2,0,0,0,0|0,0,2]=4 3279 B8R0.3 COCC(N)C(=O)OC MCULE-1717271658 [0,2,0,0,0,0|0,0,2]=4 3280 B8R0.3 COCC(N)C(=O)OC MCULE-4567479747 [0,2,0,0,0,0|0,0,2]=4 3281 B8R0.3 COCC(N)C(=O)OC MCULE-4859095599 [0,2,0,0,0,0|0,0,2]=4 3282 B8R0.3 COCC(N)C(=O)OC MCULE-8125210840 [0,2,0,0,0,0|0,0,2]=4 3283 B8R0.3 COC[C@@H](N)C(=O)OC MCULE-2867072950 [0,2,0,0,0,0|0,0,2]=4 3284 B8R0.3 COC[C@@H](N)C(=O)OC MCULE-5445193744 [0,2,0,0,0,0|0,0,2]=4 3285 B8R0.3 COC[C@@H](N)C(=O)OC MCULE-8505505456 [0,2,0,0,0,0|0,0,2]=4 3286 B8R0.3 COC[C@@H](N)C(=O)OC MCULE-8525451378 [0,2,0,0,0,0|0,0,2]=4 3287 B8R0.3 O=CCC(O)C(O)CO MCULE-3895407431 [0,2,0,0,0,0|1,0,0]=3 3288 B8R0.3 O=CC[C@@H](O)[C@@H](O)CO MCULE-1639637147 [0,2,0,0,0,0|1,0,0]=3 3289 B8R0.3 O=CC[C@@H](O)[C@@H](O)CO MCULE-4968821647 [0,2,0,0,0,0|1,0,0]=3 3290 B8R0.3 O=CC[C@@H](O)[C@H](O)CO MCULE-5691852027 [0,2,0,0,0,0|1,0,0]=3 3291 B8R0.3 O=CC[C@H](O)[C@H](O)CO MCULE-4741377107 [0,2,0,0,0,0|1,0,0]=3 3292 B8R0.3 O=CC[C@H](O)[C@H](O)CO MCULE-6728124442 [0,2,0,0,0,0|1,0,0]=3 3293 B8R0.3 O=CC[C@H](O)[C@H](O)CO MCULE-7223741689 [0,2,0,0,0,0|1,0,0]=3 3294 B8R0.3 [C@H](N)(CO)C(=O)OCC MCULE-8379845791 [0,2,0,0,0,0|0,0,2]=4 3295 B8R0.8 C=CCCC(N)C(C)C MCULE-5950352597 [0,2,0,0,0,0|2,0,0]=4 3296 B8R0.8 C=CCCC(N)C(C)C MCULE-6219678925 [0,2,0,0,0,0|2,0,0]=4 3297 B8R0.8 CC(O)C(=O)NCCO MCULE-2938685957 [0,2,0,0,0,0|1,0,1]=4 3298 B8R0.8 CC(O)C(=O)OCCO MCULE-9321822945 [0,2,0,0,0,0|1,0,1]=4 3299 B8R0.8 CCCCC(C)C(C)O MCULE-2881990446 [0,2,0,0,0,0|2,0,0]=4 3300 B8R0.8 CCCCC(N)C(C)O MCULE-3645367149 [0,2,0,0,0,0|1,0,0]=3 3301 B8R0.8 CCCCC(N)C(C)O MCULE-4512291097 [0,2,0,0,0,0|1,0,0]=3 3302 B8R0.8 CCOCC(N)C(C)C MCULE-6644223666 [0,2,0,0,0,0|1,0,0]=3 3303 B8R0.8 CCOCC(N)C(C)C MCULE-7204690887 [0,2,0,0,0,0|1,0,0]=3 3304 B8R0.8 CCOC[C@@H](N)C(=O)O MCULE-9199053225 [0,2,0,0,0,0|1,0,1]=4 3305 B8R0.8 CCOC[C@@H](N)C(=O)O MCULE-9684903914 [0,2,0,0,0,0|1,0,1]=4 3306 B8R0.8 CCOC[C@H](N)C(=O)O MCULE-6351196285 [0,2,0,0,0,0|1,0,1]=4 3307 B8R0.8 CCOC[C@H](N)C(=O)O MCULE-7653589662 [0,2,0,0,0,0|1,0,1]=4 3308 B8R0.8 COCCC(N)C(=O)O MCULE-3018605108 [0,2,0,0,0,0|1,0,1]=4 3309 B8R0.8 COCCC(O)C(C)C MCULE-8987535377 [0,2,0,0,0,0|2,0,0]=4 3310 B8R0.8 COCC[C@H](N)C(=O)O MCULE-6748608543 [0,2,0,0,0,0|1,0,1]=4 3311 B8R0.8 COCC[C@H](N)C(=O)O MCULE-8586358852 [0,2,0,0,0,0|1,0,1]=4 3312 B8R0.8 NC(CCCO)C(=O)O MCULE-5421732564 [0,2,0,0,0,0|1,0,1]=4 3313 B8R0.8 NOCCC(N)C(=O)O MCULE-1540658941 [0,2,0,0,0,0|1,0,1]=4 3314 B8R0.8 NOCCC(N)C(=O)O MCULE-3729513992 [0,2,0,0,0,0|1,0,1]=4 3315 B8R0.8 NOCC[C@@H](N)C(=O)O MCULE-3273727827 [0,2,0,0,0,0|1,0,1]=4 3316 B8R0.8 NOCC[C@H](N)C(=O)O MCULE-2315172974 [0,2,0,0,0,0|1,0,1]=4 3317 B8R0.8 N[C@@H](CCCO)C(=O)O MCULE-3220645027 [0,2,0,0,0,0|1,0,1]=4 3318 B8R0.8 N[C@@H](CCCO)C(=O)O MCULE-4608316868 [0,2,0,0,0,0|1,0,1]=4 3319 B8R0.8 [C@H](N)(CCON)C(=O)O MCULE-1309966773 [0,2,0,0,0,0|1,0,1]=4 3320 B8R0.14 C=CCC(N)C(C)(C)C MCULE-3790250697 [0,2,0,0,0,0|2,0,0]=4 3321 B8R0.14 C=CCC(N)C(C)(C)C MCULE-9971524352 [0,2,0,0,0,0|2,0,0]=4 3322 B8R0.14 CC(C)(C)C(N)CCO MCULE-1010726098 [0,2,0,0,0,0|1,0,0]=3 3323 B8R0.14 CC(C)(C)C(O)CON MCULE-4687686608 [0,2,0,0,0,0|2,0,0]=4 3324 B8R0.14 CC(C)(O)[C@H](F)CCO MCULE-9185535119 [0,2,0,0,0,0|1,0,0]=3 3325 B8R0.14 CC(CCO)C(C)(C)O MCULE-9511812518 [0,2,0,0,0,0|1,0,0]=3 3326 B8R0.14 CCCC(C)C(C)(C)O MCULE-2569743231 [0,2,0,0,0,0|2,0,0]=4 3327 B8R0.14 CCCC(N)C(C)(C)C MCULE-1269755653 [0,2,0,0,0,0|2,0,0]=4 3328 B8R0.14 CCCC(N)C(C)(C)C MCULE-9780401895 [0,2,0,0,0,0|2,0,0]=4 3329 B8R0.14 COCC(O)C(C)(C)C MCULE-2227683316 [0,2,0,0,0,0|2,0,0]=4 3330 B8R0.14 NC(CCO)C(F)(F)F MCULE-1294544079 [0,2,0,0,0,0|2,0,0]=4 3331 B8R0.14 NC(CCO)C(F)(F)F MCULE-4775215778 [0,2,0,0,0,0|2,0,0]=4 3332 B8R0.14 N[C@@H](CCO)C(F)(F)F MCULE-4846720412 [0,2,0,0,0,0|2,0,0]=4 3333 B8R0.14 N[C@@H](CCO)C(F)(F)F MCULE-8113769077 [0,2,0,0,0,0|2,0,0]=4 3334 B8R0.14 N[C@@H](CCO)C(F)(F)F MCULE-8159371061 [0,2,0,0,0,0|2,0,0]=4 3335 B8R0.14 N[C@H](CCO)C(F)(F)F MCULE-2483130048 [0,2,0,0,0,0|2,0,0]=4 3336 B8R0.14 N[C@H](CCO)C(F)(F)F MCULE-5172424490 [0,2,0,0,0,0|2,0,0]=4 3337 B8R0.15 CN(C)C(CO)CCN MCULE-3885599914 [0,2,0,0,0,0|2,0,0]=4 3338 B8R0.15 CNC(COC)C(=O)O MCULE-4091913769 [0,2,0,0,0,0|1,0,1]=4 3339 B8R0.15 CNC(COC)C(=O)O MCULE-6745647660 [0,2,0,0,0,0|1,0,1]=4 3340 B8R0.15 CN[C@@H](CCO)C(=O)O MCULE-4209872941 [0,2,0,0,0,0|1,0,1]=4 3341 B8R0.15 CN[C@@H](CCO)C(=O)O MCULE-7202916887 [0,2,0,0,0,0|1,0,1]=4 3342 B8R0.15 CN[C@H](CCO)C(=O)O MCULE-1874728709 [0,2,0,0,0,0|1,0,1]=4 3343 B8R0.15 CN[C@H](CCO)C(=O)O MCULE-3716592032 [0,2,0,0,0,0|1,0,1]=4 3344 B8R0.15 COCC(CBr)C(C)C MCULE-4152089533 [0,2,0,0,0,0|2,0,0]=4 3345 B8R0.15 COCC(CN)C(C)C MCULE-1086544008 [0,2,0,0,0,0|1,0,0]=3 3346 B8R0.15 COCC(CO)C(C)C MCULE-9193310676 [0,2,0,0,0,0|2,0,0]=4 3347 B8R0.15 COCC(ON)C(=O)O MCULE-4466158339 [0,2,0,0,0,0|1,0,1]=4 3348 B8R0.15 COCC(ON)C(=O)O MCULE-6084078663 [0,2,0,0,0,0|1,0,1]=4 3349 B8R0.13 C#CC(N)C(C)(C)OC MCULE-6265225474 [0,2,0,0,0,0|1,0,1]=4 3350 B8R0.13 CC(C)(CO)C(O)CN MCULE-8834765819 [0,2,0,0,0,0|1,0,0]=3 3351 B8R0.13 CC(C)(CO)[C@@H](O)CO MCULE-9011219997 [0,2,0,0,0,0|1,0,0]=3 3352 B8R0.13 CC(NO)C(C)(C)NO MCULE-5443692344 [0,2,0,0,0,0|2,0,0]=4 3353 B8R0.13 CC([NH2+]O)C(C)(C)NO MCULE-3391316310 [0,2,0,0,0,0|2,0,0]=4 3354 B8R0.13 CCC(C)C(C)(O)CC MCULE-8544550267 [0,2,0,0,0,0|2,0,0]=4 3355 B8R0.13 CCC(C)C(C)(O)CN MCULE-5517076234 [0,2,0,0,0,0|2,0,0]=4 3356 B8R0.13 COC(=O)C(C)(N)CO MCULE-3846577646 [0,2,0,0,0,0|0,0,2]=4 3357 B8R0.13 COC(=O)C(C)(N)CO MCULE-4981173106 [0,2,0,0,0,0|0,0,2]=4 3358 B8R0.13 COC(=O)[C@@](C)(N)CO MCULE-2857382898 [0,2,0,0,0,0|0,0,2]=4 3359 B8R0.13 COC(=O)[C@@](C)(N)CO MCULE-3226982515 [0,2,0,0,0,0|0,0,2]=4 3360 B8R0.13 COC(C)(C)/C(=N/O)/N MCULE-7630452160 [0,2,0,0,0,0|1,0,1]=4 3361 B8R0.13 COC(C)(C)C(O)CN MCULE-1721044308 [0,2,0,0,0,0|2,0,0]=4 3362 B8R0.13 C[C@](O)(CO)[C@H](O)CO MCULE-5157161314 [0,2,0,0,0,0|1,0,0]=3 3363 B8R0.20 CCC(Br)C(OC)OC MCULE-9053790367 [0,2,0,0,0,0|2,0,0]=4 3364 B8R0.20 CCC(C)C(CN)OC MCULE-5181614773 [0,2,0,0,0,0|2,0,0]=4 3365 B8R0.20 CCC(C)C(CO)OC MCULE-9009724151 [0,2,0,0,0,0|2,0,0]=4 3366 B8R0.20 CCC(CC)C(O)CN MCULE-3311357012 [0,2,0,0,0,0|2,0,0]=4 3367 B8R0.20 CCC(CC)C(O)CO MCULE-2947428739 [0,2,0,0,0,0|2,0,0]=4 3368 B8R0.20 CCC(N)C(OC)OC MCULE-4426944560 [0,2,0,0,0,0|1,0,0]=3 3369 B8R0.20 CCC(N)C(OC)OC MCULE-7743570977 [0,2,0,0,0,0|1,0,0]=3 3370 B8R0.20 CCC(O)C(CC)CC MCULE-1113039438 [0,2,0,0,0,0|2,0,0]=4 3371 B8R0.20 CNC(CO)C(=O)OC MCULE-1017957273 [0,2,0,0,0,0|0,0,2]=4 3372 B8R0.20 CNC(CO)C(=O)OC MCULE-2751377307 [0,2,0,0,0,0|0,0,2]=4 3373 B8R0.20 COC(C)C(CBr)OC MCULE-3245972419 [0,2,0,0,0,0|2,0,0]=4 3374 B8R0.20 COC(C)C(CN)OC MCULE-6570822844 [0,2,0,0,0,0|2,0,0]=4 3375 B8R0.20 COC(C)C(CO)OC MCULE-5469068997 [0,2,0,0,0,0|1,0,0]=3 3376 B8R0.20 COC(CO)C(Br)CO MCULE-7125758160 [0,2,0,0,0,0|1,0,0]=3 3377 B8R0.20 COC(OC)C(O)CO MCULE-6139329169 [0,2,0,0,0,0|1,0,0]=3 3378 B8R0.17 CC(C)(C)[C@@](C)(N)CO MCULE-1071461265 [0,2,0,0,0,0|1,0,0]=3 3379 B8R0.17 CC(C)(O)C(C)(C)CN MCULE-8827828668 [0,2,0,0,0,0|2,0,0]=4 3380 B8R0.17 CC(C)(O)C(C)(C)CO MCULE-5785557080 [0,2,0,0,0,0|1,0,0]=3 3381 B8R0.17 CC(C)(O)C(F)(F)CN MCULE-1237138881 [0,2,0,0,0,0|2,0,0]=4 3382 B8R0.17 CC(C)(O)C(F)(F)CN MCULE-3447613508 [0,2,0,0,0,0|2,0,0]=4 3383 B8R0.17 CC(F)(F)C(C)(C)CO MCULE-9416274789 [0,2,0,0,0,0|2,0,0]=4 3384 B8R0.36 C=CC(N)(CO)C(=O)O MCULE-8811599430 [0,2,0,0,0,0|1,0,1]=4 3385 B8R0.36 CCC(C)(CN)C(C)O MCULE-6950019734 [0,2,0,0,0,0|1,0,0]=3 3386 B8R0.36 CCC(N)(C#N)C(C)C MCULE-6914290709 [0,2,0,0,0,0|2,0,0]=4 3387 B8R0.37 CC(C)C(C)(N)C(=O)O MCULE-2018617657 [0,2,0,0,0,0|1,0,1]=4 3388 B8R0.37 CC(C)C(C)(N)C(=O)O MCULE-8116018936 [0,2,0,0,0,0|1,0,1]=4 3389 B8R0.37 CC(C)[C@@](C)(N)C(=O)O MCULE-1672449529 [0,2,0,0,0,0|1,0,1]=4 3390 B8R0.37 CC(C)[C@@](C)(N)C(=O)O MCULE-5333264309 [0,2,0,0,0,0|1,0,1]=4 3391 B8R0.37 CC(C)[C@](C)(N)C(=O)O MCULE-3942243398 [0,2,0,0,0,0|1,0,1]=4 3392 B8R0.37 CC(C)[C@](C)(N)C(=O)O MCULE-5291448404 [0,2,0,0,0,0|1,0,1]=4 3393 B8R0.37 CC(O)C(C)(N)C(=O)O MCULE-9781647782 [0,2,0,0,0,0|0,0,1]=3 3394 B8R0.37 CC(O)C(C)(O)C(=O)O MCULE-5546110054 [0,2,0,0,0,0|1,0,1]=4 3395 B8R0.37 CC(O)C(F)(F)C(=O)O MCULE-8714570962 [0,2,0,0,0,0|1,0,1]=4 3396 B8R0.37 C[C@@H](O)[C@](C)(N)C(=O)O MCULE-4212497890 [0,2,0,0,0,0|0,0,1]=3 3397 B8R0.37 C[C@@H](O)[C@](C)(N)C(=O)O MCULE-7382680634 [0,2,0,0,0,0|0,0,1]=3 3398 B8R0.37 C[C@H](O)[C@@](C)(N)C(=O)O MCULE-5661079280 [0,2,0,0,0,0|0,0,1]=3 3399 B8R0.26 CC(C)(C)C(CN)CO MCULE-3215360709 [0,2,0,0,0,0|1,0,0]=3 3400 B8R0.26 CC(C)(C)C(CO)CO MCULE-2215387921 [0,2,0,0,0,0|2,0,0]=4 3401 B8R0.26 CCC(NN)C(C)(C)C MCULE-2777406960 [0,2,0,0,0,0|2,0,0]=4 3402 B8R0.26 CCC(NN)C(C)(C)C MCULE-6811675361 [0,2,0,0,0,0|2,0,0]=4 3403 B8R0.26 CNC(CO)C(C)(C)C MCULE-8983727573 [0,2,0,0,0,0|1,0,0]=3 3404 B8R0.26 NCC(CO)C(F)(F)F MCULE-7038755410 [0,2,0,0,0,0|2,0,0]=4 3405 B8R0.27 C(N)(C(=O)O)C(C)(C)S MCULE-1893345960 [0,2,0,0,0,0|0,1,1]=4 3406 B8R0.27 CC(C)(C)C(N)C(=O)O MCULE-4378220677 [0,2,0,0,0,0|1,0,1]=4 3407 B8R0.27 CC(C)(C)C(N)C(=O)O MCULE-7142182400 [0,2,0,0,0,0|1,0,1]=4 3408 B8R0.27 CC(C)(C)C(N)C(=O)O MCULE-9877941557 [0,2,0,0,0,0|1,0,1]=4 3409 B8R0.27 CC(C)(C)[C@@H](N)C(=O)O MCULE-1280092872 [0,2,0,0,0,0|1,0,1]=4 3410 B8R0.27 CC(C)(C)[C@@H](N)C(=O)O MCULE-8741274445 [0,2,0,0,0,0|1,0,1]=4 3411 B8R0.27 CC(C)(C)[C@@H](N)C(=O)O MCULE-9585981018 [0,2,0,0,0,0|1,0,1]=4 3412 B8R0.27 CC(C)(C)[C@H](N)C(=O)O MCULE-2361901374 [0,2,0,0,0,0|1,0,1]=4 3413 B8R0.27 CC(C)(C)[C@H](N)C(=O)O MCULE-7700637346 [0,2,0,0,0,0|1,0,1]=4 3414 B8R0.27 CC(C)(C)[C@H](N)C(=O)O MCULE-8028056550 [0,2,0,0,0,0|1,0,1]=4 3415 B8R0.27 CC(C)(C)[C@H](N)C(=O)O MCULE-8791211435 [0,2,0,0,0,0|1,0,1]=4 3416 B8R0.27 CC(C)(F)C(N)C(=O)O MCULE-3479476353 [0,2,0,0,0,0|1,0,1]=4 3417 B8R0.27 CC(C)(F)[C@H](N)C(=O)O MCULE-4975554837 [0,2,0,0,0,0|1,0,1]=4 3418 B8R0.27 CC(C)(F)[C@H](N)C(=O)O MCULE-6202392495 [0,2,0,0,0,0|1,0,1]=4 3419 B8R0.27 CC(C)(O)C(N)C(=O)O MCULE-4257891769 [0,2,0,0,0,0|0,0,1]=3 3420 B8R0.27 CC(C)(O)C(N)C(=O)O MCULE-4291820573 [0,2,0,0,0,0|0,0,1]=3 3421 B8R0.27 CC(C)(O)C(N)C(=O)O MCULE-8731964950 [0,2,0,0,0,0|0,0,1]=3 3422 B8R0.27 CC(C)(O)C(O)C(=O)O MCULE-2030710507 [0,2,0,0,0,0|1,0,1]=4 3423 B8R0.27 CC(C)(O)[C@@H](N)C(=O)O MCULE-2953137860 [0,2,0,0,0,0|0,0,1]=3 3424 B8R0.27 CC(C)(O)[C@@H](N)C(=O)O MCULE-3424625974 [0,2,0,0,0,0|0,0,1]=3 3425 B8R0.27 CC(C)(O)[C@H](N)C(=O)O MCULE-3721152032 [0,2,0,0,0,0|0,0,1]=3 3426 B8R0.27 CC(C)(O)[C@H](N)C(=O)O MCULE-7599346102 [0,2,0,0,0,0|0,0,1]=3 3427 B8R0.27 CC(C)(O)[C@H](N)C(=O)O MCULE-9499245205 [0,2,0,0,0,0|0,0,1]=3 3428 B8R0.27 CC(C)(S)C(N)C(=O)O MCULE-4184299411 [0,2,0,0,0,0|0,1,1]=4 3429 B8R0.27 CC(C)(S)C(N)C(=O)O MCULE-8542176080 [0,2,0,0,0,0|0,1,1]=4 3430 B8R0.27 CC(C)(S)[C@@H](N)C(=O)O MCULE-5986342172 [0,2,0,0,0,0|0,1,1]=4 3431 B8R0.27 CC(C)(S)[C@@H](N)C(=O)O MCULE-9856748563 [0,2,0,0,0,0|0,1,1]=4 3432 B8R0.27 CC(C)(S)[C@H](N)C(=O)O MCULE-3098543641 [0,2,0,0,0,0|0,1,1]=4 3433 B8R0.27 CC(C)(S)[C@H](N)C(=O)O MCULE-9539588985 [0,2,0,0,0,0|0,1,1]=4 3434 B8R0.27 CC(C)C(N)C(C)(C)N MCULE-1933639292 [0,2,0,0,0,0|2,0,0]=4 3435 B8R0.27 CC(C)C(N)C(C)(C)N MCULE-7573027144 [0,2,0,0,0,0|2,0,0]=4 3436 B8R0.27 CC(C)C(N)C(F)(F)F MCULE-6613647139 [0,2,0,0,0,0|2,0,0]=4 3437 B8R0.27 CC(C)C(N)C(F)(F)F MCULE-7354419141 [0,2,0,0,0,0|2,0,0]=4 3438 B8R0.27 CC(C)C(N)S(=O)(=O)O MCULE-1741232006 [0,2,0,0,0,0|2,0,0]=4 3439 B8R0.27 CC(C)[C@@H](N)C(F)(F)F MCULE-5565329333 [0,2,0,0,0,0|2,0,0]=4 3440 B8R0.27 CC(C)[C@@H](N)C(F)(F)F MCULE-5835898928 [0,2,0,0,0,0|2,0,0]=4 3441 B8R0.27 CC(C)[C@@H](N)C(F)(F)F MCULE-8084948090 [0,2,0,0,0,0|2,0,0]=4 3442 B8R0.27 CC(C)[C@@H](N)C(F)(F)F MCULE-9740449752 [0,2,0,0,0,0|2,0,0]=4 3443 B8R0.27 CC(C)[C@H](N)C(C)(C)O MCULE-2380720216 [0,2,0,0,0,0|1,0,0]=3 3444 B8R0.27 CC(C)[C@H](N)C(F)(F)F MCULE-2408012646 [0,2,0,0,0,0|2,0,0]=4 3445 B8R0.27 CC(C)[C@H](N)C(F)(F)F MCULE-3929270819 [0,2,0,0,0,0|2,0,0]=4 3446 B8R0.27 CC(C)[C@H](N)C(F)(F)F MCULE-6721478301 [0,2,0,0,0,0|2,0,0]=4 3447 B8R0.27 CC(C)[C@H](N)C(F)(F)F MCULE-6771819711 [0,2,0,0,0,0|2,0,0]=4 3448 B8R0.27 CC(F)(F)C(N)C(=O)O MCULE-1789483909 [0,2,0,0,0,0|1,0,1]=4 3449 B8R0.27 CC(F)(F)C(N)C(=O)O MCULE-3186979989 [0,2,0,0,0,0|1,0,1]=4 3450 B8R0.27 CC(O)C(N)C(F)(F)F MCULE-6743755559 [0,2,0,0,0,0|1,0,0]=3 3451 B8R0.27 CC(O)C(N)C(F)(F)F MCULE-9730043335 [0,2,0,0,0,0|1,0,0]=3 3452 B8R0.27 C[C@@H](O)[C@@H](N)C(C)(C)C MCULE-3406515694 [0,2,0,0,0,0|1,0,0]=3 3453 B8R0.27 [C@@H](N)(C(=O)O)C(C)(C)O MCULE-5116872005 [0,2,0,0,0,0|0,0,1]=3 3454 B8R0.27 [C@H](N)(C(=O)O)C(C)(C)S MCULE-5559697921 [0,2,0,0,0,0|0,1,1]=4 3455 B8R0.18 CC(C)C(CN)C(=O)O MCULE-4117902081 [0,2,0,0,0,0|1,0,1]=4 3456 B8R0.18 CC(C)C(CN)C(=O)O MCULE-7615812755 [0,2,0,0,0,0|1,0,1]=4 3457 B8R0.18 CC(C)C(CN)C(=O)O MCULE-7742033605 [0,2,0,0,0,0|1,0,1]=4 3458 B8R0.18 CC(C)C(CN)C(C)C MCULE-4493109825 [0,2,0,0,0,0|2,0,0]=4 3459 B8R0.18 CC(C)C(CN)C(C)C MCULE-9672415873 [0,2,0,0,0,0|2,0,0]=4 3460 B8R0.18 CC(C)C(CN)N(C)C MCULE-4850084094 [0,2,0,0,0,0|2,0,0]=4 3461 B8R0.18 CC(C)C(CO)C(=O)O MCULE-3554430088 [0,2,0,0,0,0|2,0,0]=4 3462 B8R0.18 CC(C)C(CO)C(=O)[O-] MCULE-8769338268 [0,2,0,0,0,0|2,0,0]=4 3463 B8R0.18 CC(C)C(CO)C(C)C MCULE-6066249901 [0,2,0,0,0,0|2,0,0]=4 3464 B8R0.18 CC(C)C(NN)C(=O)O MCULE-5064228794 [0,2,0,0,0,0|1,0,1]=4 3465 B8R0.18 CC(C)[C@@H](CN)C(=O)O MCULE-1192054373 [0,2,0,0,0,0|1,0,1]=4 3466 B8R0.18 CC(C)[C@@H](CN)C(=O)O MCULE-3040043200 [0,2,0,0,0,0|1,0,1]=4 3467 B8R0.18 CC(C)[C@@H](CN)C(=O)O MCULE-4353846755 [0,2,0,0,0,0|1,0,1]=4 3468 B8R0.18 CC(C)[C@@H](CN)C(=O)O MCULE-6762829521 [0,2,0,0,0,0|1,0,1]=4 3469 B8R0.18 CC(C)[C@H](CN)C(=O)O MCULE-4384560751 [0,2,0,0,0,0|1,0,1]=4 3470 B8R0.18 CC(C)[C@H](CN)C(=O)O MCULE-4859224613 [0,2,0,0,0,0|1,0,1]=4 3471 B8R0.18 CC(C)[C@H](CN)C(=O)O MCULE-4974717674 [0,2,0,0,0,0|1,0,1]=4 3472 B8R0.18 CC(C)[C@H](CN)C(=O)O MCULE-7170111497 [0,2,0,0,0,0|1,0,1]=4 3473 B8R0.18 CC(C)[C@H](NO)C(=O)O MCULE-4203177410 [0,2,0,0,0,0|1,0,1]=4 3474 B8R0.18 CCC(C(=O)O)C(C)O MCULE-1064081188 [0,2,0,0,0,0|1,0,1]=4 3475 B8R0.18 CNC(C(=O)O)C(C)C MCULE-2983512448 [0,2,0,0,0,0|1,0,1]=4 3476 B8R0.18 CNC(C(=O)O)C(C)C MCULE-5377326864 [0,2,0,0,0,0|1,0,1]=4 3477 B8R0.18 CNC(C(=O)O)C(C)C MCULE-7319327975 [0,2,0,0,0,0|1,0,1]=4 3478 B8R0.18 CNC(C(=O)O)C(C)O MCULE-8017224741 [0,2,0,0,0,0|0,0,1]=3 3479 B8R0.18 CN[C@@H](C(=O)O)C(C)C MCULE-4099145544 [0,2,0,0,0,0|1,0,1]=4 3480 B8R0.18 CN[C@@H](C(=O)O)C(C)C MCULE-4380404369 [0,2,0,0,0,0|1,0,1]=4 3481 B8R0.18 CN[C@@H](C(=O)O)C(C)C MCULE-9367123188 [0,2,0,0,0,0|1,0,1]=4 3482 B8R0.18 CN[C@@H](C(=O)O)C(C)C MCULE-9706333586 [0,2,0,0,0,0|1,0,1]=4 3483 B8R0.18 CN[C@H](C(=O)O)C(C)C MCULE-5443567819 [0,2,0,0,0,0|1,0,1]=4 3484 B8R0.18 CN[C@H](C(=O)O)C(C)C MCULE-5552228182 [0,2,0,0,0,0|1,0,1]=4 3485 B8R0.18 CN[C@H](C(=O)O)C(C)C MCULE-5767489702 [0,2,0,0,0,0|1,0,1]=4 3486 B8R0.18 CN[C@H](C(=O)O)C(C)C MCULE-8822349419 [0,2,0,0,0,0|1,0,1]=4 3487 B8R0.18 CN[C@H](C(=O)O)[C@@H](C)O MCULE-5405618703 [0,2,0,0,0,0|0,0,1]=3 3488 B8R0.18 CN[C@H](C(=O)O)[C@@H](C)O MCULE-6470355986 [0,2,0,0,0,0|0,0,1]=3 3489 B8R0.18 CN[C@H](C(=O)O)[C@@H](C)O MCULE-7261692258 [0,2,0,0,0,0|0,0,1]=3 3490 B8R0.18 CN[C@H](C(=O)O)[C@@H](C)O MCULE-7763091319 [0,2,0,0,0,0|0,0,1]=3 3491 B8R0.18 CN[C@H](C(=O)O)[C@@H](C)O MCULE-8429501411 [0,2,0,0,0,0|0,0,1]=3 3492 B6R1.2 BrC1CCCC1 MCULE-9383923023 [1,0,0,1,0,0|2,0,0]=4 3493 B6R1.2 BrC1CCNC1 MCULE-4841543716 [1,0,0,1,0,0|2,0,0]=4 3494 B6R1.2 BrC1CCNC1 MCULE-4954951045 [1,0,0,1,0,0|2,0,0]=4 3495 B6R1.2 BrC1CCNC1 MCULE-7176123276 [1,0,0,1,0,0|2,0,0]=4 3496 B6R1.2 BrC1CCOC1 MCULE-7037144528 [1,0,0,1,0,0|1,0,0]=3 3497 B6R1.2 BrC1CCSC1 MCULE-6663716947 [1,0,0,1,0,0|1,1,0]=4 3498 B6R1.2 Br[C@@H]1CCNC1 MCULE-1681494552 [1,0,0,1,0,0|2,0,0]=4 3499 B6R1.2 Br[C@@H]1CCNC1 MCULE-1764777534 [1,0,0,1,0,0|2,0,0]=4 3500 B6R1.2 Br[C@@H]1CCNC1 MCULE-2455801012 [1,0,0,1,0,0|2,0,0]=4 3501 B6R1.2 Br[C@@H]1CCNC1 MCULE-8945784733 [1,0,0,1,0,0|2,0,0]=4 3502 B6R1.2 Br[C@H]1CCNC1 MCULE-5014033994 [1,0,0,1,0,0|2,0,0]=4 3503 B6R1.2 Br[C@H]1CCNC1 MCULE-5217617272 [1,0,0,1,0,0|2,0,0]=4 3504 B6R1.2 Br[C@H]1CCNC1 MCULE-8899453530 [1,0,0,1,0,0|2,0,0]=4 3505 B6R1.2 Br[C@H]1CCNC1 MCULE-9461718131 [1,0,0,1,0,0|2,0,0]=4 3506 B6R1.2 Br[C@H]1CCOC1 MCULE-7554969036 [1,0,0,1,0,0|1,0,0]=3 3507 B6R1.2 C1(CCNC1)C MCULE-2542646403 [1,0,0,1,0,0|2,0,0]=4 3508 B6R1.2 C1(CCNC1)C MCULE-4538835016 [1,0,0,1,0,0|2,0,0]=4 3509 B6R1.2 C1(CCNC1)F MCULE-2259566125 [1,0,0,1,0,0|2,0,0]=4 3510 B6R1.2 C1(CCNC1)F MCULE-3325393466 [1,0,0,1,0,0|2,0,0]=4 3511 B6R1.2 C1(CCNC1)O MCULE-2676539647 [1,0,0,1,0,0|1,0,0]=3 3512 B6R1.2 C1(CCNC1)O MCULE-4228466615 [1,0,0,1,0,0|1,0,0]=3 3513 B6R1.2 C1(CCOC1)I MCULE-4877322062 [1,0,0,1,0,0|1,0,0]=3 3514 B6R1.2 C1(CCOC1)N MCULE-2221007915 [1,0,0,1,0,0|1,0,0]=3 3515 B6R1.2 C1(CCOC1)N MCULE-3972931474 [1,0,0,1,0,0|1,0,0]=3 3516 B6R1.2 C1(CCOC1)O MCULE-3631749536 [1,0,0,1,0,0|0,0,0]=2 3517 B6R1.2 CC1C=CCC1 MCULE-1638534048 [1,0,0,1,0,0|2,0,0]=4 3518 B6R1.2 CC1CCCC1 MCULE-4702116068 [1,0,0,1,0,0|2,0,0]=4 3519 B6R1.2 CC1CCCN1 MCULE-4853624560 [1,0,0,1,0,0|2,0,0]=4 3520 B6R1.2 CC1CCCN1 MCULE-5939948024 [1,0,0,1,0,0|2,0,0]=4 3521 B6R1.2 CC1CCCN1 MCULE-6020011445 [1,0,0,1,0,0|2,0,0]=4 3522 B6R1.2 CC1CCCN1 MCULE-7855346849 [1,0,0,1,0,0|2,0,0]=4 3523 B6R1.2 CC1CCCO1 MCULE-2526138687 [1,0,0,1,0,0|1,0,0]=3 3524 B6R1.2 CC1CCCS1 MCULE-8372499972 [1,0,0,1,0,0|1,1,0]=4 3525 B6R1.2 CC1CCNC1 MCULE-6494098173 [1,0,0,1,0,0|2,0,0]=4 3526 B6R1.2 CC1CCNC1 MCULE-8260364514 [1,0,0,1,0,0|2,0,0]=4 3527 B6R1.2 CC1CCOC1 MCULE-6424683416 [1,0,0,1,0,0|1,0,0]=3 3528 B6R1.2 CC1CCSC1 MCULE-7445511318 [1,0,0,1,0,0|1,1,0]=4 3529 B6R1.2 CC1CNOC1 MCULE-1071803164 [1,0,0,1,0,0|2,0,0]=4 3530 B6R1.2 CC1CNOC1 MCULE-9455391174 [1,0,0,1,0,0|2,0,0]=4 3531 B6R1.2 CC1COCO1 MCULE-9332316279 [1,0,0,1,0,0|2,0,0]=4 3532 B6R1.2 CC1OCCO1 MCULE-2943809591 [1,0,0,1,0,0|2,0,0]=4 3533 B6R1.2 CN1CCOC1 MCULE-5504672404 [1,0,0,1,0,0|2,0,0]=4 3534 B6R1.2 C[C@@H]1CCCN1 MCULE-1038329474 [1,0,0,1,0,0|2,0,0]=4 3535 B6R1.2 C[C@@H]1CCCN1 MCULE-1829999308 [1,0,0,1,0,0|2,0,0]=4 3536 B6R1.2 C[C@@H]1CCCN1 MCULE-8644278041 [1,0,0,1,0,0|2,0,0]=4 3537 B6R1.2 C[C@@H]1CCCN1 MCULE-9243990647 [1,0,0,1,0,0|2,0,0]=4 3538 B6R1.2 C[C@@H]1CCNC1 MCULE-5345577321 [1,0,0,1,0,0|2,0,0]=4 3539 B6R1.2 C[C@@H]1CCNC1 MCULE-5749945455 [1,0,0,1,0,0|2,0,0]=4 3540 B6R1.2 C[C@@H]1CCNC1 MCULE-8967606188 [1,0,0,1,0,0|2,0,0]=4 3541 B6R1.2 C[C@@H]1CCNC1 MCULE-8996756392 [1,0,0,1,0,0|2,0,0]=4 3542 B6R1.2 C[C@H]1CCCN1 MCULE-2078024663 [1,0,0,1,0,0|2,0,0]=4 3543 B6R1.2 C[C@H]1CCCN1 MCULE-3113877345 [1,0,0,1,0,0|2,0,0]=4 3544 B6R1.2 C[C@H]1CCCN1 MCULE-3426869473 [1,0,0,1,0,0|2,0,0]=4 3545 B6R1.2 C[C@H]1CCCN1 MCULE-5093266679 [1,0,0,1,0,0|2,0,0]=4 3546 B6R1.2 C[C@H]1CCNC1 MCULE-1866792897 [1,0,0,1,0,0|2,0,0]=4 3547 B6R1.2 C[C@H]1CCNC1 MCULE-3817248567 [1,0,0,1,0,0|2,0,0]=4 3548 B6R1.2 C[C@H]1CCNC1 MCULE-7938243226 [1,0,0,1,0,0|2,0,0]=4 3549 B6R1.2 C[C@H]1CCNC1 MCULE-8895875203 [1,0,0,1,0,0|2,0,0]=4 3550 B6R1.2 ClC1CCCC1 MCULE-3285928655 [1,0,0,1,0,0|2,0,0]=4 3551 B6R1.2 ClC1CCNC1 MCULE-5659561118 [1,0,0,1,0,0|2,0,0]=4 3552 B6R1.2 ClC1CCNC1 MCULE-6180477494 [1,0,0,1,0,0|2,0,0]=4 3553 B6R1.2 ClC1CCNC1 MCULE-6964859207 [1,0,0,1,0,0|2,0,0]=4 3554 B6R1.2 ClC1CCNC1 MCULE-8389509440 [1,0,0,1,0,0|2,0,0]=4 3555 B6R1.2 ClC1CCOC1 MCULE-6903762147 [1,0,0,1,0,0|1,0,0]=3 3556 B6R1.2 Cl[C@@H]1CCNC1 MCULE-3218152098 [1,0,0,1,0,0|2,0,0]=4 3557 B6R1.2 Cl[C@@H]1CCNC1 MCULE-6728755007 [1,0,0,1,0,0|2,0,0]=4 3558 B6R1.2 Cl[C@@H]1CCNC1 MCULE-7223308304 [1,0,0,1,0,0|2,0,0]=4 3559 B6R1.2 Cl[C@@H]1CCNC1 MCULE-9699335522 [1,0,0,1,0,0|2,0,0]=4 3560 B6R1.2 Cl[C@H]1CCNC1 MCULE-1696981588 [1,0,0,1,0,0|2,0,0]=4 3561 B6R1.2 Cl[C@H]1CCNC1 MCULE-4535592624 [1,0,0,1,0,0|2,0,0]=4 3562 B6R1.2 Cl[C@H]1CCNC1 MCULE-4850151938 [1,0,0,1,0,0|2,0,0]=4 3563 B6R1.2 Cl[C@H]1CCNC1 MCULE-8947782807 [1,0,0,1,0,0|2,0,0]=4 3564 B6R1.2 FC1CCCC1 MCULE-1416016970 [1,0,0,1,0,0|2,0,0]=4 3565 B6R1.2 FC1CCNC1 MCULE-3601135445 [1,0,0,1,0,0|2,0,0]=4 3566 B6R1.2 FC1CCNC1 MCULE-8578750940 [1,0,0,1,0,0|2,0,0]=4 3567 B6R1.2 FC1CNOC1 MCULE-4837734523 [1,0,0,1,0,0|2,0,0]=4 3568 B6R1.2 FC1CNOC1 MCULE-6176254900 [1,0,0,1,0,0|2,0,0]=4 3569 B6R1.2 F[C@@H]1CCNC1 MCULE-4408739710 [1,0,0,1,0,0|2,0,0]=4 3570 B6R1.2 F[C@@H]1CCNC1 MCULE-5678498844 [1,0,0,1,0,0|2,0,0]=4 3571 B6R1.2 F[C@@H]1CCNC1 MCULE-5679054116 [1,0,0,1,0,0|2,0,0]=4 3572 B6R1.2 F[C@@H]1CCNC1 MCULE-7029204180 [1,0,0,1,0,0|2,0,0]=4 3573 B6R1.2 F[C@H]1CCNC1 MCULE-2854402872 [1,0,0,1,0,0|2,0,0]=4 3574 B6R1.2 F[C@H]1CCNC1 MCULE-4493640982 [1,0,0,1,0,0|2,0,0]=4 3575 B6R1.2 F[C@H]1CCNC1 MCULE-7441383471 [1,0,0,1,0,0|2,0,0]=4 3576 B6R1.2 F[C@H]1CCNC1 MCULE-7946601643 [1,0,0,1,0,0|2,0,0]=4 3577 B6R1.2 IC1CCCC1 MCULE-2705379744 [1,0,0,1,0,0|2,0,0]=4 3578 B6R1.2 IC1CCNC1 MCULE-3058541551 [1,0,0,1,0,0|2,0,0]=4 3579 B6R1.2 IC1CCNC1 MCULE-5326267139 [1,0,0,1,0,0|2,0,0]=4 3580 B6R1.2 IC1CCOC1 MCULE-1379775972 [1,0,0,1,0,0|1,0,0]=3 3581 B6R1.2 I[C@@H]1CCNC1 MCULE-3800433724 [1,0,0,1,0,0|2,0,0]=4 3582 B6R1.2 I[C@@H]1CCNC1 MCULE-3857825133 [1,0,0,1,0,0|2,0,0]=4 3583 B6R1.2 I[C@@H]1CCNC1 MCULE-7781267462 [1,0,0,1,0,0|2,0,0]=4 3584 B6R1.2 I[C@@H]1CCNC1 MCULE-7979843810 [1,0,0,1,0,0|2,0,0]=4 3585 B6R1.2 I[C@@H]1CCOC1 MCULE-2036157502 [1,0,0,1,0,0|1,0,0]=3 3586 B6R1.2 I[C@@H]1CCOC1 MCULE-4800752659 [1,0,0,1,0,0|1,0,0]=3 3587 B6R1.2 I[C@H]1CCNC1 MCULE-1218289403 [1,0,0,1,0,0|2,0,0]=4 3588 B6R1.2 I[C@H]1CCNC1 MCULE-7469922084 [1,0,0,1,0,0|2,0,0]=4 3589 B6R1.2 I[C@H]1CCOC1 MCULE-4242860607 [1,0,0,1,0,0|1,0,0]=3 3590 B6R1.2 I[C@H]1CCOC1 MCULE-7095404975 [1,0,0,1,0,0|1,0,0]=3 3591 B6R1.2 NC1CCCC1 MCULE-2292038009 [1,0,0,1,0,0|2,0,0]=4 3592 B6R1.2 NC1CCNC1 MCULE-2237528072 [1,0,0,1,0,0|2,0,0]=4 3593 B6R1.2 NC1CCNC1 MCULE-5167920547 [1,0,0,1,0,0|2,0,0]=4 3594 B6R1.2 NC1CCNC1 MCULE-5837785719 [1,0,0,1,0,0|2,0,0]=4 3595 B6R1.2 NC1CCOC1 MCULE-1276945018 [1,0,0,1,0,0|1,0,0]=3 3596 B6R1.2 NC1CCOC1 MCULE-8146259495 [1,0,0,1,0,0|1,0,0]=3 3597 B6R1.2 NC1CCSC1 MCULE-8972229387 [1,0,0,1,0,0|1,1,0]=4 3598 B6R1.2 NC1CCSC1 MCULE-9186640582 [1,0,0,1,0,0|1,1,0]=4 3599 B6R1.2 N[C@@H]1CCNC1 MCULE-6043697974 [1,0,0,1,0,0|2,0,0]=4 3600 B6R1.2 N[C@@H]1CCNC1 MCULE-8912264932 [1,0,0,1,0,0|2,0,0]=4 3601 B6R1.2 N[C@@H]1CCNC1 MCULE-9183647019 [1,0,0,1,0,0|2,0,0]=4 3602 B6R1.2 N[C@@H]1CCNC1 MCULE-9608760183 [1,0,0,1,0,0|2,0,0]=4 3603 B6R1.2 N[C@@H]1CCOC1 MCULE-1100136080 [1,0,0,1,0,0|1,0,0]=3 3604 B6R1.2 N[C@@H]1CCOC1 MCULE-4493278911 [1,0,0,1,0,0|1,0,0]=3 3605 B6R1.2 N[C@@H]1CCOC1 MCULE-5574536510 [1,0,0,1,0,0|1,0,0]=3 3606 B6R1.2 N[C@@H]1CCOC1 MCULE-7204677203 [1,0,0,1,0,0|1,0,0]=3 3607 B6R1.2 N[C@H]1CCNC1 MCULE-3573455998 [1,0,0,1,0,0|2,0,0]=4 3608 B6R1.2 N[C@H]1CCNC1 MCULE-3988158945 [1,0,0,1,0,0|2,0,0]=4 3609 B6R1.2 N[C@H]1CCNC1 MCULE-4526890579 [1,0,0,1,0,0|2,0,0]=4 3610 B6R1.2 N[C@H]1CCNC1 MCULE-8548728927 [1,0,0,1,0,0|2,0,0]=4 3611 B6R1.2 N[C@H]1CCOC1 MCULE-2273771439 [1,0,0,1,0,0|1,0,0]=3 3612 B6R1.2 N[C@H]1CCOC1 MCULE-3567904137 [1,0,0,1,0,0|1,0,0]=3 3613 B6R1.2 N[C@H]1CCOC1 MCULE-5268616156 [1,0,0,1,0,0|1,0,0]=3 3614 B6R1.2 N[C@H]1CCOC1 MCULE-7351975857 [1,0,0,1,0,0|1,0,0]=3 3615 B6R1.2 O=C1CCOC1 MCULE-2031733910 [1,0,0,1,0,0|0,0,2]=4 3616 B6R1.2 OC1C=CCC1 MCULE-3857764876 [1,0,0,1,0,0|1,0,1]=4 3617 B6R1.2 OC1CC=CC1 MCULE-6176562196 [1,0,0,1,0,0|1,0,1]=4 3618 B6R1.2 OC1CCCC1 MCULE-1758440264 [1,0,0,1,0,0|1,0,0]=3 3619 B6R1.2 OC1CCCN1 MCULE-4787168972 [1,0,0,1,0,0|2,0,0]=4 3620 B6R1.2 OC1CCCO1 MCULE-9632627344 [1,0,0,1,0,0|2,0,0]=4 3621 B6R1.2 OC1CCNC1 MCULE-4307402606 [1,0,0,1,0,0|1,0,0]=3 3622 B6R1.2 OC1CCNC1 MCULE-6745480350 [1,0,0,1,0,0|1,0,0]=3 3623 B6R1.2 OC1CCOC1 MCULE-4469581028 [1,0,0,1,0,0|0,0,0]=2 3624 B6R1.2 OC1CCSC1 MCULE-9796808599 [1,0,0,1,0,0|0,1,0]=3 3625 B6R1.2 OC1CNOC1 MCULE-3414700581 [1,0,0,1,0,0|1,0,0]=3 3626 B6R1.2 OC1CNOC1 MCULE-8163403090 [1,0,0,1,0,0|1,0,0]=3 3627 B6R1.2 OC1CNOC1 MCULE-8644852072 [1,0,0,1,0,0|1,0,0]=3 3628 B6R1.2 OC1C[NH2+]OC1 MCULE-7865131527 [1,0,0,1,0,0|1,0,0]=3 3629 B6R1.2 O[C@@H]1CCNC1 MCULE-8116497337 [1,0,0,1,0,0|1,0,0]=3 3630 B6R1.2 O[C@@H]1CCNC1 MCULE-8578068948 [1,0,0,1,0,0|1,0,0]=3 3631 B6R1.2 O[C@@H]1CCNC1 MCULE-9094582248 [1,0,0,1,0,0|1,0,0]=3 3632 B6R1.2 O[C@@H]1CCNC1 MCULE-9933593352 [1,0,0,1,0,0|1,0,0]=3 3633 B6R1.2 O[C@@H]1CCOC1 MCULE-7739141732 [1,0,0,1,0,0|0,0,0]=2 3634 B6R1.2 O[C@@H]1CCOC1 MCULE-8344812226 [1,0,0,1,0,0|0,0,0]=2 3635 B6R1.2 O[C@@H]1CCOC1 MCULE-9098074990 [1,0,0,1,0,0|0,0,0]=2 3636 B6R1.2 O[C@@H]1CCSC1 MCULE-3532754705 [1,0,0,1,0,0|0,1,0]=3 3637 B6R1.2 O[C@@H]1CCSC1 MCULE-5800407146 [1,0,0,1,0,0|0,1,0]=3 3638 B6R1.2 O[C@@H]1CNOC1 MCULE-1481945185 [1,0,0,1,0,0|1,0,0]=3 3639 B6R1.2 O[C@@H]1CNOC1 MCULE-4156521353 [1,0,0,1,0,0|1,0,0]=3 3640 B6R1.2 O[C@@H]1CNOC1 MCULE-5692816168 [1,0,0,1,0,0|1,0,0]=3 3641 B6R1.2 O[C@@H]1CNOC1 MCULE-6838604903 [1,0,0,1,0,0|1,0,0]=3 3642 B6R1.2 O[C@H]1CCNC1 MCULE-1100098088 [1,0,0,1,0,0|1,0,0]=3 3643 B6R1.2 O[C@H]1CCNC1 MCULE-3493644065 [1,0,0,1,0,0|1,0,0]=3 3644 B6R1.2 O[C@H]1CCNC1 MCULE-3778918259 [1,0,0,1,0,0|1,0,0]=3 3645 B6R1.2 O[C@H]1CCNC1 MCULE-4680162054 [1,0,0,1,0,0|1,0,0]=3 3646 B6R1.2 O[C@H]1CCOC1 MCULE-8518846297 [1,0,0,1,0,0|0,0,0]=2 3647 B6R1.2 O[C@H]1CCOC1 MCULE-9544747995 [1,0,0,1,0,0|0,0,0]=2 3648 B6R1.2 O[C@H]1CNOC1 MCULE-1746817114 [1,0,0,1,0,0|1,0,0]=3 3649 B6R1.2 O[C@H]1CNOC1 MCULE-4469396812 [1,0,0,1,0,0|1,0,0]=3 3650 B6R1.2 O[C@H]1CNOC1 MCULE-7167785164 [1,0,0,1,0,0|1,0,0]=3 3651 B6R1.2 O[C@H]1CNOC1 MCULE-8409877332 [1,0,0,1,0,0|1,0,0]=3 3652 B6R1.2 SC1CCCC1 MCULE-5932400506 [1,0,0,1,0,0|1,1,0]=4 3653 B6R1.2 SC1CCOC1 MCULE-9247906418 [1,0,0,1,0,0|0,1,0]=3 3654 B6R1.2 SC1CCSC1 MCULE-5955380477 [1,0,0,1,0,0|0,2,0]=4 3655 B6R1.2 [NH3+]C1CC[NH2+]C1 MCULE-3374468196 [1,0,0,1,0,0|2,0,0]=4 3656 B6R1.3 BrCCC1CC1 MCULE-3454213225 [1,0,0,1,0,0|2,0,0]=4 3657 B6R1.3 BrCCC1CO1 MCULE-9889314000 [1,0,0,1,0,0|1,0,0]=3 3658 B6R1.3 BrCC[C@@H]1CO1 MCULE-7015242723 [1,0,0,1,0,0|1,0,0]=3 3659 B6R1.3 BrCC[C@H]1CO1 MCULE-3286755305 [1,0,0,1,0,0|1,0,0]=3 3660 B6R1.3 BrCC[C@H]1CO1 MCULE-3512143037 [1,0,0,1,0,0|1,0,0]=3 3661 B6R1.3 CCCC1CO1 MCULE-5080039224 [1,0,0,1,0,0|1,0,0]=3 3662 B6R1.3 CCC[C@@H]1CO1 MCULE-1815222100 [1,0,0,1,0,0|1,0,0]=3 3663 B6R1.3 CCC[C@H]1CO1 MCULE-9952368131 [1,0,0,1,0,0|1,0,0]=3 3664 B6R1.3 COCC1CO1 MCULE-3193889854 [1,0,0,1,0,0|2,0,0]=4 3665 B6R1.3 COC[C@@H]1CO1 MCULE-8086795507 [1,0,0,1,0,0|2,0,0]=4 3666 B6R1.3 COC[C@@H]1CO1 MCULE-8921875584 [1,0,0,1,0,0|2,0,0]=4 3667 B6R1.3 COC[C@H]1CO1 MCULE-7210190703 [1,0,0,1,0,0|2,0,0]=4 3668 B6R1.3 COC[C@H]1CO1 MCULE-8979404390 [1,0,0,1,0,0|2,0,0]=4 3669 B6R1.3 CSCC1CO1 MCULE-9014850650 [1,0,0,1,0,0|2,0,0]=4 3670 B6R1.3 ClCCC1CC1 MCULE-5665496795 [1,0,0,1,0,0|2,0,0]=4 3671 B6R1.3 ClCCC1CO1 MCULE-2772510260 [1,0,0,1,0,0|1,0,0]=3 3672 B6R1.3 ICCC1CC1 MCULE-5518738700 [1,0,0,1,0,0|2,0,0]=4 3673 B6R1.3 NCCC1CC1 MCULE-8459735325 [1,0,0,1,0,0|2,0,0]=4 3674 B6R1.3 NCCC1CC1 MCULE-9646218986 [1,0,0,1,0,0|2,0,0]=4 3675 B6R1.3 OCCC1CC1 MCULE-1360348684 [1,0,0,1,0,0|1,0,0]=3 3676 B6R1.3 OCCC1CO1 MCULE-6523000607 [1,0,0,1,0,0|0,0,0]=2 3677 B6R1.3 OCCN1CC1 MCULE-3845187783 [1,0,0,1,0,0|2,0,0]=4 3678 B6R1.3 OCC[C@@H]1CO1 MCULE-4797533590 [1,0,0,1,0,0|0,0,0]=2 3679 B6R1.3 OCC[C@@H]1CO1 MCULE-6833850805 [1,0,0,1,0,0|0,0,0]=2 3680 B6R1.3 OCC[C@H]1CO1 MCULE-3560802495 [1,0,0,1,0,0|0,0,0]=2 3681 B6R1.3 OCC[C@H]1CO1 MCULE-8738926598 [1,0,0,1,0,0|0,0,0]=2 3682 B6R1.5 CC1CC(=O)O1 MCULE-9285847382 [1,0,0,1,0,0|0,0,2]=4 3683 B6R1.5 CC1CC(C1)N MCULE-5323299846 [1,0,0,1,0,0|2,0,0]=4 3684 B6R1.5 CC1CC(C1)N MCULE-9940885824 [1,0,0,1,0,0|2,0,0]=4 3685 B6R1.5 CC1CC(C1)O MCULE-8612661286 [1,0,0,1,0,0|1,0,0]=3 3686 B6R1.5 CC1CC(N1)C MCULE-2112479012 [1,0,0,1,0,0|2,0,0]=4 3687 B6R1.5 CC1CC(N1)C MCULE-4224653730 [1,0,0,1,0,0|2,0,0]=4 3688 B6R1.5 CN1CC(C1)O MCULE-2897194266 [1,0,0,1,0,0|2,0,0]=4 3689 B6R1.5 CN1CC(C1)O MCULE-3717153558 [1,0,0,1,0,0|2,0,0]=4 3690 B6R1.5 CN1CC(C1)O MCULE-7229396078 [1,0,0,1,0,0|2,0,0]=4 3691 B6R1.5 C[C@@H]1CC(=O)O1 MCULE-3257475519 [1,0,0,1,0,0|0,0,2]=4 3692 B6R1.5 C[C@@H]1C[C@H](N1)C MCULE-1994890312 [1,0,0,1,0,0|2,0,0]=4 3693 B6R1.5 C[C@@H]1C[C@H](N1)C MCULE-7235151096 [1,0,0,1,0,0|2,0,0]=4 3694 B6R1.5 C[C@H]1C[C@@H](C1)N MCULE-1535311916 [1,0,0,1,0,0|2,0,0]=4 3695 B6R1.5 C[C@H]1C[C@@H](C1)N MCULE-2831484375 [1,0,0,1,0,0|2,0,0]=4 3696 B6R1.5 C[C@H]1C[C@@H](N1)C MCULE-4062075526 [1,0,0,1,0,0|2,0,0]=4 3697 B6R1.5 C[C@H]1C[C@@H](N1)C MCULE-8779826872 [1,0,0,1,0,0|2,0,0]=4 3698 B6R1.5 C[C@H]1C[C@@H](N1)C MCULE-9842353775 [1,0,0,1,0,0|2,0,0]=4 3699 B6R1.5 C[C@H]1C[C@@H](N1)C MCULE-9945333960 [1,0,0,1,0,0|2,0,0]=4 3700 B6R1.5 C[C@H]1C[C@H](C1)N MCULE-7323273959 [1,0,0,1,0,0|2,0,0]=4 3701 B6R1.5 C[C@H]1C[C@H](C1)N MCULE-9517005721 [1,0,0,1,0,0|2,0,0]=4 3702 B6R1.5 C[C@H]1C[C@H](C1)O MCULE-9757332081 [1,0,0,1,0,0|1,0,0]=3 3703 B6R1.5 C[C@H]1C[C@H](N1)C MCULE-1014047015 [1,0,0,1,0,0|2,0,0]=4 3704 B6R1.5 C[C@H]1C[C@H](N1)C MCULE-9280852387 [1,0,0,1,0,0|2,0,0]=4 3705 B6R1.5 NC1CC(C1)Br MCULE-1024702653 [1,0,0,1,0,0|2,0,0]=4 3706 B6R1.5 NC1CC(C1)Br MCULE-6956910745 [1,0,0,1,0,0|2,0,0]=4 3707 B6R1.5 NC1CC(C1)Cl MCULE-2079032271 [1,0,0,1,0,0|2,0,0]=4 3708 B6R1.5 NC1CC(C1)Cl MCULE-9907911910 [1,0,0,1,0,0|2,0,0]=4 3709 B6R1.5 NC1CC(C1)F MCULE-8668562856 [1,0,0,1,0,0|2,0,0]=4 3710 B6R1.5 NC1CC(C1)F MCULE-9413732351 [1,0,0,1,0,0|2,0,0]=4 3711 B6R1.5 NC1CC(C1)N MCULE-2499828215 [1,0,0,1,0,0|2,0,0]=4 3712 B6R1.5 NC1CC(C1)N MCULE-9585725038 [1,0,0,1,0,0|2,0,0]=4 3713 B6R1.5 NC1CC(C1)O MCULE-3800806511 [1,0,0,1,0,0|1,0,0]=3 3714 B6R1.5 NC1CC(C1)O MCULE-4101412744 [1,0,0,1,0,0|1,0,0]=3 3715 B6R1.5 NN1CC(C1)O MCULE-1883589988 [1,0,0,1,0,0|2,0,0]=4 3716 B6R1.5 NN1CC(C1)O MCULE-4736517920 [1,0,0,1,0,0|2,0,0]=4 3717 B6R1.5 N[C@H]1C[C@@H](C1)Br MCULE-2563959776 [1,0,0,1,0,0|2,0,0]=4 3718 B6R1.5 N[C@H]1C[C@@H](C1)Br MCULE-4159438704 [1,0,0,1,0,0|2,0,0]=4 3719 B6R1.5 N[C@H]1C[C@@H](C1)F MCULE-1693657713 [1,0,0,1,0,0|2,0,0]=4 3720 B6R1.5 N[C@H]1C[C@@H](C1)F MCULE-2842964955 [1,0,0,1,0,0|2,0,0]=4 3721 B6R1.5 N[C@H]1C[C@@H](C1)N MCULE-7371432215 [1,0,0,1,0,0|2,0,0]=4 3722 B6R1.5 N[C@H]1C[C@@H](C1)O MCULE-3690359453 [1,0,0,1,0,0|1,0,0]=3 3723 B6R1.5 N[C@H]1C[C@@H](C1)O MCULE-6031478808 [1,0,0,1,0,0|1,0,0]=3 3724 B6R1.5 N[C@H]1C[C@H](C1)F MCULE-7248556800 [1,0,0,1,0,0|2,0,0]=4 3725 B6R1.5 N[C@H]1C[C@H](C1)F MCULE-8169894230 [1,0,0,1,0,0|2,0,0]=4 3726 B6R1.5 N[C@H]1C[C@H](C1)N MCULE-2358029728 [1,0,0,1,0,0|2,0,0]=4 3727 B6R1.5 N[C@H]1C[C@H](C1)N MCULE-8703864989 [1,0,0,1,0,0|2,0,0]=4 3728 B6R1.5 N[C@H]1C[C@H](C1)O MCULE-2367486822 [1,0,0,1,0,0|1,0,0]=3 3729 B6R1.5 N[C@H]1C[C@H](C1)O MCULE-2477923057 [1,0,0,1,0,0|1,0,0]=3 3730 B6R1.5 O=C1CC(C1)O MCULE-7099112258 [1,0,0,1,0,0|0,0,2]=4 3731 B6R1.5 OC1CC(C1)Br MCULE-8550195809 [1,0,0,1,0,0|1,0,0]=3 3732 B6R1.5 OC1CC(C1)F MCULE-7130501241 [1,0,0,1,0,0|1,0,0]=3 3733 B6R1.5 OC1CC(C1)O MCULE-4391504671 [1,0,0,1,0,0|0,0,0]=2 3734 B6R1.5 O[C@H]1C[C@@H](C1)F MCULE-8960643165 [1,0,0,1,0,0|1,0,0]=3 3735 B6R1.5 O[C@H]1C[C@@H](C1)O MCULE-5524471729 [1,0,0,1,0,0|0,0,0]=2 3736 B6R1.5 O[C@H]1C[C@H](C1)O MCULE-7725166436 [1,0,0,1,0,0|0,0,0]=2 3737 B6R1.5 [C@@H]1(C[C@@H](C1)N)N MCULE-6268630823 [1,0,0,1,0,0|2,0,0]=4 3738 B6R1.5 [C@@H]1(C[C@H](C1)F)O MCULE-5214761916 [1,0,0,1,0,0|1,0,0]=3 3739 B6R1.8 C=C1CC1CO MCULE-4338601055 [1,0,0,1,0,0|1,0,1]=4 3740 B6R1.8 CC1CC1CN MCULE-2810102174 [1,0,0,1,0,0|2,0,0]=4 3741 B6R1.8 CC1CC1CN MCULE-7518062300 [1,0,0,1,0,0|2,0,0]=4 3742 B6R1.8 CC1CC1CO MCULE-5196594569 [1,0,0,1,0,0|1,0,0]=3 3743 B6R1.8 CC1OC1CBr MCULE-3133107383 [1,0,0,1,0,0|1,0,0]=3 3744 B6R1.8 CC1OC1CO MCULE-1680425960 [1,0,0,1,0,0|0,0,0]=2 3745 B6R1.8 CCC1CC1N MCULE-6304873051 [1,0,0,1,0,0|2,0,0]=4 3746 B6R1.8 CC[C@@H]1C[C@@H]1N MCULE-9218626187 [1,0,0,1,0,0|2,0,0]=4 3747 B6R1.8 CC[C@@H]1C[C@H]1N MCULE-5365117215 [1,0,0,1,0,0|2,0,0]=4 3748 B6R1.8 CC[C@@H]1C[C@H]1N MCULE-9993971387 [1,0,0,1,0,0|2,0,0]=4 3749 B6R1.8 CC[C@H]1C[C@@H]1N MCULE-5971477946 [1,0,0,1,0,0|2,0,0]=4 3750 B6R1.8 CC[C@H]1C[C@H]1N MCULE-4387456908 [1,0,0,1,0,0|2,0,0]=4 3751 B6R1.8 C[C@@H]1C[C@@H]1CN MCULE-5971817939 [1,0,0,1,0,0|2,0,0]=4 3752 B6R1.8 C[C@@H]1C[C@@H]1CO MCULE-7143685612 [1,0,0,1,0,0|1,0,0]=3 3753 B6R1.8 C[C@@H]1C[C@H]1CN MCULE-3418148363 [1,0,0,1,0,0|2,0,0]=4 3754 B6R1.8 C[C@@H]1C[C@H]1CN MCULE-3519756910 [1,0,0,1,0,0|2,0,0]=4 3755 B6R1.8 C[C@@H]1C[C@H]1CN MCULE-3649923384 [1,0,0,1,0,0|2,0,0]=4 3756 B6R1.8 C[C@@H]1C[C@H]1CN MCULE-8330237030 [1,0,0,1,0,0|2,0,0]=4 3757 B6R1.8 C[C@@H]1C[C@H]1CO MCULE-3741611930 [1,0,0,1,0,0|1,0,0]=3 3758 B6R1.8 C[C@H]1C[C@@H]1CN MCULE-9856477951 [1,0,0,1,0,0|2,0,0]=4 3759 B6R1.8 C[C@H]1C[C@@H]1CO MCULE-2846304871 [1,0,0,1,0,0|1,0,0]=3 3760 B6R1.8 C[C@H]1C[C@@H]1CO MCULE-9275931471 [1,0,0,1,0,0|1,0,0]=3 3761 B6R1.8 C[C@H]1C[C@H]1CN MCULE-4949172422 [1,0,0,1,0,0|2,0,0]=4 3762 B6R1.8 C[C@H]1C[C@H]1CO MCULE-3828120088 [1,0,0,1,0,0|1,0,0]=3 3763 B6R1.8 C[C@H]1C[C@H]1CO MCULE-8442952820 [1,0,0,1,0,0|1,0,0]=3 3764 B6R1.8 NC1CC1CO MCULE-7666097515 [1,0,0,1,0,0|1,0,0]=3 3765 B6R1.8 NCC1CC1N MCULE-4864283129 [1,0,0,1,0,0|2,0,0]=4 3766 B6R1.8 NCC1CC1N MCULE-7029010792 [1,0,0,1,0,0|2,0,0]=4 3767 B6R1.8 OCC1CC1Cl MCULE-1321755136 [1,0,0,1,0,0|1,0,0]=3 3768 B6R1.8 OCC1C[C@@H]1F MCULE-2637570432 [1,0,0,1,0,0|1,0,0]=3 3769 B6R1.8 OC[C@@H]1C[C@@H]1F MCULE-9090620006 [1,0,0,1,0,0|1,0,0]=3 3770 B6R1.8 OC[C@@H]1C[C@H]1Br MCULE-8344332753 [1,0,0,1,0,0|1,0,0]=3 3771 B6R1.8 OC[C@@H]1C[C@H]1F MCULE-6282037947 [1,0,0,1,0,0|1,0,0]=3 3772 B6R1.8 OC[C@@H]1C[C@H]1F MCULE-8944803823 [1,0,0,1,0,0|1,0,0]=3 3773 B6R1.8 OC[C@H]1C[C@@H]1F MCULE-3157094299 [1,0,0,1,0,0|1,0,0]=3 3774 B6R1.9 CC1(CC1Br)C MCULE-4060390279 [1,0,0,1,0,0|2,0,0]=4 3775 B6R1.9 CC1(CC1Br)N MCULE-2545863228 [1,0,0,1,0,0|2,0,0]=4 3776 B6R1.9 CC1(CC1Br)N MCULE-6976008667 [1,0,0,1,0,0|2,0,0]=4 3777 B6R1.9 CC1(CC1N)C MCULE-3767513819 [1,0,0,1,0,0|2,0,0]=4 3778 B6R1.9 CC1(CC1N)C MCULE-9259559793 [1,0,0,1,0,0|2,0,0]=4 3779 B6R1.9 CC1(CC1O)C MCULE-2207251369 [1,0,0,1,0,0|1,0,0]=3 3780 B6R1.9 CC1(C[C@@H]1N)C MCULE-8232974349 [1,0,0,1,0,0|2,0,0]=4 3781 B6R1.9 CC1(C[C@@H]1N)C MCULE-9299327749 [1,0,0,1,0,0|2,0,0]=4 3782 B6R1.9 CC1(C[C@H]1N)C MCULE-2015844172 [1,0,0,1,0,0|2,0,0]=4 3783 B6R1.9 CC1(C[C@H]1N)C MCULE-8301129744 [1,0,0,1,0,0|2,0,0]=4 3784 B6R1.9 CC1CC1(C)N MCULE-2748884505 [1,0,0,1,0,0|2,0,0]=4 3785 B6R1.9 CC1CC1(C)N MCULE-6309103404 [1,0,0,1,0,0|2,0,0]=4 3786 B6R1.9 OC1CC1(F)F MCULE-7582982777 [1,0,0,1,0,0|2,0,0]=4 3787 B6R1.10 CC1(CCC1)N MCULE-1932351179 [1,0,0,1,0,0|2,0,0]=4 3788 B6R1.10 CC1(CCC1)N MCULE-9177696302 [1,0,0,1,0,0|2,0,0]=4 3789 B6R1.10 CC1(CCC1)O MCULE-4021675717 [1,0,0,1,0,0|1,0,0]=3 3790 B6R1.10 CC1(CCN1)C MCULE-2285435720 [1,0,0,1,0,0|2,0,0]=4 3791 B6R1.10 CC1(CCN1)C MCULE-3069932253 [1,0,0,1,0,0|2,0,0]=4 3792 B6R1.10 CC1(CNC1)O MCULE-3071077269 [1,0,0,1,0,0|2,0,0]=4 3793 B6R1.10 CC1(CNC1)O MCULE-9470244891 [1,0,0,1,0,0|2,0,0]=4 3794 B6R1.10 CC1(COC1)O MCULE-9813168910 [1,0,0,1,0,0|2,0,0]=4 3795 B6R1.10 CC1(CSC1)O MCULE-9703448589 [1,0,0,1,0,0|2,0,0]=4 3796 B6R1.11 C=C(C)C1CO1 MCULE-3656533343 [1,0,0,1,0,0|1,0,1]=4 3797 B6R1.11 CC(=O)C1CO1 MCULE-4329154079 [1,0,0,1,0,0|0,0,2]=4 3798 B6R1.11 CC(C)C1CO1 MCULE-6294069717 [1,0,0,1,0,0|1,0,0]=3 3799 B6R1.11 CC(C)[C@@H]1CO1 MCULE-9181831987 [1,0,0,1,0,0|1,0,0]=3 3800 B6R1.11 CC(C)[C@H]1CO1 MCULE-1978831452 [1,0,0,1,0,0|1,0,0]=3 3801 B6R1.11 CC(Cl)C1CC1 MCULE-7361335709 [1,0,0,1,0,0|2,0,0]=4 3802 B6R1.11 CC(N)C1CC1 MCULE-2052303800 [1,0,0,1,0,0|2,0,0]=4 3803 B6R1.11 CC(N)C1CC1 MCULE-3007763115 [1,0,0,1,0,0|2,0,0]=4 3804 B6R1.11 CC(N)C1CC1 MCULE-3459276996 [1,0,0,1,0,0|2,0,0]=4 3805 B6R1.11 CC(N)C1CC1 MCULE-6761961556 [1,0,0,1,0,0|2,0,0]=4 3806 B6R1.11 CC(O)C1CC1 MCULE-8628810684 [1,0,0,1,0,0|1,0,0]=3 3807 B6R1.11 CC(O)C1CO1 MCULE-2044990126 [1,0,0,1,0,0|0,0,0]=2 3808 B6R1.11 C[C@@H](N)C1CC1 MCULE-2097889079 [1,0,0,1,0,0|2,0,0]=4 3809 B6R1.11 C[C@@H](N)C1CC1 MCULE-3667125695 [1,0,0,1,0,0|2,0,0]=4 3810 B6R1.11 C[C@@H](N)C1CC1 MCULE-4529741221 [1,0,0,1,0,0|2,0,0]=4 3811 B6R1.11 C[C@@H](N)C1CC1 MCULE-4996656085 [1,0,0,1,0,0|2,0,0]=4 3812 B6R1.11 C[C@@H](O)C1CC1 MCULE-8359847821 [1,0,0,1,0,0|1,0,0]=3 3813 B6R1.11 C[C@H](N)C1CC1 MCULE-5080052640 [1,0,0,1,0,0|2,0,0]=4 3814 B6R1.11 C[C@H](N)C1CC1 MCULE-8331040870 [1,0,0,1,0,0|2,0,0]=4 3815 B6R1.11 C[C@H](N)C1CC1 MCULE-8367240790 [1,0,0,1,0,0|2,0,0]=4 3816 B6R1.11 C[C@H](N)C1CC1 MCULE-8726268701 [1,0,0,1,0,0|2,0,0]=4 3817 B6R1.11 C[C@H](O)C1CC1 MCULE-2458075152 [1,0,0,1,0,0|1,0,0]=3 3818 B6R1.11 O=C(O)C1CO1 MCULE-2152916793 [1,0,0,1,0,0|1,0,1]=4 3819 B6R1.11 O=C(O)[C@H]1CO1 MCULE-5204459723 [1,0,0,1,0,0|1,0,1]=4 3820 B6R1.11 O=C(O)[C@H]1CO1 MCULE-6983707093 [1,0,0,1,0,0|1,0,1]=4 3821 B6R1.4 CC1CCC1N MCULE-9634057678 [1,0,0,1,0,0|1,0,0]=3 3822 B6R1.4 CC1CCC1N MCULE-9849489304 [1,0,0,1,0,0|1,0,0]=3 3823 B6R1.4 CC1CCC1O MCULE-3852133104 [1,0,0,1,0,0|1,0,0]=3 3824 B6R1.4 CC1CNC1C MCULE-6217110869 [1,0,0,1,0,0|2,0,0]=4 3825 B6R1.4 CC1CNC1C MCULE-8966220604 [1,0,0,1,0,0|2,0,0]=4 3826 B6R1.4 CC1NCC1F MCULE-2205876595 [1,0,0,1,0,0|2,0,0]=4 3827 B6R1.4 CC1NCC1F MCULE-3575637458 [1,0,0,1,0,0|2,0,0]=4 3828 B6R1.4 CC1NCC1O MCULE-6512695808 [1,0,0,1,0,0|2,0,0]=4 3829 B6R1.4 CC1NCC1O MCULE-8357296054 [1,0,0,1,0,0|2,0,0]=4 3830 B6R1.4 CC1OCC1=O MCULE-7718609686 [1,0,0,1,0,0|1,0,1]=4 3831 B6R1.4 CC1OCC1O MCULE-1893283492 [1,0,0,1,0,0|1,0,0]=3 3832 B6R1.4 C[C@@H]1CC[C@@H]1N MCULE-9803413081 [1,0,0,1,0,0|1,0,0]=3 3833 B6R1.4 C[C@@H]1CC[C@H]1N MCULE-3888655890 [1,0,0,1,0,0|1,0,0]=3 3834 B6R1.4 C[C@@H]1CN[C@@H]1C MCULE-5099590573 [1,0,0,1,0,0|2,0,0]=4 3835 B6R1.4 C[C@@H]1CN[C@@H]1C MCULE-6754257002 [1,0,0,1,0,0|2,0,0]=4 3836 B6R1.4 C[C@@H]1CN[C@@H]1C MCULE-7084262632 [1,0,0,1,0,0|2,0,0]=4 3837 B6R1.4 C[C@@H]1CN[C@@H]1C MCULE-9147724667 [1,0,0,1,0,0|2,0,0]=4 3838 B6R1.4 C[C@@H]1NC[C@@H]1F MCULE-2104999017 [1,0,0,1,0,0|2,0,0]=4 3839 B6R1.4 C[C@@H]1NC[C@@H]1F MCULE-9859591204 [1,0,0,1,0,0|2,0,0]=4 3840 B6R1.4 C[C@@H]1NC[C@@H]1O MCULE-1528414534 [1,0,0,1,0,0|2,0,0]=4 3841 B6R1.4 C[C@@H]1NC[C@@H]1O MCULE-2910306067 [1,0,0,1,0,0|2,0,0]=4 3842 B6R1.4 C[C@@H]1NC[C@@H]1O MCULE-3197698089 [1,0,0,1,0,0|2,0,0]=4 3843 B6R1.4 C[C@@H]1NC[C@@H]1O MCULE-3295326997 [1,0,0,1,0,0|2,0,0]=4 3844 B6R1.4 C[C@@H]1NC[C@@H]1O MCULE-5640695802 [1,0,0,1,0,0|2,0,0]=4 3845 B6R1.4 C[C@@H]1NC[C@@H]1O MCULE-7598216076 [1,0,0,1,0,0|2,0,0]=4 3846 B6R1.4 C[C@@H]1NC[C@H]1F MCULE-2384338566 [1,0,0,1,0,0|2,0,0]=4 3847 B6R1.4 C[C@@H]1NC[C@H]1F MCULE-3761027062 [1,0,0,1,0,0|2,0,0]=4 3848 B6R1.4 C[C@@H]1NC[C@H]1F MCULE-7625337051 [1,0,0,1,0,0|2,0,0]=4 3849 B6R1.4 C[C@@H]1NC[C@H]1F MCULE-8482078532 [1,0,0,1,0,0|2,0,0]=4 3850 B6R1.4 C[C@@H]1NC[C@H]1O MCULE-3152396704 [1,0,0,1,0,0|2,0,0]=4 3851 B6R1.4 C[C@@H]1NC[C@H]1O MCULE-3248209918 [1,0,0,1,0,0|2,0,0]=4 3852 B6R1.4 C[C@@H]1NC[C@H]1O MCULE-3575939824 [1,0,0,1,0,0|2,0,0]=4 3853 B6R1.4 C[C@@H]1NC[C@H]1O MCULE-4120662394 [1,0,0,1,0,0|2,0,0]=4 3854 B6R1.4 C[C@H]1CC[C@@H]1N MCULE-1445146965 [1,0,0,1,0,0|1,0,0]=3 3855 B6R1.4 C[C@H]1CC[C@H]1N MCULE-3329522369 [1,0,0,1,0,0|1,0,0]=3 3856 B6R1.4 C[C@H]1NC[C@@H]1F MCULE-6266484815 [1,0,0,1,0,0|2,0,0]=4 3857 B6R1.4 C[C@H]1NC[C@@H]1F MCULE-9525975864 [1,0,0,1,0,0|2,0,0]=4 3858 B6R1.4 C[C@H]1NC[C@@H]1O MCULE-3510002118 [1,0,0,1,0,0|2,0,0]=4 3859 B6R1.4 C[C@H]1NC[C@@H]1O MCULE-6901722671 [1,0,0,1,0,0|2,0,0]=4 3860 B6R1.4 C[C@H]1NC[C@H]1F MCULE-6303998999 [1,0,0,1,0,0|2,0,0]=4 3861 B6R1.4 C[C@H]1NC[C@H]1F MCULE-8897044344 [1,0,0,1,0,0|2,0,0]=4 3862 B6R1.4 C[C@H]1NC[C@H]1O MCULE-1733557375 [1,0,0,1,0,0|2,0,0]=4 3863 B6R1.4 C[C@H]1NC[C@H]1O MCULE-3026150373 [1,0,0,1,0,0|2,0,0]=4 3864 B6R1.4 C[C@H]1NC[C@H]1O MCULE-7386387747 [1,0,0,1,0,0|2,0,0]=4 3865 B6R1.4 C[C@H]1NC[C@H]1O MCULE-7405032693 [1,0,0,1,0,0|2,0,0]=4 3866 B6R1.4 NC1CCC1=O MCULE-3868209809 [1,0,0,1,0,0|0,0,2]=4 3867 B6R1.4 NC1CCC1=O MCULE-9741389143 [1,0,0,1,0,0|0,0,2]=4 3868 B6R1.4 NC1CCC1F MCULE-1403984623 [1,0,0,1,0,0|1,0,0]=3 3869 B6R1.4 NC1CCC1F MCULE-8216841286 [1,0,0,1,0,0|1,0,0]=3 3870 B6R1.4 NC1CCC1N MCULE-6052332328 [1,0,0,1,0,0|1,0,0]=3 3871 B6R1.4 NC1CCC1O MCULE-4636397534 [1,0,0,1,0,0|0,0,0]=2 3872 B6R1.4 NC1CCC1O MCULE-7148132261 [1,0,0,1,0,0|0,0,0]=2 3873 B6R1.4 NC1COC1=O MCULE-6998565452 [1,0,0,1,0,0|0,0,2]=4 3874 B6R1.4 N[C@@H]1CC[C@@H]1O MCULE-1054283097 [1,0,0,1,0,0|0,0,0]=2 3875 B6R1.4 N[C@@H]1CC[C@@H]1O MCULE-3905992171 [1,0,0,1,0,0|0,0,0]=2 3876 B6R1.4 N[C@@H]1CC[C@@H]1O MCULE-6111990015 [1,0,0,1,0,0|0,0,0]=2 3877 B6R1.4 N[C@@H]1CC[C@@H]1O MCULE-9101755956 [1,0,0,1,0,0|0,0,0]=2 3878 B6R1.4 N[C@@H]1CC[C@H]1N MCULE-6204977772 [1,0,0,1,0,0|1,0,0]=3 3879 B6R1.4 N[C@@H]1CC[C@H]1O MCULE-1883601377 [1,0,0,1,0,0|0,0,0]=2 3880 B6R1.4 N[C@@H]1CC[C@H]1O MCULE-6045787726 [1,0,0,1,0,0|0,0,0]=2 3881 B6R1.4 N[C@@H]1CC[C@H]1O MCULE-7120290402 [1,0,0,1,0,0|0,0,0]=2 3882 B6R1.4 N[C@@H]1CC[C@H]1O MCULE-8603369729 [1,0,0,1,0,0|0,0,0]=2 3883 B6R1.4 N[C@@H]1COC1=O MCULE-8080548213 [1,0,0,1,0,0|0,0,2]=4 3884 B6R1.4 N[C@@H]1COC1=O MCULE-9370092691 [1,0,0,1,0,0|0,0,2]=4 3885 B6R1.4 N[C@H]1CC[C@@H]1N MCULE-3551063683 [1,0,0,1,0,0|1,0,0]=3 3886 B6R1.4 N[C@H]1CC[C@@H]1O MCULE-1761694918 [1,0,0,1,0,0|0,0,0]=2 3887 B6R1.4 N[C@H]1CC[C@@H]1O MCULE-2828590958 [1,0,0,1,0,0|0,0,0]=2 3888 B6R1.4 N[C@H]1CC[C@@H]1O MCULE-3261752057 [1,0,0,1,0,0|0,0,0]=2 3889 B6R1.4 N[C@H]1CC[C@@H]1O MCULE-7711512049 [1,0,0,1,0,0|0,0,0]=2 3890 B6R1.4 N[C@H]1CC[C@H]1N MCULE-2823061893 [1,0,0,1,0,0|1,0,0]=3 3891 B6R1.4 N[C@H]1CC[C@H]1N MCULE-6752412872 [1,0,0,1,0,0|1,0,0]=3 3892 B6R1.4 N[C@H]1CC[C@H]1O MCULE-3204268809 [1,0,0,1,0,0|0,0,0]=2 3893 B6R1.4 N[C@H]1CC[C@H]1O MCULE-4184135738 [1,0,0,1,0,0|0,0,0]=2 3894 B6R1.4 N[C@H]1COC1=O MCULE-4812631526 [1,0,0,1,0,0|0,0,2]=4 3895 B6R1.4 O=C1CCC1O MCULE-1248327203 [1,0,0,1,0,0|1,0,1]=4 3896 B6R1.4 OC1CCC1O MCULE-3286787157 [1,0,0,1,0,0|1,0,0]=3 3897 B6R1.4 O[C@@H]1CC[C@H]1O MCULE-5060593050 [1,0,0,1,0,0|1,0,0]=3 3898 B6R1.4 O[C@@H]1CC[C@H]1O MCULE-6357622033 [1,0,0,1,0,0|1,0,0]=3 3899 B6R1.4 O[C@H]1CC[C@H]1O MCULE-7964152901 [1,0,0,1,0,0|1,0,0]=3 3900 B6R1.4 [C@@H]1(COC1=O)N MCULE-7456320845 [1,0,0,1,0,0|0,0,2]=4 3901 B6R1.6 BrCC1CCC1 MCULE-6307620219 [1,0,0,1,0,0|2,0,0]=4 3902 B6R1.6 BrCC1CCO1 MCULE-8997197221 [1,0,0,1,0,0|2,0,0]=4 3903 B6R1.6 BrCC1COC1 MCULE-3267235863 [1,0,0,1,0,0|2,0,0]=4 3904 B6R1.6 BrC[C@@H]1CCO1 MCULE-5332541596 [1,0,0,1,0,0|2,0,0]=4 3905 B6R1.6 BrC[C@H]1CCO1 MCULE-4327725094 [1,0,0,1,0,0|2,0,0]=4 3906 B6R1.6 BrC[C@H]1CCO1 MCULE-5319595119 [1,0,0,1,0,0|2,0,0]=4 3907 B6R1.6 C#CC1CCN1 MCULE-4919064001 [1,0,0,1,0,0|1,0,1]=4 3908 B6R1.6 C#CC1CCN1 MCULE-9869131517 [1,0,0,1,0,0|1,0,1]=4 3909 B6R1.6 C1(CCN1)CO MCULE-6309114010 [1,0,0,1,0,0|0,0,0]=2 3910 B6R1.6 CCC1CCN1 MCULE-2791335818 [1,0,0,1,0,0|1,0,0]=3 3911 B6R1.6 CCC1CCN1 MCULE-3929810240 [1,0,0,1,0,0|1,0,0]=3 3912 B6R1.6 CCC1CNC1 MCULE-5314495230 [1,0,0,1,0,0|2,0,0]=4 3913 B6R1.6 CCC1CNC1 MCULE-6675770601 [1,0,0,1,0,0|2,0,0]=4 3914 B6R1.6 CNC1CCN1 MCULE-7769870554 [1,0,0,1,0,0|2,0,0]=4 3915 B6R1.6 CNC1CCN1 MCULE-9764026934 [1,0,0,1,0,0|2,0,0]=4 3916 B6R1.6 CNC1COC1 MCULE-2040978636 [1,0,0,1,0,0|2,0,0]=4 3917 B6R1.6 CNC1COC1 MCULE-3130259264 [1,0,0,1,0,0|2,0,0]=4 3918 B6R1.6 CNC1COC1 MCULE-4618612030 [1,0,0,1,0,0|2,0,0]=4 3919 B6R1.6 ClCC1CCC1 MCULE-2464596839 [1,0,0,1,0,0|2,0,0]=4 3920 B6R1.6 ClCC1CCO1 MCULE-3809712491 [1,0,0,1,0,0|2,0,0]=4 3921 B6R1.6 ClCC1COC1 MCULE-1144637548 [1,0,0,1,0,0|2,0,0]=4 3922 B6R1.6 FCC1CCN1 MCULE-1368993155 [1,0,0,1,0,0|1,0,0]=3 3923 B6R1.6 FCC1CCN1 MCULE-8515014805 [1,0,0,1,0,0|1,0,0]=3 3924 B6R1.6 FCC1CCN1 MCULE-9723993015 [1,0,0,1,0,0|1,0,0]=3 3925 B6R1.6 FC[C@@H]1CCN1 MCULE-3863169127 [1,0,0,1,0,0|1,0,0]=3 3926 B6R1.6 FC[C@@H]1CCN1 MCULE-6069828502 [1,0,0,1,0,0|1,0,0]=3 3927 B6R1.6 FC[C@@H]1CCN1 MCULE-7267455157 [1,0,0,1,0,0|1,0,0]=3 3928 B6R1.6 FC[C@@H]1CCN1 MCULE-8157561423 [1,0,0,1,0,0|1,0,0]=3 3929 B6R1.6 FC[C@H]1CCN1 MCULE-3092369600 [1,0,0,1,0,0|1,0,0]=3 3930 B6R1.6 FC[C@H]1CCN1 MCULE-6708783004 [1,0,0,1,0,0|1,0,0]=3 3931 B6R1.6 ICC1CCC1 MCULE-7767711699 [1,0,0,1,0,0|2,0,0]=4 3932 B6R1.6 ICC1CCO1 MCULE-4132798336 [1,0,0,1,0,0|2,0,0]=4 3933 B6R1.6 ICC1COC1 MCULE-6325029437 [1,0,0,1,0,0|2,0,0]=4 3934 B6R1.6 N#CC1CCN1 MCULE-1911621774 [1,0,0,1,0,0|1,0,1]=4 3935 B6R1.6 N#CC1CCN1 MCULE-4794260273 [1,0,0,1,0,0|1,0,1]=4 3936 B6R1.6 N#CC1CCN1 MCULE-9823982389 [1,0,0,1,0,0|1,0,1]=4 3937 B6R1.6 N#C[C@@H]1CCN1 MCULE-1138328452 [1,0,0,1,0,0|1,0,1]=4 3938 B6R1.6 N#C[C@@H]1CCN1 MCULE-5332905379 [1,0,0,1,0,0|1,0,1]=4 3939 B6R1.6 N#C[C@@H]1CCN1 MCULE-6157011731 [1,0,0,1,0,0|1,0,1]=4 3940 B6R1.6 N#C[C@@H]1CCN1 MCULE-8276413658 [1,0,0,1,0,0|1,0,1]=4 3941 B6R1.6 N#C[C@H]1CCN1 MCULE-1867811844 [1,0,0,1,0,0|1,0,1]=4 3942 B6R1.6 N#C[C@H]1CCN1 MCULE-2164621620 [1,0,0,1,0,0|1,0,1]=4 3943 B6R1.6 N#C[C@H]1CCN1 MCULE-7854885202 [1,0,0,1,0,0|1,0,1]=4 3944 B6R1.6 N#C[C@H]1CCN1 MCULE-8486466797 [1,0,0,1,0,0|1,0,1]=4 3945 B6R1.6 N#C[C@H]1CCN1 MCULE-9219109892 [1,0,0,1,0,0|1,0,1]=4 3946 B6R1.6 NCC1CCC1 MCULE-4977602211 [1,0,0,1,0,0|2,0,0]=4 3947 B6R1.6 NCC1CCC1 MCULE-8434128112 [1,0,0,1,0,0|2,0,0]=4 3948 B6R1.6 NCC1CCN1 MCULE-4988917629 [1,0,0,1,0,0|1,0,0]=3 3949 B6R1.6 NCC1CCN1 MCULE-5495577627 [1,0,0,1,0,0|1,0,0]=3 3950 B6R1.6 NCC1CCN1 MCULE-7749596260 [1,0,0,1,0,0|1,0,0]=3 3951 B6R1.6 NCC1CCO1 MCULE-4478591600 [1,0,0,1,0,0|2,0,0]=4 3952 B6R1.6 NCC1CCS1 MCULE-4026106833 [1,0,0,1,0,0|2,0,0]=4 3953 B6R1.6 NCC1CCS1 MCULE-5342015412 [1,0,0,1,0,0|2,0,0]=4 3954 B6R1.6 NCC1COC1 MCULE-4685637013 [1,0,0,1,0,0|2,0,0]=4 3955 B6R1.6 NCC1COC1 MCULE-6896653344 [1,0,0,1,0,0|2,0,0]=4 3956 B6R1.6 NC[C@@H]1CCO1 MCULE-2375359339 [1,0,0,1,0,0|2,0,0]=4 3957 B6R1.6 NC[C@@H]1CCO1 MCULE-4004256578 [1,0,0,1,0,0|2,0,0]=4 3958 B6R1.6 NC[C@H]1CCN1 MCULE-2270552795 [1,0,0,1,0,0|1,0,0]=3 3959 B6R1.6 NC[C@H]1CCN1 MCULE-2882990554 [1,0,0,1,0,0|1,0,0]=3 3960 B6R1.6 NC[C@H]1CCO1 MCULE-2811111103 [1,0,0,1,0,0|2,0,0]=4 3961 B6R1.6 NC[C@H]1CCO1 MCULE-4329808216 [1,0,0,1,0,0|2,0,0]=4 3962 B6R1.6 NC[C@H]1CCO1 MCULE-9974781002 [1,0,0,1,0,0|2,0,0]=4 3963 B6R1.6 OCC1CCC1 MCULE-3046613150 [1,0,0,1,0,0|1,0,0]=3 3964 B6R1.6 OCC1CCN1 MCULE-1812443062 [1,0,0,1,0,0|0,0,0]=2 3965 B6R1.6 OCC1CCN1 MCULE-8390631765 [1,0,0,1,0,0|0,0,0]=2 3966 B6R1.6 OCC1CCO1 MCULE-7120761203 [1,0,0,1,0,0|1,0,0]=3 3967 B6R1.6 OCC1CCO1 MCULE-7517577386 [1,0,0,1,0,0|1,0,0]=3 3968 B6R1.6 OCC1CNC1 MCULE-1537874886 [1,0,0,1,0,0|2,0,0]=4 3969 B6R1.6 OCC1CNC1 MCULE-8316085177 [1,0,0,1,0,0|2,0,0]=4 3970 B6R1.6 OCC1COC1 MCULE-5031415478 [1,0,0,1,0,0|1,0,0]=3 3971 B6R1.6 OCC1CSC1 MCULE-9388221183 [1,0,0,1,0,0|1,1,0]=4 3972 B6R1.6 OC[C@@H]1CCN1 MCULE-5565957906 [1,0,0,1,0,0|0,0,0]=2 3973 B6R1.6 OC[C@@H]1CCN1 MCULE-7064010066 [1,0,0,1,0,0|0,0,0]=2 3974 B6R1.6 OC[C@@H]1CCN1 MCULE-7539121327 [1,0,0,1,0,0|0,0,0]=2 3975 B6R1.6 OC[C@@H]1CCN1 MCULE-9740096939 [1,0,0,1,0,0|0,0,0]=2 3976 B6R1.6 OC[C@@H]1CCO1 MCULE-7613449097 [1,0,0,1,0,0|1,0,0]=3 3977 B6R1.6 OC[C@@H]1CCO1 MCULE-9444003682 [1,0,0,1,0,0|1,0,0]=3 3978 B6R1.6 OC[C@H]1CCN1 MCULE-5733363493 [1,0,0,1,0,0|0,0,0]=2 3979 B6R1.6 OC[C@H]1CCN1 MCULE-8466413816 [1,0,0,1,0,0|0,0,0]=2 3980 B6R1.6 OC[C@H]1CCO1 MCULE-1446169257 [1,0,0,1,0,0|1,0,0]=3 3981 B6R1.6 OC[C@H]1CCO1 MCULE-2929052431 [1,0,0,1,0,0|1,0,0]=3 3982 B6R1.6 SCC1CCC1 MCULE-4083757063 [1,0,0,1,0,0|1,1,0]=4 3983 B6R1.6 SCC1COC1 MCULE-7193197469 [1,0,0,1,0,0|1,1,0]=4 3984 B6R1.7 BrCC1(CC1)Br MCULE-3664717874 [1,0,0,1,0,0|2,0,0]=4 3985 B6R1.7 C#CC1(CC1)N MCULE-2111588628 [1,0,0,1,0,0|1,0,1]=4 3986 B6R1.7 C#CC1(CC1)N MCULE-6233600820 [1,0,0,1,0,0|1,0,1]=4 3987 B6R1.7 CC1(CC1)CBr MCULE-7638105894 [1,0,0,1,0,0|2,0,0]=4 3988 B6R1.7 CC1(CC1)CCl MCULE-5653369516 [1,0,0,1,0,0|2,0,0]=4 3989 B6R1.7 CC1(CC1)CN MCULE-2933267296 [1,0,0,1,0,0|2,0,0]=4 3990 B6R1.7 CC1(CC1)CN MCULE-6561269012 [1,0,0,1,0,0|2,0,0]=4 3991 B6R1.7 CC1(CC1)CO MCULE-9292264802 [1,0,0,1,0,0|1,0,0]=3 3992 B6R1.7 CC1(CO1)CBr MCULE-5372688659 [1,0,0,1,0,0|2,0,0]=4 3993 B6R1.7 CC1(CO1)CCl MCULE-8847094307 [1,0,0,1,0,0|2,0,0]=4 3994 B6R1.7 CC1(CO1)CO MCULE-1000912721 [1,0,0,1,0,0|1,0,0]=3 3995 B6R1.7 CCC1(CC1)N MCULE-3440893089 [1,0,0,1,0,0|1,0,0]=3 3996 B6R1.7 CCC1(CC1)N MCULE-8936334501 [1,0,0,1,0,0|1,0,0]=3 3997 B6R1.7 CCC1(CC1)O MCULE-7491011687 [1,0,0,1,0,0|2,0,0]=4 3998 B6R1.7 CCC1(CO1)C MCULE-5308881519 [1,0,0,1,0,0|1,0,0]=3 3999 B6R1.7 C[C@@]1(CO1)CO MCULE-2087028484 [1,0,0,1,0,0|1,0,0]=3 4000 B6R1.7 C[C@@]1(CO1)CO MCULE-6244999634 [1,0,0,1,0,0|1,0,0]=3 4001 B6R1.7 C[C@]1(CO1)CO MCULE-1098652766 [1,0,0,1,0,0|1,0,0]=3 4002 B6R1.7 C[C@]1(CO1)CO MCULE-9811443530 [1,0,0,1,0,0|1,0,0]=3 4003 B6R1.7 ClC1(CC1)CBr MCULE-5738182750 [1,0,0,1,0,0|2,0,0]=4 4004 B6R1.7 ClCC1(CC1)Br MCULE-5375999277 [1,0,0,1,0,0|2,0,0]=4 4005 B6R1.7 FC1(CC1)CBr MCULE-9308548759 [1,0,0,1,0,0|2,0,0]=4 4006 B6R1.7 N#CC1(CC1)N MCULE-2345532836 [1,0,0,1,0,0|1,0,1]=4 4007 B6R1.7 N#CC1(CC1)N MCULE-6976493694 [1,0,0,1,0,0|1,0,1]=4 4008 B6R1.7 NC1(CC1)CF MCULE-3560419554 [1,0,0,1,0,0|1,0,0]=3 4009 B6R1.7 NC1(CC1)CF MCULE-5037711402 [1,0,0,1,0,0|1,0,0]=3 4010 B6R1.7 NC1(CC1)CO MCULE-5890036745 [1,0,0,1,0,0|0,0,0]=2 4011 B6R1.7 NC1(CC1)CO MCULE-6476116416 [1,0,0,1,0,0|0,0,0]=2 4012 B6R1.7 NCC1(CC1)Br MCULE-7318489845 [1,0,0,1,0,0|2,0,0]=4 4013 B6R1.7 NCC1(CC1)F MCULE-6736176817 [1,0,0,1,0,0|2,0,0]=4 4014 B6R1.7 NCC1(CC1)F MCULE-7735967320 [1,0,0,1,0,0|2,0,0]=4 4015 B6R1.7 NCC1(CC1)N MCULE-4980820376 [1,0,0,1,0,0|1,0,0]=3 4016 B6R1.7 NCC1(CC1)N MCULE-7033999881 [1,0,0,1,0,0|1,0,0]=3 4017 B6R1.7 NCC1(CC1)O MCULE-7633241990 [1,0,0,1,0,0|2,0,0]=4 4018 B6R1.7 NCC1(CC1)O MCULE-8264909288 [1,0,0,1,0,0|2,0,0]=4 4019 B6R1.7 OCC1(CC1)Br MCULE-2797548638 [1,0,0,1,0,0|1,0,0]=3 4020 B6R1.7 OCC1(CC1)Cl MCULE-4350532922 [1,0,0,1,0,0|1,0,0]=3 4021 B6R1.7 OCC1(CC1)F MCULE-9539268105 [1,0,0,1,0,0|1,0,0]=3 4022 B6R1.7 OCC1(CC1)O MCULE-7768871656 [1,0,0,1,0,0|1,0,0]=3 4023 B8R1.1 C=C1CN[C@@H](C1)CO MCULE-2356105510 [0,0,0,1,0,1|1,0,1]=4 4024 B8R1.1 C=C1CN[C@@H](C1)CO MCULE-8856338816 [0,0,0,1,0,1|1,0,1]=4 4025 B8R1.1 CC1CC(CN1)CO MCULE-3385267892 [0,0,0,1,0,1|2,0,0]=4 4026 B8R1.1 CC1CC(CN1)CO MCULE-5508438719 [0,0,0,1,0,1|2,0,0]=4 4027 B8R1.1 CC1CCC(C1)CO MCULE-3130047677 [0,0,0,1,0,1|2,0,0]=4 4028 B8R1.1 CC1CCC(N1)CO MCULE-7935473441 [0,0,0,1,0,1|2,0,0]=4 4029 B8R1.1 CC1CCC(N1)CO MCULE-8743496847 [0,0,0,1,0,1|2,0,0]=4 4030 B8R1.1 CC1CCC(O1)CO MCULE-1587985152 [0,0,0,1,0,1|2,0,0]=4 4031 B8R1.1 CC1CNC(C1)CF MCULE-6699916370 [0,0,0,1,0,1|2,0,0]=4 4032 B8R1.1 CC1CNC(C1)CF MCULE-9019063440 [0,0,0,1,0,1|2,0,0]=4 4033 B8R1.1 CC1CNC(C1)CO MCULE-2461186712 [0,0,0,1,0,1|1,0,0]=3 4034 B8R1.1 CC1CNC(C1)CO MCULE-5209280647 [0,0,0,1,0,1|1,0,0]=3 4035 B8R1.1 CC1COC(C1)CO MCULE-4511313299 [0,0,0,1,0,1|2,0,0]=4 4036 B8R1.1 CC1OCC(O1)CO MCULE-1328866429 [0,0,0,1,0,1|1,0,0]=3 4037 B8R1.1 CCC1CC(CN1)C MCULE-1050977557 [0,0,0,1,0,1|2,0,0]=4 4038 B8R1.1 C[C@@H]1CC[C@@H](N1)CO MCULE-5635555767 [0,0,0,1,0,1|2,0,0]=4 4039 B8R1.1 C[C@@H]1CC[C@@H](N1)CO MCULE-7103292821 [0,0,0,1,0,1|2,0,0]=4 4040 B8R1.1 C[C@@H]1CC[C@@H](N1)CO MCULE-8577607094 [0,0,0,1,0,1|2,0,0]=4 4041 B8R1.1 C[C@@H]1CC[C@@H](N1)CO MCULE-8853557592 [0,0,0,1,0,1|2,0,0]=4 4042 B8R1.1 C[C@@H]1CC[C@@H](O1)CO MCULE-1981408927 [0,0,0,1,0,1|2,0,0]=4 4043 B8R1.1 C[C@@H]1CC[C@@H](O1)CO MCULE-2750103072 [0,0,0,1,0,1|2,0,0]=4 4044 B8R1.1 C[C@@H]1CN[C@@H](C1)CF MCULE-2959715955 [0,0,0,1,0,1|2,0,0]=4 4045 B8R1.1 C[C@@H]1CN[C@@H](C1)CF MCULE-8576921377 [0,0,0,1,0,1|2,0,0]=4 4046 B8R1.1 C[C@@H]1CN[C@@H](C1)CO MCULE-1057201942 [0,0,0,1,0,1|1,0,0]=3 4047 B8R1.1 C[C@@H]1CN[C@@H](C1)CO MCULE-5251520971 [0,0,0,1,0,1|1,0,0]=3 4048 B8R1.1 C[C@H]1CC[C@H](N1)CO MCULE-5943356667 [0,0,0,1,0,1|2,0,0]=4 4049 B8R1.1 C[C@H]1CC[C@H](N1)CO MCULE-6303404144 [0,0,0,1,0,1|2,0,0]=4 4050 B8R1.1 C[C@H]1CC[C@H](O1)CO MCULE-2585928492 [0,0,0,1,0,1|2,0,0]=4 4051 B8R1.1 C[C@H]1CC[C@H](O1)CO MCULE-3715649264 [0,0,0,1,0,1|2,0,0]=4 4052 B8R1.1 C[C@H]1CN[C@@H](C1)CO MCULE-3784655204 [0,0,0,1,0,1|1,0,0]=3 4053 B8R1.1 C[C@H]1CN[C@@H](C1)CO MCULE-3927798393 [0,0,0,1,0,1|1,0,0]=3 4054 B8R1.1 C[C@H]1C[C@@H](CN1)CO MCULE-4062182666 [0,0,0,1,0,1|2,0,0]=4 4055 B8R1.1 C[C@H]1C[C@@H](CN1)CO MCULE-6218632921 [0,0,0,1,0,1|2,0,0]=4 4056 B8R1.1 FCC1CC(CN1)F MCULE-2675667218 [0,0,0,1,0,1|2,0,0]=4 4057 B8R1.1 FCC1CC(CN1)F MCULE-9263946341 [0,0,0,1,0,1|2,0,0]=4 4058 B8R1.1 FC[C@@H]1C[C@@H](CN1)F MCULE-6952912871 [0,0,0,1,0,1|2,0,0]=4 4059 B8R1.1 FC[C@@H]1C[C@@H](CN1)F MCULE-9220587585 [0,0,0,1,0,1|2,0,0]=4 4060 B8R1.1 FC[C@H]1C[C@H](CN1)F MCULE-1208494188 [0,0,0,1,0,1|2,0,0]=4 4061 B8R1.1 FC[C@H]1C[C@H](CN1)F MCULE-2034962585 [0,0,0,1,0,1|2,0,0]=4 4062 B8R1.1 NCC1CCC(C1)O MCULE-1780130995 [0,0,0,1,0,1|2,0,0]=4 4063 B8R1.1 NCC1CCC(C1)O MCULE-5002398342 [0,0,0,1,0,1|2,0,0]=4 4064 B8R1.1 NCC1C[C@H](CN1)O MCULE-1428185082 [0,0,0,1,0,1|1,0,0]=3 4065 B8R1.1 NC[C@@H]1CC[C@@H](C1)O MCULE-2662561877 [0,0,0,1,0,1|2,0,0]=4 4066 B8R1.1 NC[C@@H]1CC[C@H](C1)O MCULE-9258933196 [0,0,0,1,0,1|2,0,0]=4 4067 B8R1.1 NC[C@H]1CC[C@@H](C1)O MCULE-1995293557 [0,0,0,1,0,1|2,0,0]=4 4068 B8R1.1 NC[C@H]1CC[C@@H](C1)O MCULE-9517253792 [0,0,0,1,0,1|2,0,0]=4 4069 B8R1.1 NC[C@H]1CC[C@H](C1)O MCULE-5659749587 [0,0,0,1,0,1|2,0,0]=4 4070 B8R1.1 NC[C@H]1CC[C@H](C1)O MCULE-9056303043 [0,0,0,1,0,1|2,0,0]=4 4071 B8R1.1 N[C@@H]1CN[C@H](C1)CO MCULE-7916347231 [0,0,0,1,0,1|1,0,0]=3 4072 B8R1.1 N[C@@H]1CN[C@H](C1)CO MCULE-8825406157 [0,0,0,1,0,1|1,0,0]=3 4073 B8R1.1 N[C@H]1CN[C@@H](C1)CO MCULE-3649010281 [0,0,0,1,0,1|1,0,0]=3 4074 B8R1.1 N[C@H]1CN[C@@H](C1)CO MCULE-5102365319 [0,0,0,1,0,1|1,0,0]=3 4075 B8R1.1 N[C@H]1CN[C@@H](C1)CO MCULE-8268517033 [0,0,0,1,0,1|1,0,0]=3 4076 B8R1.1 OC1COC(C1)CI MCULE-9241971646 [0,0,0,1,0,1|2,0,0]=4 4077 B8R1.1 OCC1CC(CN1)F MCULE-6111724005 [0,0,0,1,0,1|1,0,0]=3 4078 B8R1.1 OCC1CC(CN1)F MCULE-9466287708 [0,0,0,1,0,1|1,0,0]=3 4079 B8R1.1 OCC1CC(CN1)O MCULE-1017614151 [0,0,0,1,0,1|0,0,0]=2 4080 B8R1.1 OCC1CC(CN1)O MCULE-5049675085 [0,0,0,1,0,1|0,0,0]=2 4081 B8R1.1 OCC1CC(CO1)O MCULE-4648895678 [0,0,0,1,0,1|1,0,0]=3 4082 B8R1.1 OCC1CCC(C1)F MCULE-4786923020 [0,0,0,1,0,1|2,0,0]=4 4083 B8R1.1 OCC1CCC(C1)O MCULE-5225292788 [0,0,0,1,0,1|1,0,0]=3 4084 B8R1.1 OC[C@@H]1CC[C@@H](C1)O MCULE-7117159358 [0,0,0,1,0,1|1,0,0]=3 4085 B8R1.1 OC[C@@H]1CC[C@H](C1)F MCULE-4252726732 [0,0,0,1,0,1|2,0,0]=4 4086 B8R1.1 OC[C@@H]1C[C@@H](CN1)F MCULE-2619594606 [0,0,0,1,0,1|1,0,0]=3 4087 B8R1.1 OC[C@@H]1C[C@@H](CN1)F MCULE-3940168858 [0,0,0,1,0,1|1,0,0]=3 4088 B8R1.1 OC[C@@H]1C[C@@H](CN1)F MCULE-6567372757 [0,0,0,1,0,1|1,0,0]=3 4089 B8R1.1 OC[C@@H]1C[C@@H](CN1)O MCULE-2521610955 [0,0,0,1,0,1|0,0,0]=2 4090 B8R1.1 OC[C@@H]1C[C@@H](CN1)O MCULE-3659134136 [0,0,0,1,0,1|0,0,0]=2 4091 B8R1.1 OC[C@@H]1C[C@@H](CN1)O MCULE-8149895498 [0,0,0,1,0,1|0,0,0]=2 4092 B8R1.1 OC[C@@H]1C[C@@H](CN1)O MCULE-9582350102 [0,0,0,1,0,1|0,0,0]=2 4093 B8R1.1 OC[C@@H]1C[C@@H](CO1)O MCULE-7875239623 [0,0,0,1,0,1|1,0,0]=3 4094 B8R1.1 OC[C@@H]1C[C@H](CN1)F MCULE-4754863670 [0,0,0,1,0,1|1,0,0]=3 4095 B8R1.1 OC[C@@H]1C[C@H](CN1)F MCULE-4823692987 [0,0,0,1,0,1|1,0,0]=3 4096 B8R1.1 OC[C@@H]1C[C@H](CN1)O MCULE-4908761192 [0,0,0,1,0,1|0,0,0]=2 4097 B8R1.1 OC[C@@H]1C[C@H](CN1)O MCULE-5510339033 [0,0,0,1,0,1|0,0,0]=2 4098 B8R1.1 OC[C@@H]1C[C@H](CN1)O MCULE-7612890329 [0,0,0,1,0,1|0,0,0]=2 4099 B8R1.1 OC[C@@H]1C[C@H](CN1)O MCULE-8424913442 [0,0,0,1,0,1|0,0,0]=2 4100 B8R1.1 OC[C@H]1CC[C@@H](C1)O MCULE-7760122854 [0,0,0,1,0,1|1,0,0]=3 4101 B8R1.1 OC[C@H]1CC[C@@H](C1)O MCULE-9132554470 [0,0,0,1,0,1|1,0,0]=3 4102 B8R1.1 OC[C@H]1C[C@@H](CN1)F MCULE-2106727383 [0,0,0,1,0,1|1,0,0]=3 4103 B8R1.1 OC[C@H]1C[C@@H](CN1)F MCULE-3167425320 [0,0,0,1,0,1|1,0,0]=3 4104 B8R1.1 OC[C@H]1C[C@@H](CN1)F MCULE-5656834651 [0,0,0,1,0,1|1,0,0]=3 4105 B8R1.1 OC[C@H]1C[C@@H](CN1)F MCULE-9413584553 [0,0,0,1,0,1|1,0,0]=3 4106 B8R1.1 OC[C@H]1C[C@@H](CN1)O MCULE-2855908983 [0,0,0,1,0,1|0,0,0]=2 4107 B8R1.1 OC[C@H]1C[C@@H](CN1)O MCULE-5564885819 [0,0,0,1,0,1|0,0,0]=2 4108 B8R1.1 OC[C@H]1C[C@@H](CN1)O MCULE-9276468823 [0,0,0,1,0,1|0,0,0]=2 4109 B8R1.1 OC[C@H]1C[C@@H](CN1)O MCULE-9585503921 [0,0,0,1,0,1|0,0,0]=2 4110 B8R1.1 OC[C@H]1C[C@@H](CO1)O MCULE-5801561749 [0,0,0,1,0,1|1,0,0]=3 4111 B8R1.1 OC[C@H]1C[C@H](CN1)F MCULE-3583754715 [0,0,0,1,0,1|1,0,0]=3 4112 B8R1.1 OC[C@H]1C[C@H](CN1)F MCULE-3654392017 [0,0,0,1,0,1|1,0,0]=3 4113 B8R1.1 OC[C@H]1C[C@H](CN1)F MCULE-3959005096 [0,0,0,1,0,1|1,0,0]=3 4114 B8R1.1 OC[C@H]1C[C@H](CN1)F MCULE-9542838904 [0,0,0,1,0,1|1,0,0]=3 4115 B8R1.1 OC[C@H]1C[C@H](CN1)O MCULE-2099905531 [0,0,0,1,0,1|0,0,0]=2 4116 B8R1.1 OC[C@H]1C[C@H](CN1)O MCULE-5693059049 [0,0,0,1,0,1|0,0,0]=2 4117 B8R1.1 OC[C@H]1C[C@H](CN1)O MCULE-6004929736 [0,0,0,1,0,1|0,0,0]=2 4118 B8R1.1 OC[C@H]1C[C@H](CN1)O MCULE-8607282785 [0,0,0,1,0,1|0,0,0]=2 4119 B8R1.1 OC[C@H]1C[C@H](CO1)O MCULE-4197376814 [0,0,0,1,0,1|1,0,0]=3 4120 B8R1.1 OC[C@H]1C[C@H](CO1)O MCULE-4573543387 [0,0,0,1,0,1|1,0,0]=3 4121 B8R1.1 [C@H]1(CN[C@@H](C1)CF)F MCULE-2056395387 [0,0,0,1,0,1|2,0,0]=4 4122 B8R1.1 [C@H]1(CN[C@@H](C1)CF)F MCULE-9578613289 [0,0,0,1,0,1|2,0,0]=4 4123 B8R1.1 [C@H]1(CN[C@@H](C1)CO)C MCULE-1910074067 [0,0,0,1,0,1|1,0,0]=3 4124 B8R1.1 [C@H]1(CN[C@@H](C1)CO)C MCULE-9340203932 [0,0,0,1,0,1|1,0,0]=3 4125 B8R1.1 [C@H]1(CN[C@@H](C1)CO)F MCULE-7089143816 [0,0,0,1,0,1|1,0,0]=3 4126 B8R1.1 [C@H]1(C[C@H](CN1)F)CO MCULE-2231031404 [0,0,0,1,0,1|1,0,0]=3 4127 B8R1.1 [C@H]1(C[C@H](CN1)F)CO MCULE-6096542902 [0,0,0,1,0,1|1,0,0]=3 4128 B8R1.1 [C@H]1(C[C@H](CN1)N)CO MCULE-6496782896 [0,0,0,1,0,1|1,0,0]=3 4129 B8R1.1 [C@H]1(C[C@H](CN1)O)CO MCULE-4041584401 [0,0,0,1,0,1|0,0,0]=2 4130 B8R1.1 [C@H]1(C[C@H](CN1)O)CO MCULE-9607072956 [0,0,0,1,0,1|0,0,0]=2 4131 B8R1.4 CC1CC(CCO1)N MCULE-6804148880 [0,0,0,1,0,1|1,0,0]=3 4132 B8R1.4 CC1CC(CCO1)N MCULE-8648516718 [0,0,0,1,0,1|1,0,0]=3 4133 B8R1.4 CC1CC(CCO1)O MCULE-4865141445 [0,0,0,1,0,1|2,0,0]=4 4134 B8R1.4 CC1CC(CCS1)N MCULE-2033728520 [0,0,0,1,0,1|1,1,0]=4 4135 B8R1.4 CC1CCCC(C1)N MCULE-5556282713 [0,0,0,1,0,1|2,0,0]=4 4136 B8R1.4 CC1CCCC(C1)N MCULE-8731144009 [0,0,0,1,0,1|2,0,0]=4 4137 B8R1.4 CC1CCCC(C1)O MCULE-5839979596 [0,0,0,1,0,1|2,0,0]=4 4138 B8R1.4 CC1CCC[C@H](C1)O MCULE-8817611474 [0,0,0,1,0,1|2,0,0]=4 4139 B8R1.4 CC1CCOC(O1)C MCULE-1813287934 [0,0,0,1,0,1|2,0,0]=4 4140 B8R1.4 CC1CNCC(C1)N MCULE-3061635524 [0,0,0,1,0,1|2,0,0]=4 4141 B8R1.4 CC1CNCC(C1)O MCULE-3984160340 [0,0,0,1,0,1|2,0,0]=4 4142 B8R1.4 CC1CNCC(C1)O MCULE-8485435970 [0,0,0,1,0,1|2,0,0]=4 4143 B8R1.4 CC1COCC(N1)C MCULE-4328769074 [0,0,0,1,0,1|2,0,0]=4 4144 B8R1.4 CC1COCC(N1)C MCULE-5344050444 [0,0,0,1,0,1|2,0,0]=4 4145 B8R1.4 C[C@@H]1CCC[C@@H](C1)N MCULE-4415985299 [0,0,0,1,0,1|2,0,0]=4 4146 B8R1.4 C[C@@H]1CCC[C@@H](C1)N MCULE-8377118927 [0,0,0,1,0,1|2,0,0]=4 4147 B8R1.4 C[C@@H]1CCC[C@@H](C1)O MCULE-9818117668 [0,0,0,1,0,1|2,0,0]=4 4148 B8R1.4 C[C@@H]1CCC[C@H](C1)N MCULE-8122076410 [0,0,0,1,0,1|2,0,0]=4 4149 B8R1.4 C[C@@H]1CCC[C@H](C1)N MCULE-8755565938 [0,0,0,1,0,1|2,0,0]=4 4150 B8R1.4 C[C@@H]1COC[C@H](N1)C MCULE-2736879628 [0,0,0,1,0,1|2,0,0]=4 4151 B8R1.4 C[C@@H]1COC[C@H](N1)C MCULE-6480700093 [0,0,0,1,0,1|2,0,0]=4 4152 B8R1.4 C[C@@H]1COC[C@H](N1)C MCULE-7175758116 [0,0,0,1,0,1|2,0,0]=4 4153 B8R1.4 C[C@@H]1COC[C@H](N1)C MCULE-8111856201 [0,0,0,1,0,1|2,0,0]=4 4154 B8R1.4 C[C@@H]1COC[C@H](N1)C MCULE-9185751584 [0,0,0,1,0,1|2,0,0]=4 4155 B8R1.4 C[C@@H]1C[C@@H](CCN1)N MCULE-5240939973 [0,0,0,1,0,1|2,0,0]=4 4156 B8R1.4 C[C@@H]1C[C@@H](CCN1)N MCULE-7786078968 [0,0,0,1,0,1|2,0,0]=4 4157 B8R1.4 C[C@@H]1C[C@@H](CCO1)N MCULE-5401313109 [0,0,0,1,0,1|1,0,0]=3 4158 B8R1.4 C[C@@H]1C[C@@H](CCO1)N MCULE-6369939467 [0,0,0,1,0,1|1,0,0]=3 4159 B8R1.4 C[C@@H]1C[C@@H](CCO1)O MCULE-6251959536 [0,0,0,1,0,1|2,0,0]=4 4160 B8R1.4 C[C@@H]1C[C@H](CCO1)Br MCULE-5055630042 [0,0,0,1,0,1|2,0,0]=4 4161 B8R1.4 C[C@@H]1C[C@H](CCO1)N MCULE-3414529082 [0,0,0,1,0,1|1,0,0]=3 4162 B8R1.4 C[C@@H]1C[C@H](CCO1)N MCULE-9424615508 [0,0,0,1,0,1|1,0,0]=3 4163 B8R1.4 C[C@H]1CCC[C@H](C1)N MCULE-5054508849 [0,0,0,1,0,1|2,0,0]=4 4164 B8R1.4 C[C@H]1CCC[C@H](C1)O MCULE-9355825371 [0,0,0,1,0,1|2,0,0]=4 4165 B8R1.4 C[C@H]1COC[C@@H](N1)C MCULE-1719904204 [0,0,0,1,0,1|2,0,0]=4 4166 B8R1.4 C[C@H]1COC[C@@H](N1)C MCULE-4982848827 [0,0,0,1,0,1|2,0,0]=4 4167 B8R1.4 C[C@H]1COC[C@@H](N1)C MCULE-5187697554 [0,0,0,1,0,1|2,0,0]=4 4168 B8R1.4 C[C@H]1COC[C@@H](N1)C MCULE-5502522190 [0,0,0,1,0,1|2,0,0]=4 4169 B8R1.4 C[C@H]1COC[C@H](N1)C MCULE-1213066303 [0,0,0,1,0,1|2,0,0]=4 4170 B8R1.4 C[C@H]1COC[C@H](N1)C MCULE-4127485214 [0,0,0,1,0,1|2,0,0]=4 4171 B8R1.4 C[C@H]1C[C@@H](CCO1)N MCULE-1731421927 [0,0,0,1,0,1|1,0,0]=3 4172 B8R1.4 C[C@H]1C[C@@H](CCO1)O MCULE-3846187212 [0,0,0,1,0,1|2,0,0]=4 4173 B8R1.4 C[C@H]1C[C@H](CCO1)N MCULE-6954386064 [0,0,0,1,0,1|1,0,0]=3 4174 B8R1.4 C[C@H]1C[C@H](CCO1)O MCULE-3007764630 [0,0,0,1,0,1|2,0,0]=4 4175 B8R1.4 NC1CCCC(C1)Cl MCULE-7655504973 [0,0,0,1,0,1|2,0,0]=4 4176 B8R1.4 NC1CCCC(C1)Cl MCULE-9341575456 [0,0,0,1,0,1|2,0,0]=4 4177 B8R1.4 NC1CCCC(C1)F MCULE-5865882171 [0,0,0,1,0,1|2,0,0]=4 4178 B8R1.4 NC1CCCC(C1)F MCULE-8837450344 [0,0,0,1,0,1|2,0,0]=4 4179 B8R1.4 NC1CCCC(C1)N MCULE-3029985677 [0,0,0,1,0,1|2,0,0]=4 4180 B8R1.4 NC1CCCC(C1)N MCULE-6391736640 [0,0,0,1,0,1|2,0,0]=4 4181 B8R1.4 NC1CCCC(C1)O MCULE-6642881941 [0,0,0,1,0,1|1,0,0]=3 4182 B8R1.4 NC1CCCC(C1)O MCULE-7481733301 [0,0,0,1,0,1|1,0,0]=3 4183 B8R1.4 NC1CNCC(C1)O MCULE-6920221467 [0,0,0,1,0,1|1,0,0]=3 4184 B8R1.4 NC1COCC(=O)C1 MCULE-4958107203 [0,0,0,1,0,1|0,0,2]=4 4185 B8R1.4 NC1COCC(=O)C1 MCULE-9645630994 [0,0,0,1,0,1|0,0,2]=4 4186 B8R1.4 NC1COCC(C1)O MCULE-4181084305 [0,0,0,1,0,1|0,0,0]=2 4187 B8R1.4 NC1COCC(C1)O MCULE-5761305163 [0,0,0,1,0,1|0,0,0]=2 4188 B8R1.4 NN1CCCC(C1)O MCULE-4022389356 [0,0,0,1,0,1|2,0,0]=4 4189 B8R1.4 N[C@@H]1CCC[C@@H](C1)O MCULE-2185895220 [0,0,0,1,0,1|1,0,0]=3 4190 B8R1.4 N[C@@H]1CCC[C@@H](C1)O MCULE-6878512399 [0,0,0,1,0,1|1,0,0]=3 4191 B8R1.4 N[C@@H]1CCC[C@@H](C1)O MCULE-7794771906 [0,0,0,1,0,1|1,0,0]=3 4192 B8R1.4 N[C@@H]1CCC[C@@H](C1)O MCULE-9600913098 [0,0,0,1,0,1|1,0,0]=3 4193 B8R1.4 N[C@@H]1CCC[C@H](C1)F MCULE-2536282257 [0,0,0,1,0,1|2,0,0]=4 4194 B8R1.4 N[C@@H]1CCC[C@H](C1)F MCULE-2736673815 [0,0,0,1,0,1|2,0,0]=4 4195 B8R1.4 N[C@@H]1CCC[C@H](C1)F MCULE-4628461523 [0,0,0,1,0,1|2,0,0]=4 4196 B8R1.4 N[C@@H]1CCC[C@H](C1)F MCULE-9688546453 [0,0,0,1,0,1|2,0,0]=4 4197 B8R1.4 N[C@@H]1CCC[C@H](C1)N MCULE-2130309446 [0,0,0,1,0,1|2,0,0]=4 4198 B8R1.4 N[C@@H]1CCC[C@H](C1)O MCULE-3943542357 [0,0,0,1,0,1|1,0,0]=3 4199 B8R1.4 N[C@@H]1CCC[C@H](C1)O MCULE-7462583711 [0,0,0,1,0,1|1,0,0]=3 4200 B8R1.4 N[C@@H]1CCC[C@H](C1)O MCULE-8163415958 [0,0,0,1,0,1|1,0,0]=3 4201 B8R1.4 N[C@@H]1CCC[C@H](C1)O MCULE-9050533878 [0,0,0,1,0,1|1,0,0]=3 4202 B8R1.4 N[C@@H]1COCC(=O)C1 MCULE-3299834957 [0,0,0,1,0,1|0,0,2]=4 4203 B8R1.4 N[C@@H]1COCC(=O)C1 MCULE-6683156371 [0,0,0,1,0,1|0,0,2]=4 4204 B8R1.4 N[C@@H]1COC[C@@H](C1)O MCULE-2589345375 [0,0,0,1,0,1|0,0,0]=2 4205 B8R1.4 N[C@@H]1COC[C@@H](C1)O MCULE-5154891684 [0,0,0,1,0,1|0,0,0]=2 4206 B8R1.4 N[C@@H]1COC[C@H](C1)O MCULE-1888308248 [0,0,0,1,0,1|0,0,0]=2 4207 B8R1.4 N[C@@H]1COC[C@H](C1)O MCULE-4630509866 [0,0,0,1,0,1|0,0,0]=2 4208 B8R1.4 N[C@H]1CCC[C@@H](C1)F MCULE-3206920587 [0,0,0,1,0,1|2,0,0]=4 4209 B8R1.4 N[C@H]1CCC[C@@H](C1)F MCULE-3799023910 [0,0,0,1,0,1|2,0,0]=4 4210 B8R1.4 N[C@H]1CCC[C@@H](C1)F MCULE-4345615346 [0,0,0,1,0,1|2,0,0]=4 4211 B8R1.4 N[C@H]1CCC[C@@H](C1)F MCULE-6740747871 [0,0,0,1,0,1|2,0,0]=4 4212 B8R1.4 N[C@H]1CCC[C@@H](C1)N MCULE-1460773264 [0,0,0,1,0,1|2,0,0]=4 4213 B8R1.4 N[C@H]1CCC[C@@H](C1)N MCULE-7326708293 [0,0,0,1,0,1|2,0,0]=4 4214 B8R1.4 N[C@H]1CCC[C@@H](C1)N MCULE-7679169264 [0,0,0,1,0,1|2,0,0]=4 4215 B8R1.4 N[C@H]1CCC[C@@H](C1)N MCULE-8810866148 [0,0,0,1,0,1|2,0,0]=4 4216 B8R1.4 N[C@H]1CCC[C@@H](C1)O MCULE-2088777566 [0,0,0,1,0,1|1,0,0]=3 4217 B8R1.4 N[C@H]1CCC[C@@H](C1)O MCULE-6052884406 [0,0,0,1,0,1|1,0,0]=3 4218 B8R1.4 N[C@H]1CCC[C@@H](C1)O MCULE-7145455722 [0,0,0,1,0,1|1,0,0]=3 4219 B8R1.4 N[C@H]1CCC[C@@H](C1)O MCULE-8458598098 [0,0,0,1,0,1|1,0,0]=3 4220 B8R1.4 N[C@H]1CCC[C@H](C1)Cl MCULE-1818262804 [0,0,0,1,0,1|2,0,0]=4 4221 B8R1.4 N[C@H]1CCC[C@H](C1)Cl MCULE-8427852595 [0,0,0,1,0,1|2,0,0]=4 4222 B8R1.4 N[C@H]1CCC[C@H](C1)F MCULE-1359534220 [0,0,0,1,0,1|2,0,0]=4 4223 B8R1.4 N[C@H]1CCC[C@H](C1)F MCULE-1857618544 [0,0,0,1,0,1|2,0,0]=4 4224 B8R1.4 N[C@H]1CCC[C@H](C1)F MCULE-4081113085 [0,0,0,1,0,1|2,0,0]=4 4225 B8R1.4 N[C@H]1CCC[C@H](C1)F MCULE-9022718283 [0,0,0,1,0,1|2,0,0]=4 4226 B8R1.4 N[C@H]1CCC[C@H](C1)N MCULE-7378030264 [0,0,0,1,0,1|2,0,0]=4 4227 B8R1.4 N[C@H]1CCC[C@H](C1)N MCULE-8100723700 [0,0,0,1,0,1|2,0,0]=4 4228 B8R1.4 N[C@H]1CCC[C@H](C1)N MCULE-8346537188 [0,0,0,1,0,1|2,0,0]=4 4229 B8R1.4 N[C@H]1CCC[C@H](C1)O MCULE-1402442931 [0,0,0,1,0,1|1,0,0]=3 4230 B8R1.4 N[C@H]1CCC[C@H](C1)O MCULE-2566868682 [0,0,0,1,0,1|1,0,0]=3 4231 B8R1.4 N[C@H]1CCC[C@H](C1)O MCULE-8263508625 [0,0,0,1,0,1|1,0,0]=3 4232 B8R1.4 N[C@H]1CCC[C@H](C1)O MCULE-9158452946 [0,0,0,1,0,1|1,0,0]=3 4233 B8R1.4 N[C@H]1CCC[C@H](C1)O MCULE-9908500977 [0,0,0,1,0,1|1,0,0]=3 4234 B8R1.4 N[C@H]1COC[C@@H](C1)O MCULE-6168789714 [0,0,0,1,0,1|0,0,0]=2 4235 B8R1.4 N[C@H]1COC[C@H](C1)O MCULE-1887576189 [0,0,0,1,0,1|0,0,0]=2 4236 B8R1.4 N[C@H]1COC[C@H](C1)O MCULE-2203204142 [0,0,0,1,0,1|0,0,0]=2 4237 B8R1.4 O=C1COCC(C1)O MCULE-6056926421 [0,0,0,1,0,1|1,0,1]=4 4238 B8R1.4 OC1C=C(COC1)Br MCULE-4969292541 [0,0,0,1,0,1|1,0,1]=4 4239 B8R1.4 OC1CCCC(C1)O MCULE-5377622416 [0,0,0,1,0,1|2,0,0]=4 4240 B8R1.4 OC1CNCC(C1)O MCULE-1197120974 [0,0,0,1,0,1|2,0,0]=4 4241 B8R1.4 OC1CNCC(C1)O MCULE-4759581472 [0,0,0,1,0,1|2,0,0]=4 4242 B8R1.4 O[C@@H]1CCC[C@H](C1)O MCULE-1135108851 [0,0,0,1,0,1|2,0,0]=4 4243 B8R1.4 O[C@@H]1CCC[C@H](C1)O MCULE-4488851523 [0,0,0,1,0,1|2,0,0]=4 4244 B8R1.4 O[C@@H]1CNC[C@@H](C1)F MCULE-1439853464 [0,0,0,1,0,1|2,0,0]=4 4245 B8R1.4 O[C@@H]1CNC[C@@H](C1)F MCULE-9096067151 [0,0,0,1,0,1|2,0,0]=4 4246 B8R1.4 O[C@@H]1CNC[C@@H](C1)O MCULE-1294085941 [0,0,0,1,0,1|2,0,0]=4 4247 B8R1.4 O[C@@H]1CNC[C@@H](C1)O MCULE-3774231585 [0,0,0,1,0,1|2,0,0]=4 4248 B8R1.4 O[C@@H]1CNC[C@H](C1)O MCULE-5630014959 [0,0,0,1,0,1|2,0,0]=4 4249 B8R1.4 O[C@@H]1CNC[C@H](C1)O MCULE-8096152429 [0,0,0,1,0,1|2,0,0]=4 4250 B8R1.4 O[C@H]1CCC[C@@H](C1)O MCULE-4718573149 [0,0,0,1,0,1|2,0,0]=4 4251 B8R1.4 O[C@H]1CCC[C@H](C1)O MCULE-9402957017 [0,0,0,1,0,1|2,0,0]=4 4252 B8R1.4 O[C@H]1CNC[C@@H](C1)O MCULE-3635256197 [0,0,0,1,0,1|2,0,0]=4 4253 B8R1.4 O[C@H]1CNC[C@@H](C1)O MCULE-7162868831 [0,0,0,1,0,1|2,0,0]=4 4254 B8R1.4 [C@@H]1(CCC[C@@H](C1)N)C MCULE-3863430976 [0,0,0,1,0,1|2,0,0]=4 4255 B8R1.4 [C@H]1(CCC[C@H](C1)O)N MCULE-1919170190 [0,0,0,1,0,1|1,0,0]=3 4256 B8R1.4 [C@H]1(CCC[C@H](C1)O)N MCULE-2985238129 [0,0,0,1,0,1|1,0,0]=3 4257 B8R1.4 [C@H]1(COC[C@H](N1)C)C MCULE-9060251275 [0,0,0,1,0,1|2,0,0]=4 4258 B8R1.18 CC1CC(C(=O)O1)N MCULE-4414809681 [0,0,0,1,0,1|0,0,2]=4 4259 B8R1.18 CC1CC(C(=O)O1)N MCULE-7247771680 [0,0,0,1,0,1|0,0,2]=4 4260 B8R1.18 CC1CC(C(O1)C)N MCULE-3274169856 [0,0,0,1,0,1|1,0,0]=3 4261 B8R1.18 CC1CC(C(O1)C)N MCULE-9455862703 [0,0,0,1,0,1|1,0,0]=3 4262 B8R1.18 CC1CC(C(O1)C)S MCULE-4786793091 [0,0,0,1,0,1|2,0,0]=4 4263 B8R1.18 CN1CC(C(C1)O)N MCULE-2599335817 [0,0,0,1,0,1|2,0,0]=4 4264 B8R1.18 CN1CC(C(C1)O)N MCULE-6847369546 [0,0,0,1,0,1|2,0,0]=4 4265 B8R1.18 CN1C[C@@H]([C@@H](C1)O)N MCULE-2486938322 [0,0,0,1,0,1|2,0,0]=4 4266 B8R1.18 CN1C[C@@H]([C@@H](C1)O)N MCULE-5836595032 [0,0,0,1,0,1|2,0,0]=4 4267 B8R1.18 CN1C[C@@H]([C@@H](C1)O)N MCULE-6830124811 [0,0,0,1,0,1|2,0,0]=4 4268 B8R1.18 CN1C[C@@H]([C@@H](C1)O)N MCULE-9514040195 [0,0,0,1,0,1|2,0,0]=4 4269 B8R1.18 CN1C[C@H]([C@@H](C1)O)N MCULE-3812148649 [0,0,0,1,0,1|2,0,0]=4 4270 B8R1.18 CN1C[C@H]([C@@H](C1)O)N MCULE-5853867679 [0,0,0,1,0,1|2,0,0]=4 4271 B8R1.18 CN1C[C@H]([C@@H](C1)O)N MCULE-7840416361 [0,0,0,1,0,1|2,0,0]=4 4272 B8R1.18 CN1C[C@H]([C@@H](C1)O)N MCULE-8395934464 [0,0,0,1,0,1|2,0,0]=4 4273 B8R1.18 NC1CC(C(C1)O)O MCULE-4578427017 [0,0,0,1,0,1|2,0,0]=4 4274 B8R1.18 NC1CC(C(C1)O)O MCULE-5175955370 [0,0,0,1,0,1|2,0,0]=4 4275 B8R1.18 NC1C[C@@H]([C@@H](C1)O)O MCULE-6906947518 [0,0,0,1,0,1|2,0,0]=4 4276 B8R1.18 NC1C[C@@H]([C@@H](C1)O)O MCULE-9885099468 [0,0,0,1,0,1|2,0,0]=4 4277 B8R1.18 N[C@@H]1C[C@@H]([C@@H](C1)O)O MCULE-1413629464 [0,0,0,1,0,1|2,0,0]=4 4278 B8R1.18 N[C@@H]1C[C@@H]([C@@H](C1)O)O MCULE-2282806557 [0,0,0,1,0,1|2,0,0]=4 4279 B8R1.18 N[C@H]1C[C@@H]([C@@H](C1)O)O MCULE-1533256813 [0,0,0,1,0,1|2,0,0]=4 4280 B8R1.18 N[C@H]1C[C@@H]([C@@H](C1)O)O MCULE-8968529452 [0,0,0,1,0,1|2,0,0]=4 4281 B8R1.31 CC(C)C1OCC1N MCULE-3528951242 [0,0,0,1,0,1|1,0,0]=3 4282 B8R1.31 CC(O)C1CCC1F MCULE-2872972823 [0,0,0,1,0,1|2,0,0]=4 4283 B8R1.34 CC(C)NC1COC1 MCULE-7347698371 [0,0,0,1,0,1|2,0,0]=4 4284 B8R1.34 CC(C)NC1COC1 MCULE-7707077616 [0,0,0,1,0,1|2,0,0]=4 4285 B8R1.40 CCC(N)CC1CC1 MCULE-5542802833 [0,0,0,1,0,1|2,0,0]=4 4286 B8R1.40 NC(CO)CC1CC1 MCULE-7286476383 [0,0,0,1,0,1|1,0,0]=3 4287 B8R1.40 NC(CO)CC1CC1 MCULE-9063082551 [0,0,0,1,0,1|1,0,0]=3 4288 B8R1.40 N[C@@H](CO)CC1CC1 MCULE-2751028745 [0,0,0,1,0,1|1,0,0]=3 4289 B8R1.40 N[C@@H](CO)CC1CC1 MCULE-5358245814 [0,0,0,1,0,1|1,0,0]=3 4290 B8R1.40 N[C@H](CO)CC1CC1 MCULE-2936761410 [0,0,0,1,0,1|1,0,0]=3 4291 B8R1.40 N[C@H](CO)CC1CC1 MCULE-4806571417 [0,0,0,1,0,1|1,0,0]=3 4292 B8R1.40 N[C@H](CO)CC1CC1 MCULE-6129944826 [0,0,0,1,0,1|1,0,0]=3 4293 B8R1.42 CC(C)CC1(CC1)N MCULE-6063357206 [0,0,0,1,0,1|2,0,0]=4 4294 B8R1.42 CC(C)CC1(CC1)N MCULE-8450584368 [0,0,0,1,0,1|2,0,0]=4 4295 B8R1.43 CC(C)C1CC1CO MCULE-2405752880 [0,0,0,1,0,1|2,0,0]=4 4296 B8R1.51 CC1(CC(CO1)Br)C MCULE-6264816299 [0,0,0,1,0,1|2,0,0]=4 4297 B8R1.51 CC1(CC(CO1)N)C MCULE-7633375889 [0,0,0,1,0,1|1,0,0]=3 4298 B8R1.51 CC1(CC(CO1)N)C MCULE-7644576148 [0,0,0,1,0,1|1,0,0]=3 4299 B8R1.51 CC1(CC(CO1)O)C MCULE-6020499551 [0,0,0,1,0,1|2,0,0]=4 4300 B8R1.51 CC1(CC(CO1)S)C MCULE-1857889655 [0,0,0,1,0,1|2,0,0]=4 4301 B8R1.51 CC1(CCC(C1)N)C MCULE-1462634969 [0,0,0,1,0,1|2,0,0]=4 4302 B8R1.51 CC1(CCC(C1)N)C MCULE-7718074169 [0,0,0,1,0,1|2,0,0]=4 4303 B8R1.51 CC1(CCC(C1)N)O MCULE-2662110764 [0,0,0,1,0,1|1,0,0]=3 4304 B8R1.51 CC1(CCC(C1)N)O MCULE-8421528641 [0,0,0,1,0,1|1,0,0]=3 4305 B8R1.51 CC1CCC(C1)(C)O MCULE-5369529521 [0,0,0,1,0,1|2,0,0]=4 4306 B8R1.51 CC1COC(O1)(C)C MCULE-2118300632 [0,0,0,1,0,1|2,0,0]=4 4307 B8R1.51 C[C@]1(CC[C@@H](C1)N)O MCULE-4320731186 [0,0,0,1,0,1|1,0,0]=3 4308 B8R1.53 CC1(CC(C1)CN)O MCULE-7937499181 [0,0,0,1,0,1|2,0,0]=4 4309 B8R1.53 CC1(CC(C1)CN)O MCULE-8215295434 [0,0,0,1,0,1|2,0,0]=4 4310 B8R1.53 CC1(CC(C1)CO)C MCULE-4960689844 [0,0,0,1,0,1|2,0,0]=4 4311 B8R1.53 CC1(CC(C1)CO)O MCULE-8748762687 [0,0,0,1,0,1|1,0,0]=3 4312 B8R1.53 CC1(CC(O1)CO)C MCULE-4486069537 [0,0,0,1,0,1|2,0,0]=4 4313 B8R1.53 CC1(C[C@@H](O1)CO)C MCULE-4245314494 [0,0,0,1,0,1|2,0,0]=4 4314 B8R1.53 C[C@@]1(C[C@H](C1)CN)O MCULE-2105482458 [0,0,0,1,0,1|2,0,0]=4 4315 B8R1.53 C[C@@]1(C[C@H](C1)CN)O MCULE-8687149478 [0,0,0,1,0,1|2,0,0]=4 4316 B8R1.53 [C@@H]1(C[C@](C1)(C)O)CN MCULE-6495615071 [0,0,0,1,0,1|2,0,0]=4 4317 B8R1.53 [C@@H]1(C[C@](C1)(C)O)CN MCULE-8603898788 [0,0,0,1,0,1|2,0,0]=4 4318 B8R1.62 CC1CC(C1)(N)CO MCULE-8274627147 [0,0,0,1,0,1|1,0,0]=3 4319 B8R1.62 C[C@@]1(C[C@H](C1)N)CO MCULE-2371405532 [0,0,0,1,0,1|2,0,0]=4 4320 B8R1.62 C[C@@]1(C[C@H](C1)N)CO MCULE-6179609767 [0,0,0,1,0,1|2,0,0]=4 4321 B8R1.62 NC1(CC(C1)F)CO MCULE-1267158959 [0,0,0,1,0,1|1,0,0]=3 4322 B8R1.62 NC1(CC(C1)F)CO MCULE-5898059221 [0,0,0,1,0,1|1,0,0]=3 4323 B8R1.83 CCC(N)C1CC1C MCULE-5927058941 [0,0,0,1,0,1|2,0,0]=4 4324 B8R1.5 C=C1COCCC1N MCULE-4966385224 [0,1,0,1,0,0|1,0,1]=4 4325 B8R1.5 CC1CCCCC1N MCULE-3041016580 [0,1,0,1,0,0|2,0,0]=4 4326 B8R1.5 CC1CCCCC1N MCULE-4294403075 [0,1,0,1,0,0|2,0,0]=4 4327 B8R1.5 CC1CCCCC1O MCULE-2704647488 [0,1,0,1,0,0|2,0,0]=4 4328 B8R1.5 CC1CCNCC1O MCULE-5450375148 [0,1,0,1,0,0|2,0,0]=4 4329 B8R1.5 CC1CCNCC1O MCULE-5649027214 [0,1,0,1,0,0|2,0,0]=4 4330 B8R1.5 CC1CNCCC1N MCULE-4288510851 [0,1,0,1,0,0|2,0,0]=4 4331 B8R1.5 CC1CNCCC1N MCULE-7264043917 [0,1,0,1,0,0|2,0,0]=4 4332 B8R1.5 CC1CNCCC1O MCULE-1960718296 [0,1,0,1,0,0|2,0,0]=4 4333 B8R1.5 CC1CNCCC1O MCULE-8434519185 [0,1,0,1,0,0|2,0,0]=4 4334 B8R1.5 CC1COCCC1N MCULE-6236890728 [0,1,0,1,0,0|1,0,0]=3 4335 B8R1.5 CC1COCCC1N MCULE-7497946239 [0,1,0,1,0,0|1,0,0]=3 4336 B8R1.5 CC1COCCC1O MCULE-9430778912 [0,1,0,1,0,0|1,0,0]=3 4337 B8R1.5 CC1NCCCC1O MCULE-4670774259 [0,1,0,1,0,0|2,0,0]=4 4338 B8R1.5 CC1NCCCC1O MCULE-7229970366 [0,1,0,1,0,0|2,0,0]=4 4339 B8R1.5 CC1NCCOC1C MCULE-1624947595 [0,1,0,1,0,0|2,0,0]=4 4340 B8R1.5 CC1NCCOC1C MCULE-4208173089 [0,1,0,1,0,0|2,0,0]=4 4341 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-2207912311 [0,1,0,1,0,0|2,0,0]=4 4342 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-3227199256 [0,1,0,1,0,0|2,0,0]=4 4343 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-4948677049 [0,1,0,1,0,0|2,0,0]=4 4344 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-6377741621 [0,1,0,1,0,0|2,0,0]=4 4345 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-8426223529 [0,1,0,1,0,0|2,0,0]=4 4346 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-9542068395 [0,1,0,1,0,0|2,0,0]=4 4347 B8R1.5 C[C@@H]1CCCC[C@@H]1O MCULE-3547716632 [0,1,0,1,0,0|2,0,0]=4 4348 B8R1.5 C[C@@H]1CCCC[C@@H]1O MCULE-9259793572 [0,1,0,1,0,0|2,0,0]=4 4349 B8R1.5 C[C@@H]1CCCC[C@H]1N MCULE-2021817746 [0,1,0,1,0,0|2,0,0]=4 4350 B8R1.5 C[C@@H]1CCCC[C@H]1N MCULE-3944837592 [0,1,0,1,0,0|2,0,0]=4 4351 B8R1.5 C[C@@H]1CCNC[C@@H]1O MCULE-6946702609 [0,1,0,1,0,0|2,0,0]=4 4352 B8R1.5 C[C@@H]1CCNC[C@@H]1O MCULE-7899767253 [0,1,0,1,0,0|2,0,0]=4 4353 B8R1.5 C[C@@H]1CCNC[C@@H]1O MCULE-9159305922 [0,1,0,1,0,0|2,0,0]=4 4354 B8R1.5 C[C@@H]1CCNC[C@@H]1O MCULE-9391376462 [0,1,0,1,0,0|2,0,0]=4 4355 B8R1.5 C[C@@H]1CCNC[C@H]1O MCULE-4706073937 [0,1,0,1,0,0|2,0,0]=4 4356 B8R1.5 C[C@@H]1CCNC[C@H]1O MCULE-5188621987 [0,1,0,1,0,0|2,0,0]=4 4357 B8R1.5 C[C@@H]1CCNC[C@H]1O MCULE-6031430878 [0,1,0,1,0,0|2,0,0]=4 4358 B8R1.5 C[C@@H]1CCNC[C@H]1O MCULE-8311134495 [0,1,0,1,0,0|2,0,0]=4 4359 B8R1.5 C[C@@H]1CNCC[C@@H]1N MCULE-1733727000 [0,1,0,1,0,0|2,0,0]=4 4360 B8R1.5 C[C@@H]1CNCC[C@@H]1N MCULE-5971884774 [0,1,0,1,0,0|2,0,0]=4 4361 B8R1.5 C[C@@H]1CNCC[C@H]1N MCULE-4381780061 [0,1,0,1,0,0|2,0,0]=4 4362 B8R1.5 C[C@@H]1CNCC[C@H]1N MCULE-7332887720 [0,1,0,1,0,0|2,0,0]=4 4363 B8R1.5 C[C@@H]1CNCC[C@H]1O MCULE-1211656855 [0,1,0,1,0,0|2,0,0]=4 4364 B8R1.5 C[C@@H]1CNCC[C@H]1O MCULE-8887033073 [0,1,0,1,0,0|2,0,0]=4 4365 B8R1.5 C[C@@H]1COCC[C@@H]1N MCULE-1854737385 [0,1,0,1,0,0|1,0,0]=3 4366 B8R1.5 C[C@@H]1COCC[C@@H]1N MCULE-5272955365 [0,1,0,1,0,0|1,0,0]=3 4367 B8R1.5 C[C@@H]1COCC[C@H]1N MCULE-1385721208 [0,1,0,1,0,0|1,0,0]=3 4368 B8R1.5 C[C@@H]1COCC[C@H]1N MCULE-1584947952 [0,1,0,1,0,0|1,0,0]=3 4369 B8R1.5 C[C@@H]1COCC[C@H]1N MCULE-3448920251 [0,1,0,1,0,0|1,0,0]=3 4370 B8R1.5 C[C@@H]1COCC[C@H]1N MCULE-7256484712 [0,1,0,1,0,0|1,0,0]=3 4371 B8R1.5 C[C@@H]1NCCC[C@H]1O MCULE-4565116334 [0,1,0,1,0,0|2,0,0]=4 4372 B8R1.5 C[C@H]1CCCC[C@@H]1N MCULE-3841584035 [0,1,0,1,0,0|2,0,0]=4 4373 B8R1.5 C[C@H]1CCCC[C@@H]1N MCULE-4158219749 [0,1,0,1,0,0|2,0,0]=4 4374 B8R1.5 C[C@H]1CCCC[C@@H]1N MCULE-8973971252 [0,1,0,1,0,0|2,0,0]=4 4375 B8R1.5 C[C@H]1CCCC[C@@H]1N MCULE-9885453921 [0,1,0,1,0,0|2,0,0]=4 4376 B8R1.5 C[C@H]1CCCC[C@@H]1O MCULE-4879328575 [0,1,0,1,0,0|2,0,0]=4 4377 B8R1.5 C[C@H]1CCCC[C@@H]1O MCULE-7331434797 [0,1,0,1,0,0|2,0,0]=4 4378 B8R1.5 C[C@H]1CCCC[C@H]1N MCULE-1533998857 [0,1,0,1,0,0|2,0,0]=4 4379 B8R1.5 C[C@H]1CCCC[C@H]1N MCULE-5254242664 [0,1,0,1,0,0|2,0,0]=4 4380 B8R1.5 C[C@H]1CCCC[C@H]1N MCULE-5432486645 [0,1,0,1,0,0|2,0,0]=4 4381 B8R1.5 C[C@H]1CCCC[C@H]1N MCULE-7149509445 [0,1,0,1,0,0|2,0,0]=4 4382 B8R1.5 C[C@H]1CCNC[C@@H]1O MCULE-2413866964 [0,1,0,1,0,0|2,0,0]=4 4383 B8R1.5 C[C@H]1CCNC[C@@H]1O MCULE-3541397142 [0,1,0,1,0,0|2,0,0]=4 4384 B8R1.5 C[C@H]1CCNC[C@@H]1O MCULE-4524645861 [0,1,0,1,0,0|2,0,0]=4 4385 B8R1.5 C[C@H]1CCNC[C@@H]1O MCULE-4989324272 [0,1,0,1,0,0|2,0,0]=4 4386 B8R1.5 C[C@H]1CCNC[C@H]1O MCULE-6149485279 [0,1,0,1,0,0|2,0,0]=4 4387 B8R1.5 C[C@H]1CCNC[C@H]1O MCULE-9609136161 [0,1,0,1,0,0|2,0,0]=4 4388 B8R1.5 C[C@H]1CNCC[C@@H]1N MCULE-1222815331 [0,1,0,1,0,0|2,0,0]=4 4389 B8R1.5 C[C@H]1CNCC[C@@H]1N MCULE-1657518091 [0,1,0,1,0,0|2,0,0]=4 4390 B8R1.5 C[C@H]1CNCC[C@@H]1O MCULE-1418189839 [0,1,0,1,0,0|2,0,0]=4 4391 B8R1.5 C[C@H]1CNCC[C@@H]1O MCULE-2162007646 [0,1,0,1,0,0|2,0,0]=4 4392 B8R1.5 C[C@H]1CNCC[C@@H]1O MCULE-4884869364 [0,1,0,1,0,0|2,0,0]=4 4393 B8R1.5 C[C@H]1CNCC[C@@H]1O MCULE-9707177849 [0,1,0,1,0,0|2,0,0]=4 4394 B8R1.5 C[C@H]1CNCC[C@H]1N MCULE-2604448103 [0,1,0,1,0,0|2,0,0]=4 4395 B8R1.5 C[C@H]1CNCC[C@H]1N MCULE-4549710847 [0,1,0,1,0,0|2,0,0]=4 4396 B8R1.5 C[C@H]1CNCC[C@H]1O MCULE-1909814972 [0,1,0,1,0,0|2,0,0]=4 4397 B8R1.5 C[C@H]1CNCC[C@H]1O MCULE-8202226496 [0,1,0,1,0,0|2,0,0]=4 4398 B8R1.5 C[C@H]1CNCC[C@H]1O MCULE-9674887824 [0,1,0,1,0,0|2,0,0]=4 4399 B8R1.5 C[C@H]1CNCC[C@H]1O MCULE-9888495251 [0,1,0,1,0,0|2,0,0]=4 4400 B8R1.5 C[C@H]1COCC[C@@H]1N MCULE-3420685614 [0,1,0,1,0,0|1,0,0]=3 4401 B8R1.5 C[C@H]1COCC[C@@H]1N MCULE-4495690357 [0,1,0,1,0,0|1,0,0]=3 4402 B8R1.5 C[C@H]1COCC[C@@H]1N MCULE-9724547988 [0,1,0,1,0,0|1,0,0]=3 4403 B8R1.5 C[C@H]1COCC[C@@H]1N MCULE-9889716251 [0,1,0,1,0,0|1,0,0]=3 4404 B8R1.5 C[C@H]1COCC[C@H]1N MCULE-3075216082 [0,1,0,1,0,0|1,0,0]=3 4405 B8R1.5 C[C@H]1COCC[C@H]1N MCULE-4276602047 [0,1,0,1,0,0|1,0,0]=3 4406 B8R1.5 C[C@H]1COCC[C@H]1N MCULE-6090606114 [0,1,0,1,0,0|1,0,0]=3 4407 B8R1.5 C[C@H]1COCC[C@H]1N MCULE-6610603811 [0,1,0,1,0,0|1,0,0]=3 4408 B8R1.5 C[C@H]1NCCC[C@@H]1O MCULE-4581708846 [0,1,0,1,0,0|2,0,0]=4 4409 B8R1.5 NC1CC=CCC1N MCULE-3943853809 [0,1,0,1,0,0|2,0,0]=4 4410 B8R1.5 NC1CC=CCC1N MCULE-5846438826 [0,1,0,1,0,0|2,0,0]=4 4411 B8R1.5 NC1CCCCC1Cl MCULE-3676302646 [0,1,0,1,0,0|2,0,0]=4 4412 B8R1.5 NC1CCCCC1Cl MCULE-7920658638 [0,1,0,1,0,0|2,0,0]=4 4413 B8R1.5 NC1CCCCC1F MCULE-6643891539 [0,1,0,1,0,0|2,0,0]=4 4414 B8R1.5 NC1CCCCC1F MCULE-7855236144 [0,1,0,1,0,0|2,0,0]=4 4415 B8R1.5 NC1CCCCC1N MCULE-1677916175 [0,1,0,1,0,0|2,0,0]=4 4416 B8R1.5 NC1CCCCC1N MCULE-9568644004 [0,1,0,1,0,0|2,0,0]=4 4417 B8R1.5 NC1CCCCC1O MCULE-1427424523 [0,1,0,1,0,0|1,0,0]=3 4418 B8R1.5 NC1CCCCC1O MCULE-2793336591 [0,1,0,1,0,0|1,0,0]=3 4419 B8R1.5 NC1CCNCC1O MCULE-2705091841 [0,1,0,1,0,0|1,0,0]=3 4420 B8R1.5 NC1CCOCC1F MCULE-1016932578 [0,1,0,1,0,0|1,0,0]=3 4421 B8R1.5 NC1CCOCC1F MCULE-9622790392 [0,1,0,1,0,0|1,0,0]=3 4422 B8R1.5 NC1CCOCC1O MCULE-2815184899 [0,1,0,1,0,0|0,0,0]=2 4423 B8R1.5 NC1CCOCC1O MCULE-4548392204 [0,1,0,1,0,0|0,0,0]=2 4424 B8R1.5 NC1COCCC1=O MCULE-2621905094 [0,1,0,1,0,0|0,0,2]=4 4425 B8R1.5 NC1COCCC1=O MCULE-5417580672 [0,1,0,1,0,0|0,0,2]=4 4426 B8R1.5 NC1COCCC1F MCULE-1455837903 [0,1,0,1,0,0|1,0,0]=3 4427 B8R1.5 NC1COCCC1F MCULE-7145252320 [0,1,0,1,0,0|1,0,0]=3 4428 B8R1.5 NC1COCCC1O MCULE-6374385354 [0,1,0,1,0,0|0,0,0]=2 4429 B8R1.5 NC1COCCC1O MCULE-7944406292 [0,1,0,1,0,0|0,0,0]=2 4430 B8R1.5 N[C@@H]1CC=CC[C@H]1N MCULE-3622120987 [0,1,0,1,0,0|2,0,0]=4 4431 B8R1.5 N[C@@H]1CC=CC[C@H]1N MCULE-4467278353 [0,1,0,1,0,0|2,0,0]=4 4432 B8R1.5 N[C@@H]1CC=CC[C@H]1N MCULE-4650951696 [0,1,0,1,0,0|2,0,0]=4 4433 B8R1.5 N[C@@H]1CC=CC[C@H]1N MCULE-9460537896 [0,1,0,1,0,0|2,0,0]=4 4434 B8R1.5 N[C@@H]1CCCC[C@@H]1F MCULE-1657692826 [0,1,0,1,0,0|2,0,0]=4 4435 B8R1.5 N[C@@H]1CCCC[C@@H]1F MCULE-3328673946 [0,1,0,1,0,0|2,0,0]=4 4436 B8R1.5 N[C@@H]1CCCC[C@@H]1O MCULE-2753918610 [0,1,0,1,0,0|1,0,0]=3 4437 B8R1.5 N[C@@H]1CCCC[C@@H]1O MCULE-2761271370 [0,1,0,1,0,0|1,0,0]=3 4438 B8R1.5 N[C@@H]1CCCC[C@@H]1O MCULE-4978213189 [0,1,0,1,0,0|1,0,0]=3 4439 B8R1.5 N[C@@H]1CCCC[C@@H]1O MCULE-9182719952 [0,1,0,1,0,0|1,0,0]=3 4440 B8R1.5 N[C@@H]1CCCC[C@H]1F MCULE-3474870548 [0,1,0,1,0,0|2,0,0]=4 4441 B8R1.5 N[C@@H]1CCCC[C@H]1F MCULE-3984172565 [0,1,0,1,0,0|2,0,0]=4 4442 B8R1.5 N[C@@H]1CCCC[C@H]1F MCULE-4705427644 [0,1,0,1,0,0|2,0,0]=4 4443 B8R1.5 N[C@@H]1CCCC[C@H]1F MCULE-7025237099 [0,1,0,1,0,0|2,0,0]=4 4444 B8R1.5 N[C@@H]1CCCC[C@H]1N MCULE-1186999216 [0,1,0,1,0,0|2,0,0]=4 4445 B8R1.5 N[C@@H]1CCCC[C@H]1N MCULE-2134025562 [0,1,0,1,0,0|2,0,0]=4 4446 B8R1.5 N[C@@H]1CCCC[C@H]1N MCULE-6149251599 [0,1,0,1,0,0|2,0,0]=4 4447 B8R1.5 N[C@@H]1CCCC[C@H]1N MCULE-6588424966 [0,1,0,1,0,0|2,0,0]=4 4448 B8R1.5 N[C@@H]1CCCC[C@H]1O MCULE-1509174959 [0,1,0,1,0,0|1,0,0]=3 4449 B8R1.5 N[C@@H]1CCCC[C@H]1O MCULE-2336529349 [0,1,0,1,0,0|1,0,0]=3 4450 B8R1.5 N[C@@H]1CCCC[C@H]1O MCULE-4732604931 [0,1,0,1,0,0|1,0,0]=3 4451 B8R1.5 N[C@@H]1CCCC[C@H]1O MCULE-6124510830 [0,1,0,1,0,0|1,0,0]=3 4452 B8R1.5 N[C@@H]1CCCC[C@H]1O MCULE-7301593250 [0,1,0,1,0,0|1,0,0]=3 4453 B8R1.5 N[C@@H]1CCCC[C@H]1O MCULE-8501577810 [0,1,0,1,0,0|1,0,0]=3 4454 B8R1.5 N[C@@H]1CCNC[C@H]1O MCULE-1435526553 [0,1,0,1,0,0|1,0,0]=3 4455 B8R1.5 N[C@@H]1CCNC[C@H]1O MCULE-8731873892 [0,1,0,1,0,0|1,0,0]=3 4456 B8R1.5 N[C@@H]1CCOC[C@@H]1F MCULE-1239747130 [0,1,0,1,0,0|1,0,0]=3 4457 B8R1.5 N[C@@H]1CCOC[C@@H]1F MCULE-2720196545 [0,1,0,1,0,0|1,0,0]=3 4458 B8R1.5 N[C@@H]1CCOC[C@@H]1F MCULE-4681308404 [0,1,0,1,0,0|1,0,0]=3 4459 B8R1.5 N[C@@H]1CCOC[C@@H]1F MCULE-5510784592 [0,1,0,1,0,0|1,0,0]=3 4460 B8R1.5 N[C@@H]1CCOC[C@@H]1F MCULE-6118396691 [0,1,0,1,0,0|1,0,0]=3 4461 B8R1.5 N[C@@H]1CCOC[C@@H]1F MCULE-9001277868 [0,1,0,1,0,0|1,0,0]=3 4462 B8R1.5 N[C@@H]1CCOC[C@@H]1O MCULE-1888816293 [0,1,0,1,0,0|0,0,0]=2 4463 B8R1.5 N[C@@H]1CCOC[C@@H]1O MCULE-3667258867 [0,1,0,1,0,0|0,0,0]=2 4464 B8R1.5 N[C@@H]1CCOC[C@@H]1O MCULE-3915823883 [0,1,0,1,0,0|0,0,0]=2 4465 B8R1.5 N[C@@H]1CCOC[C@@H]1O MCULE-9959521476 [0,1,0,1,0,0|0,0,0]=2 4466 B8R1.5 N[C@@H]1CCOC[C@H]1F MCULE-3556707940 [0,1,0,1,0,0|1,0,0]=3 4467 B8R1.5 N[C@@H]1CCOC[C@H]1F MCULE-4525092522 [0,1,0,1,0,0|1,0,0]=3 4468 B8R1.5 N[C@@H]1CCOC[C@H]1F MCULE-7086756183 [0,1,0,1,0,0|1,0,0]=3 4469 B8R1.5 N[C@@H]1CCOC[C@H]1F MCULE-8506007792 [0,1,0,1,0,0|1,0,0]=3 4470 B8R1.5 N[C@@H]1CCOC[C@H]1O MCULE-1071839837 [0,1,0,1,0,0|0,0,0]=2 4471 B8R1.5 N[C@@H]1CCOC[C@H]1O MCULE-6051401821 [0,1,0,1,0,0|0,0,0]=2 4472 B8R1.5 N[C@@H]1CCOC[C@H]1O MCULE-7013720281 [0,1,0,1,0,0|0,0,0]=2 4473 B8R1.5 N[C@@H]1CCOC[C@H]1O MCULE-8477518337 [0,1,0,1,0,0|0,0,0]=2 4474 B8R1.5 N[C@@H]1COCC[C@@H]1O MCULE-1031623201 [0,1,0,1,0,0|0,0,0]=2 4475 B8R1.5 N[C@@H]1COCC[C@@H]1O MCULE-2846030882 [0,1,0,1,0,0|0,0,0]=2 4476 B8R1.5 N[C@@H]1COCC[C@@H]1O MCULE-8863364874 [0,1,0,1,0,0|0,0,0]=2 4477 B8R1.5 N[C@@H]1COCC[C@@H]1O MCULE-9836639365 [0,1,0,1,0,0|0,0,0]=2 4478 B8R1.5 N[C@@H]1COCC[C@H]1F MCULE-2318671918 [0,1,0,1,0,0|1,0,0]=3 4479 B8R1.5 N[C@@H]1COCC[C@H]1F MCULE-3695420668 [0,1,0,1,0,0|1,0,0]=3 4480 B8R1.5 N[C@@H]1COCC[C@H]1F MCULE-6955873978 [0,1,0,1,0,0|1,0,0]=3 4481 B8R1.5 N[C@@H]1COCC[C@H]1F MCULE-8343413560 [0,1,0,1,0,0|1,0,0]=3 4482 B8R1.5 N[C@@H]1COCC[C@H]1O MCULE-4436769496 [0,1,0,1,0,0|0,0,0]=2 4483 B8R1.5 N[C@@H]1COCC[C@H]1O MCULE-6163244980 [0,1,0,1,0,0|0,0,0]=2 4484 B8R1.5 N[C@@H]1COCC[C@H]1O MCULE-8697534407 [0,1,0,1,0,0|0,0,0]=2 4485 B8R1.5 N[C@@H]1COCC[C@H]1O MCULE-9625047427 [0,1,0,1,0,0|0,0,0]=2 4486 B8R1.5 N[C@H]1CC=CC[C@@H]1N MCULE-1809147231 [0,1,0,1,0,0|2,0,0]=4 4487 B8R1.5 N[C@H]1CC=CC[C@@H]1N MCULE-4009547577 [0,1,0,1,0,0|2,0,0]=4 4488 B8R1.5 N[C@H]1CC=CC[C@H]1N MCULE-9531245900 [0,1,0,1,0,0|2,0,0]=4 4489 B8R1.5 N[C@H]1CC=CC[C@H]1N MCULE-9562977605 [0,1,0,1,0,0|2,0,0]=4 4490 B8R1.5 N[C@H]1CCCC[C@@H]1F MCULE-2983212378 [0,1,0,1,0,0|2,0,0]=4 4491 B8R1.5 N[C@H]1CCCC[C@@H]1F MCULE-6196710696 [0,1,0,1,0,0|2,0,0]=4 4492 B8R1.5 N[C@H]1CCCC[C@@H]1N MCULE-3653211978 [0,1,0,1,0,0|2,0,0]=4 4493 B8R1.5 N[C@H]1CCCC[C@@H]1N MCULE-5059719804 [0,1,0,1,0,0|2,0,0]=4 4494 B8R1.5 N[C@H]1CCCC[C@@H]1O MCULE-1277967673 [0,1,0,1,0,0|1,0,0]=3 4495 B8R1.5 N[C@H]1CCCC[C@@H]1O MCULE-1301750612 [0,1,0,1,0,0|1,0,0]=3 4496 B8R1.5 N[C@H]1CCCC[C@@H]1O MCULE-3861922722 [0,1,0,1,0,0|1,0,0]=3 4497 B8R1.5 N[C@H]1CCCC[C@@H]1O MCULE-8489439004 [0,1,0,1,0,0|1,0,0]=3 4498 B8R1.5 N[C@H]1CCCC[C@H]1F MCULE-7579368841 [0,1,0,1,0,0|2,0,0]=4 4499 B8R1.5 N[C@H]1CCCC[C@H]1F MCULE-8479221038 [0,1,0,1,0,0|2,0,0]=4 4500 B8R1.5 N[C@H]1CCCC[C@H]1N MCULE-2011367325 [0,1,0,1,0,0|2,0,0]=4 4501 B8R1.5 N[C@H]1CCCC[C@H]1N MCULE-7126233212 [0,1,0,1,0,0|2,0,0]=4 4502 B8R1.5 N[C@H]1CCCC[C@H]1O MCULE-1599409645 [0,1,0,1,0,0|1,0,0]=3 4503 B8R1.5 N[C@H]1CCCC[C@H]1O MCULE-3318800690 [0,1,0,1,0,0|1,0,0]=3 4504 B8R1.5 N[C@H]1CCCC[C@H]1O MCULE-4235445104 [0,1,0,1,0,0|1,0,0]=3 4505 B8R1.5 N[C@H]1CCCC[C@H]1O MCULE-6518289705 [0,1,0,1,0,0|1,0,0]=3 4506 B8R1.5 N[C@H]1CCCC[C@H]1O MCULE-6606691116 [0,1,0,1,0,0|1,0,0]=3 4507 B8R1.5 N[C@H]1CCCC[C@H]1O MCULE-9979333085 [0,1,0,1,0,0|1,0,0]=3 4508 B8R1.5 N[C@H]1CCOC[C@@H]1F MCULE-1493875164 [0,1,0,1,0,0|1,0,0]=3 4509 B8R1.5 N[C@H]1CCOC[C@@H]1F MCULE-2102376472 [0,1,0,1,0,0|1,0,0]=3 4510 B8R1.5 N[C@H]1CCOC[C@@H]1F MCULE-6109633704 [0,1,0,1,0,0|1,0,0]=3 4511 B8R1.5 N[C@H]1CCOC[C@@H]1F MCULE-7337274868 [0,1,0,1,0,0|1,0,0]=3 4512 B8R1.5 N[C@H]1CCOC[C@@H]1F MCULE-9740357152 [0,1,0,1,0,0|1,0,0]=3 4513 B8R1.5 N[C@H]1CCOC[C@@H]1F MCULE-9831607120 [0,1,0,1,0,0|1,0,0]=3 4514 B8R1.5 N[C@H]1CCOC[C@@H]1O MCULE-1217623714 [0,1,0,1,0,0|0,0,0]=2 4515 B8R1.5 N[C@H]1CCOC[C@@H]1O MCULE-4607259008 [0,1,0,1,0,0|0,0,0]=2 4516 B8R1.5 N[C@H]1CCOC[C@@H]1O MCULE-4749541215 [0,1,0,1,0,0|0,0,0]=2 4517 B8R1.5 N[C@H]1CCOC[C@@H]1O MCULE-9683658087 [0,1,0,1,0,0|0,0,0]=2 4518 B8R1.5 N[C@H]1CCOC[C@H]1F MCULE-1550590585 [0,1,0,1,0,0|1,0,0]=3 4519 B8R1.5 N[C@H]1CCOC[C@H]1F MCULE-4067592428 [0,1,0,1,0,0|1,0,0]=3 4520 B8R1.5 N[C@H]1CCOC[C@H]1F MCULE-4649837852 [0,1,0,1,0,0|1,0,0]=3 4521 B8R1.5 N[C@H]1CCOC[C@H]1F MCULE-6334068028 [0,1,0,1,0,0|1,0,0]=3 4522 B8R1.5 N[C@H]1CCOC[C@H]1O MCULE-1807586879 [0,1,0,1,0,0|0,0,0]=2 4523 B8R1.5 N[C@H]1CCOC[C@H]1O MCULE-1937023434 [0,1,0,1,0,0|0,0,0]=2 4524 B8R1.5 N[C@H]1CCOC[C@H]1O MCULE-4374635229 [0,1,0,1,0,0|0,0,0]=2 4525 B8R1.5 N[C@H]1CCOC[C@H]1O MCULE-4873019238 [0,1,0,1,0,0|0,0,0]=2 4526 B8R1.5 N[C@H]1COCC[C@@H]1O MCULE-1937054893 [0,1,0,1,0,0|0,0,0]=2 4527 B8R1.5 N[C@H]1COCC[C@@H]1O MCULE-4877924283 [0,1,0,1,0,0|0,0,0]=2 4528 B8R1.5 N[C@H]1COCC[C@@H]1O MCULE-6674323819 [0,1,0,1,0,0|0,0,0]=2 4529 B8R1.5 N[C@H]1COCC[C@H]1O MCULE-7305089306 [0,1,0,1,0,0|0,0,0]=2 4530 B8R1.5 N[C@H]1COCC[C@H]1O MCULE-8372108333 [0,1,0,1,0,0|0,0,0]=2 4531 B8R1.5 O=C1CCOCC1O MCULE-7032874317 [0,1,0,1,0,0|1,0,1]=4 4532 B8R1.5 OC1CCCCC1Cl MCULE-8650942069 [0,1,0,1,0,0|2,0,0]=4 4533 B8R1.5 OC1CCCCC1F MCULE-7634543650 [0,1,0,1,0,0|2,0,0]=4 4534 B8R1.5 OC1CCCCC1O MCULE-2967360901 [0,1,0,1,0,0|2,0,0]=4 4535 B8R1.5 OC1CCNCC1F MCULE-3466397366 [0,1,0,1,0,0|2,0,0]=4 4536 B8R1.5 OC1CCNCC1F MCULE-8065194779 [0,1,0,1,0,0|2,0,0]=4 4537 B8R1.5 OC1CCNCC1O MCULE-3039573850 [0,1,0,1,0,0|2,0,0]=4 4538 B8R1.5 OC1CCNCC1O MCULE-8828122539 [0,1,0,1,0,0|2,0,0]=4 4539 B8R1.5 OC1CCOCC1F MCULE-6531880501 [0,1,0,1,0,0|1,0,0]=3 4540 B8R1.5 OC1CNCCC1F MCULE-2946280821 [0,1,0,1,0,0|2,0,0]=4 4541 B8R1.5 OC1CNCCC1F MCULE-3493148821 [0,1,0,1,0,0|2,0,0]=4 4542 B8R1.5 OC1CSSCC1O MCULE-3716589710 [0,1,0,1,0,0|1,1,0]=4 4543 B8R1.5 O[C@@H]1CCCC[C@H]1F MCULE-2305949625 [0,1,0,1,0,0|2,0,0]=4 4544 B8R1.5 O[C@@H]1CCCC[C@H]1O MCULE-3067807104 [0,1,0,1,0,0|2,0,0]=4 4545 B8R1.5 O[C@@H]1CCCC[C@H]1O MCULE-3429096841 [0,1,0,1,0,0|2,0,0]=4 4546 B8R1.5 O[C@@H]1CCCC[C@H]1O MCULE-9892753066 [0,1,0,1,0,0|2,0,0]=4 4547 B8R1.5 O[C@@H]1CCCC[C@H]1S MCULE-6222162383 [0,1,0,1,0,0|2,0,0]=4 4548 B8R1.5 O[C@@H]1CCNC[C@@H]1F MCULE-3951980250 [0,1,0,1,0,0|2,0,0]=4 4549 B8R1.5 O[C@@H]1CCNC[C@@H]1F MCULE-4022160407 [0,1,0,1,0,0|2,0,0]=4 4550 B8R1.5 O[C@@H]1CCNC[C@@H]1F MCULE-7163743424 [0,1,0,1,0,0|2,0,0]=4 4551 B8R1.5 O[C@@H]1CCNC[C@@H]1F MCULE-9380154478 [0,1,0,1,0,0|2,0,0]=4 4552 B8R1.5 O[C@@H]1CCNC[C@H]1F MCULE-2399390264 [0,1,0,1,0,0|2,0,0]=4 4553 B8R1.5 O[C@@H]1CCNC[C@H]1F MCULE-6405573375 [0,1,0,1,0,0|2,0,0]=4 4554 B8R1.5 O[C@@H]1CCNC[C@H]1F MCULE-7590255724 [0,1,0,1,0,0|2,0,0]=4 4555 B8R1.5 O[C@@H]1CCNC[C@H]1F MCULE-8845231230 [0,1,0,1,0,0|2,0,0]=4 4556 B8R1.5 O[C@@H]1CCNC[C@H]1O MCULE-3688872623 [0,1,0,1,0,0|2,0,0]=4 4557 B8R1.5 O[C@@H]1CCNC[C@H]1O MCULE-5098984807 [0,1,0,1,0,0|2,0,0]=4 4558 B8R1.5 O[C@@H]1CCOC[C@@H]1F MCULE-1035298575 [0,1,0,1,0,0|1,0,0]=3 4559 B8R1.5 O[C@@H]1CCOC[C@@H]1F MCULE-7549327189 [0,1,0,1,0,0|1,0,0]=3 4560 B8R1.5 O[C@@H]1CCOC[C@H]1F MCULE-5919881662 [0,1,0,1,0,0|1,0,0]=3 4561 B8R1.5 O[C@@H]1CNCC[C@@H]1F MCULE-1622561753 [0,1,0,1,0,0|2,0,0]=4 4562 B8R1.5 O[C@@H]1CNCC[C@@H]1F MCULE-6945313787 [0,1,0,1,0,0|2,0,0]=4 4563 B8R1.5 O[C@@H]1CNCC[C@H]1F MCULE-3612777118 [0,1,0,1,0,0|2,0,0]=4 4564 B8R1.5 O[C@@H]1CNCC[C@H]1F MCULE-5621905223 [0,1,0,1,0,0|2,0,0]=4 4565 B8R1.5 O[C@@H]1CNCC[C@H]1F MCULE-6188298332 [0,1,0,1,0,0|2,0,0]=4 4566 B8R1.5 O[C@@H]1CNCC[C@H]1F MCULE-7586426338 [0,1,0,1,0,0|2,0,0]=4 4567 B8R1.5 O[C@@H]1CSSC[C@H]1O MCULE-2981026113 [0,1,0,1,0,0|1,1,0]=4 4568 B8R1.5 O[C@H]1CCCC[C@@H]1F MCULE-7833708338 [0,1,0,1,0,0|2,0,0]=4 4569 B8R1.5 O[C@H]1CCCC[C@@H]1O MCULE-7078207162 [0,1,0,1,0,0|2,0,0]=4 4570 B8R1.5 O[C@H]1CCCC[C@@H]1O MCULE-9836847707 [0,1,0,1,0,0|2,0,0]=4 4571 B8R1.5 O[C@H]1CCCC[C@H]1Br MCULE-8133807743 [0,1,0,1,0,0|2,0,0]=4 4572 B8R1.5 O[C@H]1CCCC[C@H]1O MCULE-3539097516 [0,1,0,1,0,0|2,0,0]=4 4573 B8R1.5 O[C@H]1CCNC[C@@H]1F MCULE-1808200479 [0,1,0,1,0,0|2,0,0]=4 4574 B8R1.5 O[C@H]1CCNC[C@@H]1F MCULE-5879546904 [0,1,0,1,0,0|2,0,0]=4 4575 B8R1.5 O[C@H]1CCNC[C@@H]1F MCULE-7720582046 [0,1,0,1,0,0|2,0,0]=4 4576 B8R1.5 O[C@H]1CCNC[C@@H]1F MCULE-9733376385 [0,1,0,1,0,0|2,0,0]=4 4577 B8R1.5 O[C@H]1CCNC[C@@H]1O MCULE-1740802653 [0,1,0,1,0,0|2,0,0]=4 4578 B8R1.5 O[C@H]1CCNC[C@@H]1O MCULE-5396588753 [0,1,0,1,0,0|2,0,0]=4 4579 B8R1.5 O[C@H]1CCNC[C@@H]1O MCULE-6762598540 [0,1,0,1,0,0|2,0,0]=4 4580 B8R1.5 O[C@H]1CCNC[C@@H]1O MCULE-9747818285 [0,1,0,1,0,0|2,0,0]=4 4581 B8R1.5 O[C@H]1CCNC[C@H]1F MCULE-2742864171 [0,1,0,1,0,0|2,0,0]=4 4582 B8R1.5 O[C@H]1CCNC[C@H]1F MCULE-4720397627 [0,1,0,1,0,0|2,0,0]=4 4583 B8R1.5 O[C@H]1CCNC[C@H]1F MCULE-7747536704 [0,1,0,1,0,0|2,0,0]=4 4584 B8R1.5 O[C@H]1CCNC[C@H]1F MCULE-9341492038 [0,1,0,1,0,0|2,0,0]=4 4585 B8R1.5 O[C@H]1CCNC[C@H]1O MCULE-2865586489 [0,1,0,1,0,0|2,0,0]=4 4586 B8R1.5 O[C@H]1CCNC[C@H]1O MCULE-6097537639 [0,1,0,1,0,0|2,0,0]=4 4587 B8R1.5 O[C@H]1CCNC[C@H]1O MCULE-8152004203 [0,1,0,1,0,0|2,0,0]=4 4588 B8R1.5 O[C@H]1CCNC[C@H]1O MCULE-8500578666 [0,1,0,1,0,0|2,0,0]=4 4589 B8R1.5 O[C@H]1CCOC[C@@H]1F MCULE-6227313100 [0,1,0,1,0,0|1,0,0]=3 4590 B8R1.5 O[C@H]1CCOC[C@@H]1F MCULE-8454301102 [0,1,0,1,0,0|1,0,0]=3 4591 B8R1.5 O[C@H]1CCOC[C@H]1F MCULE-6598998730 [0,1,0,1,0,0|1,0,0]=3 4592 B8R1.5 O[C@H]1CCOC[C@H]1F MCULE-7224746770 [0,1,0,1,0,0|1,0,0]=3 4593 B8R1.5 O[C@H]1CCOC[C@H]1F MCULE-7648243504 [0,1,0,1,0,0|1,0,0]=3 4594 B8R1.5 O[C@H]1CNCC[C@@H]1F MCULE-1003695930 [0,1,0,1,0,0|2,0,0]=4 4595 B8R1.5 O[C@H]1CNCC[C@@H]1F MCULE-2595427193 [0,1,0,1,0,0|2,0,0]=4 4596 B8R1.5 O[C@H]1CNCC[C@@H]1F MCULE-4420509139 [0,1,0,1,0,0|2,0,0]=4 4597 B8R1.5 O[C@H]1CNCC[C@H]1F MCULE-1178411420 [0,1,0,1,0,0|2,0,0]=4 4598 B8R1.5 O[C@H]1CNCC[C@H]1F MCULE-1550810398 [0,1,0,1,0,0|2,0,0]=4 4599 B8R1.5 O[C@H]1CNCC[C@H]1F MCULE-9461941348 [0,1,0,1,0,0|2,0,0]=4 4600 B8R1.5 O[C@H]1CNCC[C@H]1F MCULE-9787124381 [0,1,0,1,0,0|2,0,0]=4 4601 B8R1.5 O[C@H]1CNCC[C@H]1O MCULE-2884977174 [0,1,0,1,0,0|2,0,0]=4 4602 B8R1.5 O[C@H]1CNCC[C@H]1O MCULE-4059971580 [0,1,0,1,0,0|2,0,0]=4 4603 B8R1.5 O[C@H]1CNCC[C@H]1O MCULE-4860264041 [0,1,0,1,0,0|2,0,0]=4 4604 B8R1.5 O[C@H]1CNCC[C@H]1O MCULE-5794552949 [0,1,0,1,0,0|2,0,0]=4 4605 B8R1.5 O[C@H]1CNNC[C@@H]1O MCULE-7867785160 [0,1,0,1,0,0|2,0,0]=4 4606 B8R1.5 O[C@H]1CSSC[C@@H]1O MCULE-2785197932 [0,1,0,1,0,0|1,1,0]=4 4607 B8R1.5 O[C@H]1CSSC[C@@H]1O MCULE-5975753187 [0,1,0,1,0,0|1,1,0]=4 4608 B8R1.5 [C@@H]1(CCNC[C@@H]1F)O MCULE-4552431818 [0,1,0,1,0,0|2,0,0]=4 4609 B8R1.5 [C@@H]1(CCNC[C@@H]1F)O MCULE-6293331305 [0,1,0,1,0,0|2,0,0]=4 4610 B8R1.5 [C@@H]1(CCNC[C@H]1F)O MCULE-2598494094 [0,1,0,1,0,0|2,0,0]=4 4611 B8R1.5 [C@@H]1(CCNC[C@H]1F)O MCULE-9897987946 [0,1,0,1,0,0|2,0,0]=4 4612 B8R1.5 [C@@H]1(CCNC[C@H]1O)C MCULE-2307148539 [0,1,0,1,0,0|2,0,0]=4 4613 B8R1.5 [C@@H]1(CCNC[C@H]1O)C MCULE-7550947729 [0,1,0,1,0,0|2,0,0]=4 4614 B8R1.5 [C@@H]1(CCOC[C@@H]1O)N MCULE-2201413833 [0,1,0,1,0,0|0,0,0]=2 4615 B8R1.5 [C@@H]1(CCOC[C@H]1N)O MCULE-7745052941 [0,1,0,1,0,0|0,0,0]=2 4616 B8R1.5 [C@@H]1(CNCC[C@@H]1F)O MCULE-6806325155 [0,1,0,1,0,0|2,0,0]=4 4617 B8R1.5 [C@@H]1(CNCC[C@@H]1F)O MCULE-8351727587 [0,1,0,1,0,0|2,0,0]=4 4618 B8R1.5 [C@@H]1(CNCC[C@@H]1F)O MCULE-9141886243 [0,1,0,1,0,0|2,0,0]=4 4619 B8R1.5 [C@@H]1(CNCC[C@H]1O)O MCULE-7522153539 [0,1,0,1,0,0|2,0,0]=4 4620 B8R1.5 [C@@H]1(CNCC[C@H]1O)O MCULE-8922491067 [0,1,0,1,0,0|2,0,0]=4 4621 B8R1.5 [C@@H]1(COCC[C@@H]1O)N MCULE-2864950342 [0,1,0,1,0,0|0,0,0]=2 4622 B8R1.5 [C@H]1(CCCC[C@H]1F)O MCULE-7751753244 [0,1,0,1,0,0|2,0,0]=4 4623 B8R1.5 [C@H]1(CCNC[C@H]1O)O MCULE-2825513554 [0,1,0,1,0,0|2,0,0]=4 4624 B8R1.5 [C@H]1(CCNC[C@H]1O)O MCULE-3902017522 [0,1,0,1,0,0|2,0,0]=4 4625 B8R1.5 [C@H]1(CCOC[C@@H]1O)N MCULE-3291339796 [0,1,0,1,0,0|0,0,0]=2 4626 B8R1.5 [C@H]1(CCOC[C@@H]1O)N MCULE-5641035715 [0,1,0,1,0,0|0,0,0]=2 4627 B8R1.5 [C@H]1(CNCC[C@H]1C)O MCULE-8053222550 [0,1,0,1,0,0|2,0,0]=4 4628 B8R1.5 [C@H]1(CNCC[C@H]1C)O MCULE-9640568177 [0,1,0,1,0,0|2,0,0]=4 4629 B8R1.5 [C@H]1(CNCC[C@H]1O)C MCULE-1419969909 [0,1,0,1,0,0|2,0,0]=4 4630 B8R1.5 [C@H]1(CNCC[C@H]1O)C MCULE-1584116117 [0,1,0,1,0,0|2,0,0]=4 4631 B8R1.5 [C@H]1(CNCC[C@H]1O)C MCULE-2275992252 [0,1,0,1,0,0|2,0,0]=4 4632 B8R1.5 [C@H]1(CNCC[C@H]1O)C MCULE-4151833845 [0,1,0,1,0,0|2,0,0]=4 4633 B8R1.5 [C@H]1(COCC[C@H]1N)C MCULE-2786096186 [0,1,0,1,0,0|1,0,0]=3 4634 B8R1.5 [C@H]1(COCC[C@H]1N)C MCULE-3516272365 [0,1,0,1,0,0|1,0,0]=3 4635 B8R1.5 [C@H]1(COCC[C@H]1N)O MCULE-2088495989 [0,1,0,1,0,0|0,0,0]=2 4636 B8R1.5 [C@H]1(COCC[C@H]1O)N MCULE-5409068801 [0,1,0,1,0,0|0,0,0]=2 4637 B8R1.5 [C@H]1(NCCO[C@H]1C)C MCULE-5977135582 [0,1,0,1,0,0|2,0,0]=4 4638 B8R1.5 [C@H]1(NCCO[C@H]1C)C MCULE-8495373224 [0,1,0,1,0,0|2,0,0]=4 4639 B8R1.7 C1(CCCN1)C(C)C MCULE-1193597619 [0,1,0,1,0,0|2,0,0]=4 4640 B8R1.7 C1(CCCN1)C(C)C MCULE-5005043134 [0,1,0,1,0,0|2,0,0]=4 4641 B8R1.7 CC(C)C1CCCN1 MCULE-2880698089 [0,1,0,1,0,0|2,0,0]=4 4642 B8R1.7 CC(C)C1CCCN1 MCULE-8748321913 [0,1,0,1,0,0|2,0,0]=4 4643 B8R1.7 CC(C)C1CCNC1 MCULE-6027927433 [0,1,0,1,0,0|2,0,0]=4 4644 B8R1.7 CC(C)C1CCNC1 MCULE-6061191970 [0,1,0,1,0,0|2,0,0]=4 4645 B8R1.7 CC(C)C1NCCO1 MCULE-8813624423 [0,1,0,1,0,0|2,0,0]=4 4646 B8R1.7 CC(C)[C@@H]1CCCN1 MCULE-1080192326 [0,1,0,1,0,0|2,0,0]=4 4647 B8R1.7 CC(C)[C@@H]1CCCN1 MCULE-7041423474 [0,1,0,1,0,0|2,0,0]=4 4648 B8R1.7 CC(C)[C@@H]1CCCN1 MCULE-8923460014 [0,1,0,1,0,0|2,0,0]=4 4649 B8R1.7 CC(C)[C@@H]1CCCN1 MCULE-9332303275 [0,1,0,1,0,0|2,0,0]=4 4650 B8R1.7 CC(C)[C@@H]1CCNC1 MCULE-1312856988 [0,1,0,1,0,0|2,0,0]=4 4651 B8R1.7 CC(C)[C@@H]1CCNC1 MCULE-1454315799 [0,1,0,1,0,0|2,0,0]=4 4652 B8R1.7 CC(C)[C@@H]1CCNC1 MCULE-3512426569 [0,1,0,1,0,0|2,0,0]=4 4653 B8R1.7 CC(C)[C@@H]1CCNC1 MCULE-8210117113 [0,1,0,1,0,0|2,0,0]=4 4654 B8R1.7 CC(C)[C@H]1CCCN1 MCULE-2217061634 [0,1,0,1,0,0|2,0,0]=4 4655 B8R1.7 CC(C)[C@H]1CCCN1 MCULE-7316037645 [0,1,0,1,0,0|2,0,0]=4 4656 B8R1.7 CC(C)[C@H]1CCCN1 MCULE-7382792334 [0,1,0,1,0,0|2,0,0]=4 4657 B8R1.7 CC(C)[C@H]1CCCN1 MCULE-9823510614 [0,1,0,1,0,0|2,0,0]=4 4658 B8R1.7 CC(C)[C@H]1CCNC1 MCULE-6484346598 [0,1,0,1,0,0|2,0,0]=4 4659 B8R1.7 CC(C)[C@H]1CCNC1 MCULE-7637885012 [0,1,0,1,0,0|2,0,0]=4 4660 B8R1.7 CC(N)C1CCOC1 MCULE-4437147688 [0,1,0,1,0,0|2,0,0]=4 4661 B8R1.7 CC(N)C1CCOC1 MCULE-5608990827 [0,1,0,1,0,0|2,0,0]=4 4662 B8R1.7 CC(O)C1CCCC1 MCULE-6730583511 [0,1,0,1,0,0|2,0,0]=4 4663 B8R1.7 CC(O)C1CCCO1 MCULE-2804362263 [0,1,0,1,0,0|2,0,0]=4 4664 B8R1.7 CC(O)C1CCNC1 MCULE-3316354505 [0,1,0,1,0,0|1,0,0]=3 4665 B8R1.7 CC(O)C1CCNC1 MCULE-6188875194 [0,1,0,1,0,0|1,0,0]=3 4666 B8R1.7 CC(O)C1CCOC1 MCULE-1059653145 [0,1,0,1,0,0|1,0,0]=3 4667 B8R1.7 C[C@@H](O)C1CCCC1 MCULE-2530250478 [0,1,0,1,0,0|2,0,0]=4 4668 B8R1.7 C[C@@H](O)[C@H]1CCCO1 MCULE-6393902221 [0,1,0,1,0,0|2,0,0]=4 4669 B8R1.7 C[C@H](O)C1CCCC1 MCULE-9054245488 [0,1,0,1,0,0|2,0,0]=4 4670 B8R1.7 C[C@H](O)C1CCCO1 MCULE-5402066981 [0,1,0,1,0,0|2,0,0]=4 4671 B8R1.7 C[C@H](O)C1CCOC1 MCULE-9092941508 [0,1,0,1,0,0|1,0,0]=3 4672 B8R1.7 C[C@H](O)[C@@H]1CCCN1 MCULE-5014228849 [0,1,0,1,0,0|1,0,0]=3 4673 B8R1.7 C[C@H](O)[C@@H]1CCCN1 MCULE-5063876687 [0,1,0,1,0,0|1,0,0]=3 4674 B8R1.7 C[C@H](O)[C@@H]1CCCO1 MCULE-3917713920 [0,1,0,1,0,0|2,0,0]=4 4675 B8R1.7 O=C(O)C1COCN1 MCULE-4997392610 [0,1,0,1,0,0|1,0,1]=4 4676 B8R1.7 O=C(O)C1COCN1 MCULE-7001651226 [0,1,0,1,0,0|1,0,1]=4 4677 B8R1.7 O=C(O)[C@@H]1COCN1 MCULE-1547472283 [0,1,0,1,0,0|1,0,1]=4 4678 B8R1.7 O=C(O)[C@@H]1COCN1 MCULE-1876089066 [0,1,0,1,0,0|1,0,1]=4 4679 B8R1.7 O=C(O)[C@@H]1COCN1 MCULE-1926856350 [0,1,0,1,0,0|1,0,1]=4 4680 B8R1.7 O=C(O)[C@@H]1COCN1 MCULE-9876695932 [0,1,0,1,0,0|1,0,1]=4 4681 B8R1.7 [C@@H]1(CCNC1)C(C)C MCULE-4130251176 [0,1,0,1,0,0|2,0,0]=4 4682 B8R1.7 [C@@H]1(CCNC1)C(C)C MCULE-9716712888 [0,1,0,1,0,0|2,0,0]=4 4683 B8R1.13 COCC1CCC1N MCULE-2980403375 [0,1,0,1,0,0|2,0,0]=4 4684 B8R1.13 COCC1CCC1N MCULE-4247085069 [0,1,0,1,0,0|2,0,0]=4 4685 B8R1.13 COC[C@@H]1CC[C@@H]1N MCULE-1015639522 [0,1,0,1,0,0|2,0,0]=4 4686 B8R1.13 COC[C@@H]1CC[C@@H]1N MCULE-6601508773 [0,1,0,1,0,0|2,0,0]=4 4687 B8R1.13 COC[C@@H]1CC[C@H]1N MCULE-4823593055 [0,1,0,1,0,0|2,0,0]=4 4688 B8R1.13 COC[C@@H]1CC[C@H]1N MCULE-6349984221 [0,1,0,1,0,0|2,0,0]=4 4689 B8R1.13 COC[C@H]1CC[C@@H]1N MCULE-2210338858 [0,1,0,1,0,0|2,0,0]=4 4690 B8R1.13 COC[C@H]1CC[C@@H]1N MCULE-2877629860 [0,1,0,1,0,0|2,0,0]=4 4691 B8R1.13 COC[C@H]1CC[C@@H]1N MCULE-5582450257 [0,1,0,1,0,0|2,0,0]=4 4692 B8R1.13 COC[C@H]1CC[C@@H]1N MCULE-5666025932 [0,1,0,1,0,0|2,0,0]=4 4693 B8R1.13 COC[C@H]1CC[C@@H]1N MCULE-6479999687 [0,1,0,1,0,0|2,0,0]=4 4694 B8R1.13 COC[C@H]1CC[C@@H]1N MCULE-9238987984 [0,1,0,1,0,0|2,0,0]=4 4695 B8R1.13 COC[C@H]1CC[C@H]1N MCULE-4476949370 [0,1,0,1,0,0|2,0,0]=4 4696 B8R1.13 COC[C@H]1CC[C@H]1N MCULE-4812696512 [0,1,0,1,0,0|2,0,0]=4 4697 B8R1.13 COC[C@H]1CC[C@H]1N MCULE-5922011030 [0,1,0,1,0,0|2,0,0]=4 4698 B8R1.13 COC[C@H]1CC[C@H]1N MCULE-8467603557 [0,1,0,1,0,0|2,0,0]=4 4699 B8R1.15 COC1C(C1(C)C)N MCULE-2363188274 [0,1,0,1,0,0|1,0,0]=3 4700 B8R1.19 CC1(CCCC1N)C MCULE-5921379560 [0,1,0,1,0,0|2,0,0]=4 4701 B8R1.19 CC1(CCCC1N)C MCULE-8867080038 [0,1,0,1,0,0|2,0,0]=4 4702 B8R1.19 CC1(CCCC1N)O MCULE-3396541731 [0,1,0,1,0,0|1,0,0]=3 4703 B8R1.19 CC1(CCCC1O)C MCULE-4878410443 [0,1,0,1,0,0|2,0,0]=4 4704 B8R1.19 CC1(CCCC1O)O MCULE-7509860049 [0,1,0,1,0,0|2,0,0]=4 4705 B8R1.19 CC1(CCC[C@@H]1N)C MCULE-2097025606 [0,1,0,1,0,0|2,0,0]=4 4706 B8R1.19 CC1(CCC[C@@H]1O)C MCULE-9402548740 [0,1,0,1,0,0|2,0,0]=4 4707 B8R1.19 CC1(CCC[C@H]1O)C MCULE-3856604720 [0,1,0,1,0,0|2,0,0]=4 4708 B8R1.19 CC1(CNCC1O)C MCULE-5213763198 [0,1,0,1,0,0|2,0,0]=4 4709 B8R1.19 CC1(CNCC1O)C MCULE-8373976987 [0,1,0,1,0,0|2,0,0]=4 4710 B8R1.19 CC1(CNC[C@@H]1O)C MCULE-4990738145 [0,1,0,1,0,0|2,0,0]=4 4711 B8R1.19 CC1(CNC[C@@H]1O)C MCULE-7313671873 [0,1,0,1,0,0|2,0,0]=4 4712 B8R1.19 CC1(CNC[C@@H]1O)C MCULE-9230991736 [0,1,0,1,0,0|2,0,0]=4 4713 B8R1.19 CC1(CNC[C@@H]1O)C MCULE-9959039343 [0,1,0,1,0,0|2,0,0]=4 4714 B8R1.19 CC1(CNC[C@H]1O)C MCULE-6924557368 [0,1,0,1,0,0|2,0,0]=4 4715 B8R1.19 CC1(COCC1N)C MCULE-7968039000 [0,1,0,1,0,0|1,0,0]=3 4716 B8R1.19 CC1(COCC1N)C MCULE-8618492637 [0,1,0,1,0,0|1,0,0]=3 4717 B8R1.19 CC1(OCCC1N)C MCULE-6592845715 [0,1,0,1,0,0|1,0,0]=3 4718 B8R1.19 CC1(OCCC1N)C MCULE-6909756281 [0,1,0,1,0,0|1,0,0]=3 4719 B8R1.19 CC1COCC1(C)O MCULE-8635665597 [0,1,0,1,0,0|1,0,0]=3 4720 B8R1.19 CC1OCCC1(C)N MCULE-3604874294 [0,1,0,1,0,0|1,0,0]=3 4721 B8R1.19 C[C@@H]1COC[C@]1(C)O MCULE-2882517612 [0,1,0,1,0,0|1,0,0]=3 4722 B8R1.19 C[C@@]1(CCC[C@@H]1N)O MCULE-4508286005 [0,1,0,1,0,0|1,0,0]=3 4723 B8R1.19 C[C@@]1(CCC[C@@H]1N)O MCULE-9668737274 [0,1,0,1,0,0|1,0,0]=3 4724 B8R1.19 C[C@@]1(CCC[C@H]1N)O MCULE-2369187970 [0,1,0,1,0,0|1,0,0]=3 4725 B8R1.19 C[C@H]1COC[C@@]1(C)O MCULE-6225656472 [0,1,0,1,0,0|1,0,0]=3 4726 B8R1.19 C[C@]1(CCC[C@@H]1N)O MCULE-2644040109 [0,1,0,1,0,0|1,0,0]=3 4727 B8R1.19 C[C@]1(CCC[C@H]1N)O MCULE-2446086306 [0,1,0,1,0,0|1,0,0]=3 4728 B8R1.19 C[C@]1(CCC[C@H]1N)O MCULE-8959851594 [0,1,0,1,0,0|1,0,0]=3 4729 B8R1.19 C[C@]1(CCC[C@H]1N)O MCULE-9937788175 [0,1,0,1,0,0|1,0,0]=3 4730 B8R1.19 NC1CCCC1(F)F MCULE-4099935690 [0,1,0,1,0,0|2,0,0]=4 4731 B8R1.19 NC1CCCC1(F)F MCULE-5850247735 [0,1,0,1,0,0|2,0,0]=4 4732 B8R1.19 NC1COCC1(F)F MCULE-2010512577 [0,1,0,1,0,0|1,0,0]=3 4733 B8R1.19 NC1COCC1(F)F MCULE-5301593126 [0,1,0,1,0,0|1,0,0]=3 4734 B8R1.19 OC1CCCC1(F)F MCULE-8959457751 [0,1,0,1,0,0|2,0,0]=4 4735 B8R1.19 OC1CNCC1(F)F MCULE-1987796647 [0,1,0,1,0,0|2,0,0]=4 4736 B8R1.19 OC1CNCC1(F)F MCULE-8584593093 [0,1,0,1,0,0|2,0,0]=4 4737 B8R1.19 OC1COCC1(F)F MCULE-7927915394 [0,1,0,1,0,0|1,0,0]=3 4738 B8R1.19 O[C@@H]1CNCC1(F)F MCULE-1741597631 [0,1,0,1,0,0|2,0,0]=4 4739 B8R1.19 O[C@@H]1CNCC1(F)F MCULE-2070285601 [0,1,0,1,0,0|2,0,0]=4 4740 B8R1.19 O[C@H]1CNCC1(F)F MCULE-1216408514 [0,1,0,1,0,0|2,0,0]=4 4741 B8R1.19 O[C@H]1CNCC1(F)F MCULE-1777567025 [0,1,0,1,0,0|2,0,0]=4 4742 B8R1.19 O[C@H]1CNCC1(F)F MCULE-3475529714 [0,1,0,1,0,0|2,0,0]=4 4743 B8R1.19 O[C@H]1CNCC1(F)F MCULE-9076102111 [0,1,0,1,0,0|2,0,0]=4 4744 B8R1.19 [C@@H]1(COC[C@@]1(C)O)C MCULE-5554336121 [0,1,0,1,0,0|1,0,0]=3 4745 B8R1.23 CC(C)C1CC(=O)N1 MCULE-9034089552 [0,1,0,1,0,0|1,0,1]=4 4746 B8R1.23 CC(C)[C@@H]1CC(=O)N1 MCULE-4005923993 [0,1,0,1,0,0|1,0,1]=4 4747 B8R1.24 CC1(C(CC1O)N)C MCULE-3161047738 [0,1,0,1,0,0|1,0,0]=3 4748 B8R1.24 CC1(C(CC1O)N)C MCULE-5651766781 [0,1,0,1,0,0|1,0,0]=3 4749 B8R1.24 CC1(C(CC1O)N)C MCULE-9975822471 [0,1,0,1,0,0|1,0,0]=3 4750 B8R1.24 CC1(C(CC1O)O)C MCULE-3292857168 [0,1,0,1,0,0|1,0,0]=3 4751 B8R1.24 CC1([C@@H](C[C@H]1O)N)C MCULE-3812300250 [0,1,0,1,0,0|1,0,0]=3 4752 B8R1.24 CC1([C@@H](C[C@H]1O)N)C MCULE-6109886528 [0,1,0,1,0,0|1,0,0]=3 4753 B8R1.24 CC1([C@@H](C[C@H]1O)N)C MCULE-6902780155 [0,1,0,1,0,0|1,0,0]=3 4754 B8R1.24 CC1([C@@H](C[C@H]1O)N)C MCULE-6997330478 [0,1,0,1,0,0|1,0,0]=3 4755 B8R1.24 CC1([C@H](C[C@H]1O)N)C MCULE-2114786882 [0,1,0,1,0,0|1,0,0]=3 4756 B8R1.24 CC1([C@H](C[C@H]1O)N)C MCULE-3752992263 [0,1,0,1,0,0|1,0,0]=3 4757 B8R1.24 CC1([C@H](C[C@H]1O)N)C MCULE-3787222612 [0,1,0,1,0,0|1,0,0]=3 4758 B8R1.24 CC1([C@H](C[C@H]1O)N)C MCULE-9529552439 [0,1,0,1,0,0|1,0,0]=3 4759 B8R1.24 [C@@H]1(C[C@H](C1(C)C)O)N MCULE-7200828513 [0,1,0,1,0,0|1,0,0]=3 4760 B8R1.24 [C@@H]1(C[C@H](C1(C)C)O)N MCULE-7549650861 [0,1,0,1,0,0|1,0,0]=3 4761 B8R1.27 CC1(CC1CCO)C MCULE-7855895874 [0,1,0,1,0,0|2,0,0]=4 4762 B8R1.37 COCC(N)C1CC1 MCULE-2784315900 [0,1,0,1,0,0|1,0,0]=3 4763 B8R1.37 COCC(N)C1CC1 MCULE-8580221311 [0,1,0,1,0,0|1,0,0]=3 4764 B8R1.37 COCC(O)C1CC1 MCULE-7802972677 [0,1,0,1,0,0|2,0,0]=4 4765 B8R1.37 N#CCC(N)C1CC1 MCULE-5007897536 [0,1,0,1,0,0|2,0,0]=4 4766 B8R1.37 N#CCC(N)C1CC1 MCULE-5610101014 [0,1,0,1,0,0|2,0,0]=4 4767 B8R1.37 NC(CCO)C1CC1 MCULE-1482841924 [0,1,0,1,0,0|1,0,0]=3 4768 B8R1.37 NC(CCO)C1CC1 MCULE-3230537155 [0,1,0,1,0,0|1,0,0]=3 4769 B8R1.54 C(N)(C(=O)O)C1CC1 MCULE-4833544032 [0,1,0,1,0,0|1,0,1]=4 4770 B8R1.54 CC(C)C(N)C1CC1 MCULE-1856185209 [0,1,0,1,0,0|2,0,0]=4 4771 B8R1.54 CC(C)C(N)C1CC1 MCULE-4020871491 [0,1,0,1,0,0|2,0,0]=4 4772 B8R1.54 NC(C(=O)O)C1CC1 MCULE-1974514713 [0,1,0,1,0,0|1,0,1]=4 4773 B8R1.54 NC(C(=O)O)C1CC1 MCULE-3126466096 [0,1,0,1,0,0|1,0,1]=4 4774 B8R1.54 NC(C(F)F)C1CC1 MCULE-4058798364 [0,1,0,1,0,0|2,0,0]=4 4775 B8R1.54 NC(C(F)F)C1CC1 MCULE-6641870280 [0,1,0,1,0,0|2,0,0]=4 4776 B8R1.54 N[C@@H](C(=O)O)C1CC1 MCULE-5662004537 [0,1,0,1,0,0|1,0,1]=4 4777 B8R1.54 N[C@@H](C(=O)O)C1CC1 MCULE-9004548949 [0,1,0,1,0,0|1,0,1]=4 4778 B8R1.54 N[C@H](C(=O)O)C1CC1 MCULE-4323013494 [0,1,0,1,0,0|1,0,1]=4 4779 B8R1.54 N[C@H](C(=O)O)C1CC1 MCULE-9475774396 [0,1,0,1,0,0|1,0,1]=4 4780 B8R1.78 CC(C)C1(CCC1)N MCULE-6914017446 [0,1,0,1,0,0|2,0,0]=4 4781 B8R1.78 CC(C)C1(COC1)O MCULE-2127199084 [0,1,0,1,0,0|2,0,0]=4 4782 B8R1.78 CC(N)C1(COC1)C MCULE-1633217304 [0,1,0,1,0,0|2,0,0]=4 4783 B8R1.78 CC(N)C1(COC1)C MCULE-2828392730 [0,1,0,1,0,0|2,0,0]=4 4784 B8R1.78 CC(O)C1(COC1)C MCULE-8955349534 [0,1,0,1,0,0|1,0,0]=3 4785 B8R1.78 NC1(COC1)C(=O)O MCULE-2048452241 [0,1,0,1,0,0|1,0,1]=4 4786 B8R1.11 C#CC1CCCC1O MCULE-6037624903 [0,1,0,1,0,0|2,0,0]=4 4787 B8R1.11 C#C[C@@H]1CCC[C@H]1O MCULE-7417393541 [0,1,0,1,0,0|2,0,0]=4 4788 B8R1.11 C#C[C@H]1CCC[C@@H]1O MCULE-6017503361 [0,1,0,1,0,0|2,0,0]=4 4789 B8R1.11 C#C[C@H]1CCC[C@H]1O MCULE-2764710000 [0,1,0,1,0,0|2,0,0]=4 4790 B8R1.11 CC1CCCC1CN MCULE-3896736641 [0,1,0,1,0,0|2,0,0]=4 4791 B8R1.11 CC1CCCC1CN MCULE-8678978716 [0,1,0,1,0,0|2,0,0]=4 4792 B8R1.11 CC1CCCC1CO MCULE-9356546543 [0,1,0,1,0,0|2,0,0]=4 4793 B8R1.11 CC1CCNC1CO MCULE-3727613396 [0,1,0,1,0,0|1,0,0]=3 4794 B8R1.11 CC1CNCC1CN MCULE-3155679753 [0,1,0,1,0,0|2,0,0]=4 4795 B8R1.11 CC1CNCC1CN MCULE-9411859132 [0,1,0,1,0,0|2,0,0]=4 4796 B8R1.11 CC1CNCC1CO MCULE-2423357421 [0,1,0,1,0,0|1,0,0]=3 4797 B8R1.11 CC1CNCC1CO MCULE-9628020162 [0,1,0,1,0,0|1,0,0]=3 4798 B8R1.11 CC1COCC1CO MCULE-7218606126 [0,1,0,1,0,0|1,0,0]=3 4799 B8R1.11 CC1NCCC1CO MCULE-2170675444 [0,1,0,1,0,0|2,0,0]=4 4800 B8R1.11 CC1NCCC1CO MCULE-6327696584 [0,1,0,1,0,0|2,0,0]=4 4801 B8R1.11 CC1OCCC1C=O MCULE-5505705817 [0,1,0,1,0,0|2,0,0]=4 4802 B8R1.11 CC1OCCC1CBr MCULE-2301764647 [0,1,0,1,0,0|2,0,0]=4 4803 B8R1.11 CC1OCCC1CN MCULE-8319428027 [0,1,0,1,0,0|1,0,0]=3 4804 B8R1.11 CC1OCCC1CN MCULE-9389911755 [0,1,0,1,0,0|1,0,0]=3 4805 B8R1.11 CC1OCCC1CO MCULE-4507531306 [0,1,0,1,0,0|1,0,0]=3 4806 B8R1.11 CCC1CCCC1N MCULE-3368757457 [0,1,0,1,0,0|2,0,0]=4 4807 B8R1.11 CCC1CNCC1O MCULE-2095082658 [0,1,0,1,0,0|1,0,0]=3 4808 B8R1.11 CCC1COCC1N MCULE-2113082654 [0,1,0,1,0,0|1,0,0]=3 4809 B8R1.11 CCC1NCCC1C MCULE-2665209322 [0,1,0,1,0,0|2,0,0]=4 4810 B8R1.11 CCC1NCCC1C MCULE-2699257293 [0,1,0,1,0,0|2,0,0]=4 4811 B8R1.11 CCC1NCCC1O MCULE-6141963287 [0,1,0,1,0,0|1,0,0]=3 4812 B8R1.11 CCC1NCCC1O MCULE-9283391049 [0,1,0,1,0,0|1,0,0]=3 4813 B8R1.11 CC[C@@H]1CCC[C@H]1N MCULE-6461151240 [0,1,0,1,0,0|2,0,0]=4 4814 B8R1.11 CC[C@@H]1OCC[C@H]1N MCULE-6631183888 [0,1,0,1,0,0|1,0,0]=3 4815 B8R1.11 CNC1CCCC1O MCULE-9589316744 [0,1,0,1,0,0|1,0,0]=3 4816 B8R1.11 CNC1COCC1O MCULE-3213649270 [0,1,0,1,0,0|0,0,0]=2 4817 B8R1.11 CNC1COCC1O MCULE-9580482754 [0,1,0,1,0,0|0,0,0]=2 4818 B8R1.11 CN[C@@H]1CCC[C@@H]1O MCULE-5540430832 [0,1,0,1,0,0|1,0,0]=3 4819 B8R1.11 CN[C@@H]1CCC[C@H]1O MCULE-5681644013 [0,1,0,1,0,0|1,0,0]=3 4820 B8R1.11 CN[C@H]1CCC[C@@H]1O MCULE-2896940586 [0,1,0,1,0,0|1,0,0]=3 4821 B8R1.11 CN[C@H]1CCC[C@@H]1O MCULE-4568895508 [0,1,0,1,0,0|1,0,0]=3 4822 B8R1.11 CN[C@H]1CCC[C@H]1O MCULE-3676766170 [0,1,0,1,0,0|1,0,0]=3 4823 B8R1.11 CN[C@H]1COC[C@@H]1O MCULE-2473921085 [0,1,0,1,0,0|0,0,0]=2 4824 B8R1.11 CN[C@H]1COC[C@@H]1O MCULE-3126899770 [0,1,0,1,0,0|0,0,0]=2 4825 B8R1.11 CN[C@H]1COC[C@@H]1O MCULE-7521708435 [0,1,0,1,0,0|0,0,0]=2 4826 B8R1.11 CN[C@H]1COC[C@@H]1O MCULE-9503537203 [0,1,0,1,0,0|0,0,0]=2 4827 B8R1.11 COC1CCCC1Br MCULE-2771155480 [0,1,0,1,0,0|2,0,0]=4 4828 B8R1.11 COC1CCCC1N MCULE-8362175674 [0,1,0,1,0,0|1,0,0]=3 4829 B8R1.11 COC1CCCC1N MCULE-9069118012 [0,1,0,1,0,0|1,0,0]=3 4830 B8R1.11 COC1CNCC1F MCULE-1754682247 [0,1,0,1,0,0|2,0,0]=4 4831 B8R1.11 COC1CNCC1F MCULE-2509276472 [0,1,0,1,0,0|2,0,0]=4 4832 B8R1.11 COC1CNCC1O MCULE-7390497672 [0,1,0,1,0,0|2,0,0]=4 4833 B8R1.11 COC1CNCC1O MCULE-9471743678 [0,1,0,1,0,0|2,0,0]=4 4834 B8R1.11 COC1COCC1=O MCULE-2097991610 [0,1,0,1,0,0|1,0,1]=4 4835 B8R1.11 COC1COCC1N MCULE-6188451020 [0,1,0,1,0,0|0,0,0]=2 4836 B8R1.11 COC1COCC1N MCULE-7557608634 [0,1,0,1,0,0|0,0,0]=2 4837 B8R1.11 CO[C@@H]1CCC[C@@H]1N MCULE-4692120885 [0,1,0,1,0,0|1,0,0]=3 4838 B8R1.11 CO[C@@H]1CCC[C@@H]1N MCULE-5926423252 [0,1,0,1,0,0|1,0,0]=3 4839 B8R1.11 CO[C@@H]1CCC[C@@H]1N MCULE-7482120389 [0,1,0,1,0,0|1,0,0]=3 4840 B8R1.11 CO[C@@H]1CCC[C@@H]1N MCULE-8564106437 [0,1,0,1,0,0|1,0,0]=3 4841 B8R1.11 CO[C@@H]1CCC[C@H]1N MCULE-3230499380 [0,1,0,1,0,0|1,0,0]=3 4842 B8R1.11 CO[C@@H]1CCC[C@H]1N MCULE-3289874569 [0,1,0,1,0,0|1,0,0]=3 4843 B8R1.11 CO[C@@H]1CCC[C@H]1N MCULE-6247013104 [0,1,0,1,0,0|1,0,0]=3 4844 B8R1.11 CO[C@@H]1CCC[C@H]1O MCULE-8222306700 [0,1,0,1,0,0|2,0,0]=4 4845 B8R1.11 CO[C@@H]1CNC[C@@H]1F MCULE-5609279872 [0,1,0,1,0,0|2,0,0]=4 4846 B8R1.11 CO[C@@H]1CNC[C@@H]1F MCULE-9437643189 [0,1,0,1,0,0|2,0,0]=4 4847 B8R1.11 CO[C@@H]1CNC[C@@H]1O MCULE-1844413335 [0,1,0,1,0,0|2,0,0]=4 4848 B8R1.11 CO[C@@H]1CNC[C@@H]1O MCULE-2306223649 [0,1,0,1,0,0|2,0,0]=4 4849 B8R1.11 CO[C@@H]1CNC[C@@H]1O MCULE-5999445824 [0,1,0,1,0,0|2,0,0]=4 4850 B8R1.11 CO[C@@H]1CNC[C@@H]1O MCULE-7003218448 [0,1,0,1,0,0|2,0,0]=4 4851 B8R1.11 CO[C@@H]1CNC[C@H]1F MCULE-2756919764 [0,1,0,1,0,0|2,0,0]=4 4852 B8R1.11 CO[C@@H]1CNC[C@H]1F MCULE-5848288888 [0,1,0,1,0,0|2,0,0]=4 4853 B8R1.11 CO[C@@H]1CNC[C@H]1F MCULE-8483933614 [0,1,0,1,0,0|2,0,0]=4 4854 B8R1.11 CO[C@@H]1CNC[C@H]1F MCULE-8641881566 [0,1,0,1,0,0|2,0,0]=4 4855 B8R1.11 CO[C@@H]1CNC[C@H]1O MCULE-3236104611 [0,1,0,1,0,0|2,0,0]=4 4856 B8R1.11 CO[C@@H]1CNC[C@H]1O MCULE-4378618899 [0,1,0,1,0,0|2,0,0]=4 4857 B8R1.11 CO[C@@H]1CNC[C@H]1O MCULE-7624934110 [0,1,0,1,0,0|2,0,0]=4 4858 B8R1.11 CO[C@@H]1CNC[C@H]1O MCULE-9044354330 [0,1,0,1,0,0|2,0,0]=4 4859 B8R1.11 CO[C@@H]1COC[C@@H]1N MCULE-3467113726 [0,1,0,1,0,0|0,0,0]=2 4860 B8R1.11 CO[C@@H]1COC[C@@H]1N MCULE-3863734761 [0,1,0,1,0,0|0,0,0]=2 4861 B8R1.11 CO[C@@H]1COC[C@@H]1N MCULE-8760768893 [0,1,0,1,0,0|0,0,0]=2 4862 B8R1.11 CO[C@@H]1COC[C@@H]1N MCULE-9860387973 [0,1,0,1,0,0|0,0,0]=2 4863 B8R1.11 CO[C@@H]1COC[C@H]1N MCULE-1558766585 [0,1,0,1,0,0|0,0,0]=2 4864 B8R1.11 CO[C@@H]1COC[C@H]1N MCULE-2616949947 [0,1,0,1,0,0|0,0,0]=2 4865 B8R1.11 CO[C@@H]1COC[C@H]1N MCULE-3846862415 [0,1,0,1,0,0|0,0,0]=2 4866 B8R1.11 CO[C@@H]1COC[C@H]1N MCULE-7298485885 [0,1,0,1,0,0|0,0,0]=2 4867 B8R1.11 CO[C@@H]1COC[C@H]1O MCULE-8600684247 [0,1,0,1,0,0|1,0,0]=3 4868 B8R1.11 CO[C@H]1CCC[C@@H]1N MCULE-2030514470 [0,1,0,1,0,0|1,0,0]=3 4869 B8R1.11 CO[C@H]1CCC[C@@H]1N MCULE-7221434150 [0,1,0,1,0,0|1,0,0]=3 4870 B8R1.11 CO[C@H]1CCC[C@H]1N MCULE-5694225216 [0,1,0,1,0,0|1,0,0]=3 4871 B8R1.11 CO[C@H]1CCC[C@H]1N MCULE-6324790556 [0,1,0,1,0,0|1,0,0]=3 4872 B8R1.11 CO[C@H]1CCC[C@H]1N MCULE-7994033941 [0,1,0,1,0,0|1,0,0]=3 4873 B8R1.11 CO[C@H]1CCC[C@H]1N MCULE-9253743808 [0,1,0,1,0,0|1,0,0]=3 4874 B8R1.11 CO[C@H]1CNC[C@@H]1F MCULE-1946101135 [0,1,0,1,0,0|2,0,0]=4 4875 B8R1.11 CO[C@H]1CNC[C@@H]1F MCULE-7242345050 [0,1,0,1,0,0|2,0,0]=4 4876 B8R1.11 CO[C@H]1CNC[C@@H]1F MCULE-9094186935 [0,1,0,1,0,0|2,0,0]=4 4877 B8R1.11 CO[C@H]1CNC[C@@H]1F MCULE-9312446955 [0,1,0,1,0,0|2,0,0]=4 4878 B8R1.11 CO[C@H]1CNC[C@@H]1O MCULE-2923113363 [0,1,0,1,0,0|2,0,0]=4 4879 B8R1.11 CO[C@H]1CNC[C@@H]1O MCULE-3550374877 [0,1,0,1,0,0|2,0,0]=4 4880 B8R1.11 CO[C@H]1CNC[C@@H]1O MCULE-4186563604 [0,1,0,1,0,0|2,0,0]=4 4881 B8R1.11 CO[C@H]1CNC[C@@H]1O MCULE-9511119070 [0,1,0,1,0,0|2,0,0]=4 4882 B8R1.11 CO[C@H]1CNC[C@H]1F MCULE-6551973591 [0,1,0,1,0,0|2,0,0]=4 4883 B8R1.11 CO[C@H]1CNC[C@H]1F MCULE-7655621214 [0,1,0,1,0,0|2,0,0]=4 4884 B8R1.11 CO[C@H]1CNC[C@H]1O MCULE-1188874550 [0,1,0,1,0,0|2,0,0]=4 4885 B8R1.11 CO[C@H]1CNC[C@H]1O MCULE-5206444167 [0,1,0,1,0,0|2,0,0]=4 4886 B8R1.11 CO[C@H]1CNC[C@H]1O MCULE-7887701450 [0,1,0,1,0,0|2,0,0]=4 4887 B8R1.11 CO[C@H]1CNC[C@H]1O MCULE-8265041947 [0,1,0,1,0,0|2,0,0]=4 4888 B8R1.11 CO[C@H]1COC[C@@H]1N MCULE-4582501901 [0,1,0,1,0,0|0,0,0]=2 4889 B8R1.11 CO[C@H]1COC[C@@H]1N MCULE-8842335446 [0,1,0,1,0,0|0,0,0]=2 4890 B8R1.11 CO[C@H]1COC[C@@H]1N MCULE-9594556693 [0,1,0,1,0,0|0,0,0]=2 4891 B8R1.11 CO[C@H]1COC[C@@H]1N MCULE-9701067125 [0,1,0,1,0,0|0,0,0]=2 4892 B8R1.11 CO[C@H]1COC[C@H]1N MCULE-9067624195 [0,1,0,1,0,0|0,0,0]=2 4893 B8R1.11 CSC1CCCC1N MCULE-2843614842 [0,1,0,1,0,0|1,1,0]=4 4894 B8R1.11 C[C@@H]1CCN[C@@H]1CO MCULE-7458696223 [0,1,0,1,0,0|1,0,0]=3 4895 B8R1.11 C[C@@H]1CCN[C@H]1CO MCULE-7407237429 [0,1,0,1,0,0|1,0,0]=3 4896 B8R1.11 C[C@@H]1CNC[C@H]1CO MCULE-9810701855 [0,1,0,1,0,0|1,0,0]=3 4897 B8R1.11 C[C@@H]1NCC[C@@H]1CO MCULE-3472303985 [0,1,0,1,0,0|2,0,0]=4 4898 B8R1.11 C[C@@H]1NCC[C@H]1CO MCULE-2404886012 [0,1,0,1,0,0|2,0,0]=4 4899 B8R1.11 C[C@@H]1NCC[C@H]1CO MCULE-3480517072 [0,1,0,1,0,0|2,0,0]=4 4900 B8R1.11 C[C@@H]1NCC[C@H]1CO MCULE-5374631986 [0,1,0,1,0,0|2,0,0]=4 4901 B8R1.11 C[C@@H]1OCC[C@H]1CN MCULE-1134549336 [0,1,0,1,0,0|1,0,0]=3 4902 B8R1.11 C[C@@H]1OCC[C@H]1CN MCULE-7039232701 [0,1,0,1,0,0|1,0,0]=3 4903 B8R1.11 C[C@@H]1OCC[C@H]1CO MCULE-2815374259 [0,1,0,1,0,0|1,0,0]=3 4904 B8R1.11 C[C@H]1CCN[C@@H]1CO MCULE-9913318158 [0,1,0,1,0,0|1,0,0]=3 4905 B8R1.11 C[C@H]1CCN[C@H]1CO MCULE-4322110368 [0,1,0,1,0,0|1,0,0]=3 4906 B8R1.11 C[C@H]1CNC[C@@H]1CO MCULE-2024872524 [0,1,0,1,0,0|1,0,0]=3 4907 B8R1.11 C[C@H]1CNC[C@@H]1CO MCULE-3327012262 [0,1,0,1,0,0|1,0,0]=3 4908 B8R1.11 C[C@H]1CNC[C@@H]1CO MCULE-4174376777 [0,1,0,1,0,0|1,0,0]=3 4909 B8R1.11 C[C@H]1CNC[C@@H]1CO MCULE-4680966874 [0,1,0,1,0,0|1,0,0]=3 4910 B8R1.11 C[C@H]1CNC[C@@H]1CO MCULE-8985861060 [0,1,0,1,0,0|1,0,0]=3 4911 B8R1.11 C[C@H]1NCC[C@@H]1CO MCULE-1622957258 [0,1,0,1,0,0|2,0,0]=4 4912 B8R1.11 C[C@H]1NCC[C@H]1CO MCULE-7769712307 [0,1,0,1,0,0|2,0,0]=4 4913 B8R1.11 C[C@H]1NCC[C@H]1CO MCULE-9254010133 [0,1,0,1,0,0|2,0,0]=4 4914 B8R1.11 C[C@H]1OCC[C@H]1CN MCULE-1227545702 [0,1,0,1,0,0|1,0,0]=3 4915 B8R1.11 C[C@H]1OCC[C@H]1CN MCULE-9284060815 [0,1,0,1,0,0|1,0,0]=3 4916 B8R1.11 C[C@H]1OCC[C@H]1CO MCULE-8680094992 [0,1,0,1,0,0|1,0,0]=3 4917 B8R1.11 N#CC1CCCC1N MCULE-2657790377 [0,1,0,1,0,0|2,0,0]=4 4918 B8R1.11 N#CC1CCCC1N MCULE-3586283447 [0,1,0,1,0,0|2,0,0]=4 4919 B8R1.11 N#CC1CCCC1O MCULE-8441776059 [0,1,0,1,0,0|1,0,1]=4 4920 B8R1.11 N#C[C@@H]1CCC[C@@H]1N MCULE-3868705638 [0,1,0,1,0,0|2,0,0]=4 4921 B8R1.11 N#C[C@@H]1CCC[C@@H]1N MCULE-5875539247 [0,1,0,1,0,0|2,0,0]=4 4922 B8R1.11 N#C[C@@H]1CCC[C@@H]1N MCULE-8719885109 [0,1,0,1,0,0|2,0,0]=4 4923 B8R1.11 N#C[C@@H]1CCC[C@@H]1N MCULE-9418838624 [0,1,0,1,0,0|2,0,0]=4 4924 B8R1.11 N#C[C@@H]1CCC[C@H]1O MCULE-4467355190 [0,1,0,1,0,0|1,0,1]=4 4925 B8R1.11 N#C[C@@H]1CCC[C@H]1O MCULE-8795058387 [0,1,0,1,0,0|1,0,1]=4 4926 B8R1.11 N#C[C@H]1CCC[C@H]1N MCULE-3483623297 [0,1,0,1,0,0|2,0,0]=4 4927 B8R1.11 N#C[C@H]1CCC[C@H]1N MCULE-3989890564 [0,1,0,1,0,0|2,0,0]=4 4928 B8R1.11 N#C[C@H]1CCC[C@H]1N MCULE-8145436082 [0,1,0,1,0,0|2,0,0]=4 4929 B8R1.11 N#C[C@H]1CCC[C@H]1N MCULE-8299410277 [0,1,0,1,0,0|2,0,0]=4 4930 B8R1.11 NC1CCCC1CO MCULE-9652022908 [0,1,0,1,0,0|1,0,0]=3 4931 B8R1.11 NC1COCC1CO MCULE-6651647999 [0,1,0,1,0,0|0,0,0]=2 4932 B8R1.11 NCC1CCCC1F MCULE-6144218913 [0,1,0,1,0,0|2,0,0]=4 4933 B8R1.11 NCC1CCCC1F MCULE-6567537087 [0,1,0,1,0,0|2,0,0]=4 4934 B8R1.11 NCC1CCCC1N MCULE-8430269654 [0,1,0,1,0,0|2,0,0]=4 4935 B8R1.11 NCC1CCCC1O MCULE-6648305550 [0,1,0,1,0,0|1,0,0]=3 4936 B8R1.11 NCC1COCC1O MCULE-7629136815 [0,1,0,1,0,0|0,0,0]=2 4937 B8R1.11 NCC1COCC1O MCULE-9331285001 [0,1,0,1,0,0|0,0,0]=2 4938 B8R1.11 NC[C@@H]1CCC[C@H]1F MCULE-1610227273 [0,1,0,1,0,0|2,0,0]=4 4939 B8R1.11 NC[C@@H]1CCC[C@H]1F MCULE-1834909475 [0,1,0,1,0,0|2,0,0]=4 4940 B8R1.11 NC[C@@H]1CCC[C@H]1F MCULE-2170917176 [0,1,0,1,0,0|2,0,0]=4 4941 B8R1.11 NC[C@@H]1CCC[C@H]1F MCULE-2741482456 [0,1,0,1,0,0|2,0,0]=4 4942 B8R1.11 NC[C@@H]1COC[C@@H]1O MCULE-1244186811 [0,1,0,1,0,0|0,0,0]=2 4943 B8R1.11 NC[C@@H]1COC[C@@H]1O MCULE-6610306543 [0,1,0,1,0,0|0,0,0]=2 4944 B8R1.11 NC[C@@H]1COC[C@H]1O MCULE-3050365915 [0,1,0,1,0,0|0,0,0]=2 4945 B8R1.11 NC[C@@H]1COC[C@H]1O MCULE-7562651947 [0,1,0,1,0,0|0,0,0]=2 4946 B8R1.11 NC[C@H]1COC[C@@H]1O MCULE-3389541880 [0,1,0,1,0,0|0,0,0]=2 4947 B8R1.11 NC[C@H]1COC[C@@H]1O MCULE-4457950567 [0,1,0,1,0,0|0,0,0]=2 4948 B8R1.11 NC[C@H]1COC[C@@H]1O MCULE-8588609893 [0,1,0,1,0,0|0,0,0]=2 4949 B8R1.11 NC[C@H]1COC[C@@H]1O MCULE-9441669251 [0,1,0,1,0,0|0,0,0]=2 4950 B8R1.11 NC[C@H]1COC[C@H]1O MCULE-8711391145 [0,1,0,1,0,0|0,0,0]=2 4951 B8R1.11 NC[C@H]1COC[C@H]1O MCULE-9812036421 [0,1,0,1,0,0|0,0,0]=2 4952 B8R1.11 NN1CCCC1CO MCULE-1842894120 [0,1,0,1,0,0|2,0,0]=4 4953 B8R1.11 NN1CCC[C@H]1CO MCULE-2058705707 [0,1,0,1,0,0|2,0,0]=4 4954 B8R1.11 NNC1CCCC1O MCULE-4679888412 [0,1,0,1,0,0|1,0,0]=3 4955 B8R1.11 NN[C@@H]1CCC[C@H]1O MCULE-6631597748 [0,1,0,1,0,0|1,0,0]=3 4956 B8R1.11 NN[C@@H]1CCC[C@H]1O MCULE-9568290705 [0,1,0,1,0,0|1,0,0]=3 4957 B8R1.11 N[C@@H]1CCC[C@H]1CO MCULE-7218353328 [0,1,0,1,0,0|1,0,0]=3 4958 B8R1.11 N[C@@H]1COC[C@@H]1CO MCULE-8267820303 [0,1,0,1,0,0|0,0,0]=2 4959 B8R1.11 N[C@@H]1COC[C@H]1CO MCULE-3070797384 [0,1,0,1,0,0|0,0,0]=2 4960 B8R1.11 N[C@@H]1COC[C@H]1CO MCULE-4572096805 [0,1,0,1,0,0|0,0,0]=2 4961 B8R1.11 N[C@H]1CCC[C@H]1CO MCULE-3793323277 [0,1,0,1,0,0|1,0,0]=3 4962 B8R1.11 N[C@H]1CCC[C@H]1CO MCULE-5297422093 [0,1,0,1,0,0|1,0,0]=3 4963 B8R1.11 N[C@H]1COC[C@@H]1CO MCULE-2948740480 [0,1,0,1,0,0|0,0,0]=2 4964 B8R1.11 N[C@H]1COC[C@H]1CO MCULE-3409455124 [0,1,0,1,0,0|0,0,0]=2 4965 B8R1.11 N[C@H]1COC[C@H]1CO MCULE-6058647833 [0,1,0,1,0,0|0,0,0]=2 4966 B8R1.11 N[C@H]1COC[C@H]1CO MCULE-6847790594 [0,1,0,1,0,0|0,0,0]=2 4967 B8R1.11 N[C@H]1COC[C@H]1CO MCULE-8456266436 [0,1,0,1,0,0|0,0,0]=2 4968 B8R1.11 OCC1CCCC1O MCULE-7244611817 [0,1,0,1,0,0|1,0,0]=3 4969 B8R1.11 OCC1CNCC1O MCULE-6800319532 [0,1,0,1,0,0|0,0,0]=2 4970 B8R1.11 OCC1CNCC1O MCULE-8508401397 [0,1,0,1,0,0|0,0,0]=2 4971 B8R1.11 OCC1NCCC1O MCULE-6288507636 [0,1,0,1,0,0|0,0,0]=2 4972 B8R1.11 OCC1NCCC1O MCULE-6806405470 [0,1,0,1,0,0|0,0,0]=2 4973 B8R1.11 OCC1OCCC1O MCULE-2601628372 [0,1,0,1,0,0|1,0,0]=3 4974 B8R1.11 OC[C@@H]1CNC[C@@H]1O MCULE-4006152813 [0,1,0,1,0,0|0,0,0]=2 4975 B8R1.11 OC[C@@H]1CNC[C@@H]1O MCULE-5884019743 [0,1,0,1,0,0|0,0,0]=2 4976 B8R1.11 OC[C@@H]1CNC[C@H]1O MCULE-4276332736 [0,1,0,1,0,0|0,0,0]=2 4977 B8R1.11 OC[C@@H]1CNC[C@H]1O MCULE-5570487527 [0,1,0,1,0,0|0,0,0]=2 4978 B8R1.11 OC[C@@H]1NCC[C@@H]1O MCULE-8384230507 [0,1,0,1,0,0|0,0,0]=2 4979 B8R1.11 OC[C@@H]1NCC[C@H]1O MCULE-3549294738 [0,1,0,1,0,0|0,0,0]=2 4980 B8R1.11 OC[C@H]1CNC[C@@H]1O MCULE-4150422763 [0,1,0,1,0,0|0,0,0]=2 4981 B8R1.11 OC[C@H]1CNC[C@@H]1O MCULE-4399626759 [0,1,0,1,0,0|0,0,0]=2 4982 B8R1.11 OC[C@H]1CNC[C@H]1O MCULE-1964844966 [0,1,0,1,0,0|0,0,0]=2 4983 B8R1.11 OC[C@H]1CNC[C@H]1O MCULE-2031563638 [0,1,0,1,0,0|0,0,0]=2 4984 B8R1.11 OC[C@H]1CNC[C@H]1O MCULE-5072230521 [0,1,0,1,0,0|0,0,0]=2 4985 B8R1.11 OC[C@H]1CNC[C@H]1O MCULE-6483520020 [0,1,0,1,0,0|0,0,0]=2 4986 B8R1.11 OC[C@H]1NCC[C@@H]1O MCULE-3020492285 [0,1,0,1,0,0|0,0,0]=2 4987 B8R1.11 OC[C@H]1NCC[C@@H]1O MCULE-4180813715 [0,1,0,1,0,0|0,0,0]=2 4988 B8R1.11 OC[C@H]1NCC[C@@H]1O MCULE-8831128340 [0,1,0,1,0,0|0,0,0]=2 4989 B8R1.11 OC[C@H]1NCC[C@@H]1O MCULE-9415023769 [0,1,0,1,0,0|0,0,0]=2 4990 B8R1.11 OC[C@H]1NCC[C@H]1O MCULE-9396804561 [0,1,0,1,0,0|0,0,0]=2 4991 B8R1.11 OC[C@H]1OC=C[C@@H]1O MCULE-7880756266 [0,1,0,1,0,0|1,0,1]=4 4992 B8R1.11 OC[C@H]1OCC[C@@H]1O MCULE-4089527318 [0,1,0,1,0,0|1,0,0]=3 4993 B8R1.11 OC[C@H]1OCC[C@@H]1O MCULE-9198335558 [0,1,0,1,0,0|1,0,0]=3 4994 B8R1.11 [C@@H]1(CNC[C@H]1OC)F MCULE-1169329370 [0,1,0,1,0,0|2,0,0]=4 4995 B8R1.11 [C@@H]1(CNC[C@H]1OC)F MCULE-1399117285 [0,1,0,1,0,0|2,0,0]=4 4996 B8R1.11 [C@@H]1(CNC[C@H]1OC)O MCULE-3599095266 [0,1,0,1,0,0|2,0,0]=4 4997 B8R1.11 [C@@H]1(CNC[C@H]1OC)O MCULE-7728927623 [0,1,0,1,0,0|2,0,0]=4 4998 B8R1.11 [C@H]1(CCC[C@H]1CO)N MCULE-8523302139 [0,1,0,1,0,0|1,0,0]=3 4999 B8R1.11 [C@H]1(CCN[C@@H]1C)CO MCULE-8740397030 [0,1,0,1,0,0|2,0,0]=4 5000 B8R1.11 [C@H]1(CCN[C@@H]1C)CO MCULE-9648533132 [0,1,0,1,0,0|2,0,0]=4 5001 B8R1.11 [C@H]1(CCO[C@@H]1C)CN MCULE-6798476466 [0,1,0,1,0,0|1,0,0]=3 5002 B8R1.11 [C@H]1(CCO[C@@H]1C)CN MCULE-9186622307 [0,1,0,1,0,0|1,0,0]=3 5003 B8R1.11 [C@H]1(CCO[C@@H]1C)CO MCULE-5629055834 [0,1,0,1,0,0|1,0,0]=3 5004 B8R1.11 [C@H]1(CNC[C@H]1OC)F MCULE-4422400064 [0,1,0,1,0,0|2,0,0]=4 5005 B8R1.11 [C@H]1(CNC[C@H]1OC)F MCULE-7414147451 [0,1,0,1,0,0|2,0,0]=4 5006 B8R1.11 [C@H]1(CNC[C@H]1OC)O MCULE-3319396411 [0,1,0,1,0,0|2,0,0]=4 5007 B8R1.11 [C@H]1(CNC[C@H]1OC)O MCULE-6548219161 [0,1,0,1,0,0|2,0,0]=4 5008 B8R1.11 [C@H]1(COC[C@@H]1CN)O MCULE-1038770438 [0,1,0,1,0,0|0,0,0]=2 5009 B8R1.11 [C@H]1(COC[C@H]1CN)O MCULE-3362382906 [0,1,0,1,0,0|0,0,0]=2 5010 B8R1.11 [C@H]1(COC[C@H]1CN)O MCULE-8153203630 [0,1,0,1,0,0|0,0,0]=2 5011 B8R1.12 C1(CCC1CO)CO MCULE-2925182914 [0,1,0,1,0,0|1,0,0]=3 5012 B8R1.12 COC1CCC1CO MCULE-6344516762 [0,1,0,1,0,0|1,0,0]=3 5013 B8R1.12 CO[C@@H]1CC[C@H]1CO MCULE-4926952555 [0,1,0,1,0,0|1,0,0]=3 5014 B8R1.12 OC[C@@H]1CC[C@H]1CO MCULE-9248215797 [0,1,0,1,0,0|1,0,0]=3 5015 B8R1.12 [C@@H]1(CC[C@H]1CO)CO MCULE-3818148307 [0,1,0,1,0,0|1,0,0]=3 5016 B8R1.38 CC(CO)C1CCC1 MCULE-1784327025 [0,1,0,1,0,0|2,0,0]=4 5017 B8R1.38 CC(CO)C1CCO1 MCULE-2444675648 [0,1,0,1,0,0|1,0,0]=3 5018 B8R1.38 CCC(N)C1CCC1 MCULE-4148346502 [0,1,0,1,0,0|2,0,0]=4 5019 B8R1.38 CCC(N)C1CCC1 MCULE-8370575436 [0,1,0,1,0,0|2,0,0]=4 5020 B8R1.38 CCC(O)C1CCC1 MCULE-5180007399 [0,1,0,1,0,0|2,0,0]=4 5021 B8R1.38 CCC(O)C1COC1 MCULE-1846989475 [0,1,0,1,0,0|1,0,0]=3 5022 B8R1.38 COC(C)C1CNC1 MCULE-5997179380 [0,1,0,1,0,0|2,0,0]=4 5023 B8R1.38 COC(C)C1CNC1 MCULE-8250860953 [0,1,0,1,0,0|2,0,0]=4 5024 B8R1.38 NC(CO)C1CCC1 MCULE-1060557753 [0,1,0,1,0,0|1,0,0]=3 5025 B8R1.38 NC(CO)C1CCC1 MCULE-4732995704 [0,1,0,1,0,0|1,0,0]=3 5026 B8R1.38 NCC(N)C1CCC1 MCULE-5439532200 [0,1,0,1,0,0|2,0,0]=4 5027 B8R1.38 NCC(N)C1CCC1 MCULE-8490064832 [0,1,0,1,0,0|2,0,0]=4 5028 B8R1.38 NCC(O)C1CCC1 MCULE-3437732656 [0,1,0,1,0,0|2,0,0]=4 5029 B8R1.38 NCC(O)C1CCC1 MCULE-3764801914 [0,1,0,1,0,0|2,0,0]=4 5030 B8R1.38 N[C@@H](CO)C1CCC1 MCULE-1191204694 [0,1,0,1,0,0|1,0,0]=3 5031 B8R1.38 N[C@@H](CO)C1CCC1 MCULE-4280800914 [0,1,0,1,0,0|1,0,0]=3 5032 B8R1.38 N[C@@H](CO)C1CCC1 MCULE-4912879577 [0,1,0,1,0,0|1,0,0]=3 5033 B8R1.38 N[C@@H](CO)C1CCC1 MCULE-8248389845 [0,1,0,1,0,0|1,0,0]=3 5034 B8R1.38 N[C@H](CO)C1CCC1 MCULE-2165772919 [0,1,0,1,0,0|1,0,0]=3 5035 B8R1.38 N[C@H](CO)C1CCC1 MCULE-5153627963 [0,1,0,1,0,0|1,0,0]=3 5036 B8R1.38 N[C@H](CO)C1CCC1 MCULE-5389043091 [0,1,0,1,0,0|1,0,0]=3 5037 B8R1.38 N[C@H](CO)C1CCC1 MCULE-7675577168 [0,1,0,1,0,0|1,0,0]=3 5038 B8R1.38 N[C@H](CO)C1COC1 MCULE-3365163158 [0,1,0,1,0,0|0,0,0]=2 5039 B8R1.38 N[C@H](CO)C1COC1 MCULE-4558714642 [0,1,0,1,0,0|0,0,0]=2 5040 B8R1.38 OCC(O)C1CCC1 MCULE-5695655912 [0,1,0,1,0,0|2,0,0]=4 5041 B8R1.39 CC1(CC1)C(O)CN MCULE-6261487507 [0,1,0,1,0,0|2,0,0]=4 5042 B8R1.39 CC1(CC1)C(O)CO MCULE-9588411733 [0,1,0,1,0,0|2,0,0]=4 5043 B8R1.39 OCC(O)C1(CC1)F MCULE-2454090628 [0,1,0,1,0,0|2,0,0]=4 5044 B8R1.50 CC1C(CCN1C)N MCULE-9387568843 [0,1,0,1,0,0|2,0,0]=4 5045 B8R1.50 CC1CCC(C1N)C MCULE-5534270110 [0,1,0,1,0,0|2,0,0]=4 5046 B8R1.50 CC1CCC(C1N)C MCULE-9569539393 [0,1,0,1,0,0|2,0,0]=4 5047 B8R1.50 CC1CCC(C1O)O MCULE-3292232581 [0,1,0,1,0,0|2,0,0]=4 5048 B8R1.50 NC1CCC(C1O)O MCULE-2902511864 [0,1,0,1,0,0|1,0,0]=3 5049 B8R1.50 NC1CCC(C1O)O MCULE-2997796956 [0,1,0,1,0,0|1,0,0]=3 5050 B8R1.50 N[C@@H]1C(=O)NC[C@H]1O MCULE-6840872048 [0,1,0,1,0,0|0,0,2]=4 5051 B8R1.50 N[C@@H]1CC[C@@H]([C@H]1O)O MCULE-4654712954 [0,1,0,1,0,0|1,0,0]=3 5052 B8R1.50 N[C@@H]1CC[C@@H]([C@H]1O)O MCULE-4756579413 [0,1,0,1,0,0|1,0,0]=3 5053 B8R1.50 N[C@@H]1CC[C@@H]([C@H]1O)O MCULE-5386854672 [0,1,0,1,0,0|1,0,0]=3 5054 B8R1.50 N[C@@H]1CC[C@@H]([C@H]1O)O MCULE-8517121727 [0,1,0,1,0,0|1,0,0]=3 5055 B8R1.50 N[C@@H]1CC[C@H]([C@@H]1O)O MCULE-1001347318 [0,1,0,1,0,0|1,0,0]=3 5056 B8R1.50 N[C@@H]1CC[C@H]([C@@H]1O)O MCULE-3161518566 [0,1,0,1,0,0|1,0,0]=3 5057 B8R1.50 N[C@@H]1CC[C@H]([C@@H]1O)O MCULE-8097854840 [0,1,0,1,0,0|1,0,0]=3 5058 B8R1.50 N[C@@H]1CC[C@H]([C@@H]1O)O MCULE-9614047785 [0,1,0,1,0,0|1,0,0]=3 5059 B8R1.50 N[C@@H]1CC[C@H]([C@H]1O)O MCULE-3397642974 [0,1,0,1,0,0|1,0,0]=3 5060 B8R1.50 N[C@@H]1CC[C@H]([C@H]1O)O MCULE-5620525999 [0,1,0,1,0,0|1,0,0]=3 5061 B8R1.50 N[C@@H]1CC[C@H]([C@H]1O)O MCULE-8393185418 [0,1,0,1,0,0|1,0,0]=3 5062 B8R1.50 N[C@@H]1CC[C@H]([C@H]1O)O MCULE-9763920178 [0,1,0,1,0,0|1,0,0]=3 5063 B8R1.50 O=C1OCC(C1O)O MCULE-9766741798 [0,1,0,1,0,0|1,0,1]=4 5064 B8R1.50 O=C1OC[C@@H]([C@@H]1Br)O MCULE-5447777048 [0,1,0,1,0,0|1,0,1]=4 5065 B8R1.50 O=C1OC[C@@H]([C@@H]1Br)O MCULE-8691985034 [0,1,0,1,0,0|1,0,1]=4 5066 B8R1.50 O=C1OC[C@@H]([C@@H]1O)O MCULE-8629460196 [0,1,0,1,0,0|1,0,1]=4 5067 B8R1.50 O=C1OC[C@@H]([C@H]1O)O MCULE-7303431003 [0,1,0,1,0,0|1,0,1]=4 5068 B8R1.50 O=C1OC[C@H]([C@H]1O)O MCULE-4704805755 [0,1,0,1,0,0|1,0,1]=4 5069 B8R1.50 O=C1OC[C@H]([C@H]1O)O MCULE-7070309718 [0,1,0,1,0,0|1,0,1]=4 5070 B8R1.50 O=C1OC[C@H]([C@H]1O)O MCULE-7824820688 [0,1,0,1,0,0|1,0,1]=4 5071 B8R1.50 OC1COC(C1O)O MCULE-2562953459 [0,1,0,1,0,0|1,0,0]=3 5072 B8R1.50 OC1OC[C@@H]([C@H]1O)O MCULE-4484765937 [0,1,0,1,0,0|1,0,0]=3 5073 B8R1.50 OC1OC[C@H]([C@@H]1O)O MCULE-4663451850 [0,1,0,1,0,0|1,0,0]=3 5074 B8R1.28 CC(C)(CO)C1CC1 MCULE-2983197297 [0,1,0,1,0,0|2,0,0]=4 5075 B8R1.28 CC(N)(CO)C1CC1 MCULE-8295035784 [0,1,0,1,0,0|1,0,0]=3 5076 B8R1.28 CCC(C)(N)C1CC1 MCULE-3249204454 [0,1,0,1,0,0|2,0,0]=4 5077 B8R1.28 CCC(C)(N)C1CC1 MCULE-9890630828 [0,1,0,1,0,0|2,0,0]=4 5078 B8R1.28 OCC(F)(F)C1CC1 MCULE-6370218002 [0,1,0,1,0,0|2,0,0]=4 5079 B8R1.63 CC(C)C1(CC1)CN MCULE-3968133975 [0,1,0,1,0,0|2,0,0]=4 5080 B8R1.63 CC(C)C1(CC1)CN MCULE-4189001122 [0,1,0,1,0,0|2,0,0]=4 5081 B8R1.63 CC(C)C1(CC1)CO MCULE-3175047466 [0,1,0,1,0,0|2,0,0]=4 5082 B8R1.63 CC(N)C1(CC1)CO MCULE-2320088907 [0,1,0,1,0,0|2,0,0]=4 5083 B8R1.63 CC(N)C1(CC1)CO MCULE-7486971083 [0,1,0,1,0,0|2,0,0]=4 5084 B8R1.63 CC(O)C1(CC1)CO MCULE-8718566573 [0,1,0,1,0,0|1,0,0]=3 5085 B8R1.63 C[C@@H](N)C1(CC1)CO MCULE-6739733341 [0,1,0,1,0,0|2,0,0]=4 5086 B8R1.63 C[C@@H](N)C1(CC1)CO MCULE-7430383351 [0,1,0,1,0,0|2,0,0]=4 5087 B8R1.87 CC1(C(C1(C)C)N)C MCULE-1702151357 [0,1,0,1,0,0|2,0,0]=4 5088 B8R1.87 CC1(C(C1(C)C)N)C MCULE-9025220862 [0,1,0,1,0,0|2,0,0]=4 5089 B8R1.48 CC1(CCC1CO)C MCULE-4983182049 [0,1,0,1,0,0|2,0,0]=4 5090 B8R1.48 CC1(CNC1CO)C MCULE-2336364671 [0,1,0,1,0,0|1,0,0]=3 5091 B8R1.48 CC1(COC1CO)C MCULE-5407535297 [0,1,0,1,0,0|2,0,0]=4 5092 B8R1.48 OCC1CCC1(F)F MCULE-3131437190 [0,1,0,1,0,0|2,0,0]=4 5093 B8R1.55 CC(C)(N)C1COC1 MCULE-6277200928 [0,1,0,1,0,0|2,0,0]=4 5094 B8R1.55 CC(C)(O)C1CCC1 MCULE-5652058826 [0,1,0,1,0,0|2,0,0]=4 5095 B8R1.55 CC(C)(O)C1CCN1 MCULE-1487456830 [0,1,0,1,0,0|1,0,0]=3 5096 B8R1.55 CC(C)(O)C1CCN1 MCULE-2185277032 [0,1,0,1,0,0|1,0,0]=3 5097 B8R1.55 CC(C)(O)C1CCN1 MCULE-2988683327 [0,1,0,1,0,0|1,0,0]=3 5098 B8R1.55 CC(C)(O)C1CCN1 MCULE-9151036064 [0,1,0,1,0,0|1,0,0]=3 5099 B8R1.55 CC(C)(O)C1CNC1 MCULE-2063799623 [0,1,0,1,0,0|2,0,0]=4 5100 B8R1.55 CC(C)(O)C1CNC1 MCULE-5996447300 [0,1,0,1,0,0|2,0,0]=4 5101 B8R1.55 CC(C)(O)[C@@H]1CCN1 MCULE-3384630145 [0,1,0,1,0,0|1,0,0]=3 5102 B8R1.55 CC(C)(O)[C@@H]1CCN1 MCULE-4108139068 [0,1,0,1,0,0|1,0,0]=3 5103 B8R1.55 CC(C)(O)[C@@H]1CCN1 MCULE-5312190045 [0,1,0,1,0,0|1,0,0]=3 5104 B8R1.55 CC(C)(O)[C@@H]1CCN1 MCULE-7637417032 [0,1,0,1,0,0|1,0,0]=3 5105 B8R1.55 CC(C)(O)[C@H]1CCN1 MCULE-1039835790 [0,1,0,1,0,0|1,0,0]=3 5106 B8R1.55 CC(C)(O)[C@H]1CCN1 MCULE-2316585316 [0,1,0,1,0,0|1,0,0]=3 5107 B8R1.55 CC(C)(O)[C@H]1CCN1 MCULE-3931949655 [0,1,0,1,0,0|1,0,0]=3 5108 B8R1.55 CC(C)(O)[C@H]1CCN1 MCULE-7464528415 [0,1,0,1,0,0|1,0,0]=3 5109 B8R1.70 CC(C)(C)C1(CC1)N MCULE-1678842721 [0,1,0,1,0,0|2,0,0]=4 5110 B8R1.70 CC(C)(C)C1(CC1)N MCULE-3342465532 [0,1,0,1,0,0|2,0,0]=4 5111 B8R1.70 CC(F)(F)C1(CC1)N MCULE-2321044540 [0,1,0,1,0,0|2,0,0]=4 5112 B8R1.70 CC(F)(F)C1(CC1)N MCULE-9776696177 [0,1,0,1,0,0|2,0,0]=4 5113 B8R1.33 CNC(CN)C1CC1 MCULE-7436848424 [0,1,0,1,0,0|2,0,0]=4 5114 B8R1.33 CNC(CO)C1CC1 MCULE-4490559774 [0,1,0,1,0,0|1,0,0]=3 5115 B8R1.33 COC(CO)C1CC1 MCULE-9815577002 [0,1,0,1,0,0|2,0,0]=4 5116 B8R1.33 NCC(CO)C1CC1 MCULE-1877246191 [0,1,0,1,0,0|1,0,0]=3 5117 B8R1.33 NCC(CO)C1CC1 MCULE-7216825790 [0,1,0,1,0,0|1,0,0]=3 5118 B8R1.64 OCC1(CC1F)CO MCULE-3851227748 [0,1,0,1,0,0|2,0,0]=4 5119 B8R2.2 CC12CCCC1O2 MCULE-5518981528 [0,0,0,2,0,0|2,0,0]=4 5120 B8R2.2 OC12CNCC1C2 MCULE-4871733427 [0,0,0,2,0,0|2,0,0]=4 5121 B8R2.2 OC12CNCC1C2 MCULE-9523698203 [0,0,0,2,0,0|2,0,0]=4 5122 B8R2.22 C1CC2CNC2C1 MCULE-9273643237 [0,0,0,2,0,0|2,0,0]=4 5123 B8R2.22 C1C[C@H]2CN[C@H]2C1 MCULE-5749283674 [0,0,0,2,0,0|2,0,0]=4 5124 B8R2.22 C1C[C@H]2CN[C@H]2C1 MCULE-6220828228 [0,0,0,2,0,0|2,0,0]=4 5125 B8R2.38 NC1CCC2C1C2 MCULE-4902375424 [0,0,0,2,0,0|2,0,0]=4 5126 B8R2.38 NC1CCC2C1C2 MCULE-9059443543 [0,0,0,2,0,0|2,0,0]=4 5127 B8R2.38 OC1CCC2C1C2 MCULE-7193372575 [0,0,0,2,0,0|2,0,0]=4 5128 B8R2.38 O[C@@H]1CC[C@@H]2[C@H]1C2 MCULE-5135101961 [0,0,0,2,0,0|2,0,0]=4 5129 B8R2.19 NC1CCC12CC2 MCULE-1612309009 [0,0,0,2,0,0|2,0,0]=4 5130 B8R2.19 NC1CCC12CC2 MCULE-8046864170 [0,0,0,2,0,0|2,0,0]=4 5131 B8R2.19 OC1CCC12CC2 MCULE-2855833660 [0,0,0,2,0,0|2,0,0]=4 5132 B8R2.1 C1CC(C1)C2CO2 MCULE-8033150021 [0,0,0,2,0,0|2,0,0]=4 5133 B8R2.1 C1CC(N1)C2CC2 MCULE-2254709110 [0,0,0,2,0,0|2,0,0]=4 5134 B8R2.1 C1CC(N1)C2CC2 MCULE-9129591869 [0,0,0,2,0,0|2,0,0]=4 5135 B8R2.41 CC1(CO1)C2CC2 MCULE-3916895683 [0,0,0,2,0,0|2,0,0]=4 5136 B8R2.41 NC1(CC1)C2CC2 MCULE-3785357213 [0,0,0,2,0,0|2,0,0]=4 5137 B8R2.41 NC1(CC1)C2CC2 MCULE-5862851858 [0,0,0,2,0,0|2,0,0]=4 5138 B8R2.20 OCC1CC12CC2 MCULE-1486840190 [0,0,0,2,0,0|2,0,0]=4 5139 B8R0.9 CC(=O)OCC(N)CO MCULE-3133254167 [0,0,0,0,0,2|0,0,2]=4 5140 B8R0.9 CC(=O)OCC(N)CO MCULE-4867842020 [0,0,0,0,0,2|0,0,2]=4 5141 B8R0.9 CC(C)CCC(C)CO MCULE-8698383870 [0,0,0,0,0,2|2,0,0]=4 5142 B8R0.9 CC(C)CCC(N)CO MCULE-1841093348 [0,0,0,0,0,2|1,0,0]=3 5143 B8R0.9 CC(C)CCC(N)CO MCULE-6322500554 [0,0,0,0,0,2|1,0,0]=3 5144 B8R0.9 CC(C)COC(C)CO MCULE-5746553586 [0,0,0,0,0,2|2,0,0]=4 5145 B8R0.9 CC(C)NCC(O)CO MCULE-6111772035 [0,0,0,0,0,2|2,0,0]=4 5146 B8R0.9 CC(C)NC[C@@H](O)CO MCULE-2239468159 [0,0,0,0,0,2|2,0,0]=4 5147 B8R0.9 CC(C)NC[C@@H](O)CO MCULE-7993975282 [0,0,0,0,0,2|2,0,0]=4 5148 B8R0.9 CC(C)NC[C@H](O)CO MCULE-3918662429 [0,0,0,0,0,2|2,0,0]=4 5149 B8R0.9 CC(C)NC[C@H](O)CO MCULE-5916462695 [0,0,0,0,0,2|2,0,0]=4 5150 B8R0.9 CC(O)CNC(C)CO MCULE-6157391749 [0,0,0,0,0,2|1,0,0]=3 5151 B8R0.9 CC(O)COC(C)CO MCULE-7544702364 [0,0,0,0,0,2|1,0,0]=3 5152 B8R0.9 CCC(C)CCC(C)O MCULE-4781356880 [0,0,0,0,0,2|2,0,0]=4 5153 B8R0.9 N[C@H](CO)CCC(=O)O MCULE-1233079264 [0,0,0,0,0,2|1,0,1]=4 5154 B8R0.9 N[C@H](CO)CCC(=O)O MCULE-8091475267 [0,0,0,0,0,2|1,0,1]=4