0 B7R0.18 C=CC(C)(CC)CO MCULE-3218490864 [0,0,0,0,0,0|3,0,1]=4 1 B7R0.18 CC(C=O)(CO)CO MCULE-2216366062 [0,0,0,0,0,0|1,0,2]=3 2 B7R0.18 CC(CCl)(CCl)CCl MCULE-8159971325 [0,0,0,0,0,0|4,0,0]=4 3 B7R0.18 CC(CN)(CN)CN MCULE-7950321638 [0,0,0,0,0,0|4,0,0]=4 4 B7R0.18 CC(CN)(CO)CO MCULE-8513833512 [0,0,0,0,0,0|2,0,0]=2 5 B7R0.18 CC(CO)(CO)CBr MCULE-5696396166 [0,0,0,0,0,0|2,0,0]=2 6 B7R0.18 CC(CO)(CO)CO MCULE-1228441837 [0,0,0,0,0,0|1,0,0]=1 7 B7R0.18 CCC(C)(CC)CC MCULE-8385527448 [0,0,0,0,0,0|4,0,0]=4 8 B7R0.18 CCC(C)(CC)CN MCULE-8216748689 [0,0,0,0,0,0|4,0,0]=4 9 B7R0.18 CCC(C)(CC)CN MCULE-8692148167 [0,0,0,0,0,0|4,0,0]=4 10 B7R0.18 CCC(C)(CN)CO MCULE-2703250369 [0,0,0,0,0,0|3,0,0]=3 11 B7R0.18 CCC(C)(CO)CO MCULE-6918244309 [0,0,0,0,0,0|2,0,0]=2 12 B7R0.18 CCC(C)(CO)OC MCULE-2048434225 [0,0,0,0,0,0|4,0,0]=4 13 B7R0.18 CCC(N)(CC)CO MCULE-7822189565 [0,0,0,0,0,0|4,0,0]=4 14 B7R0.18 CCC(N)(CO)CO MCULE-6627376273 [0,0,0,0,0,0|3,0,0]=3 15 B7R0.18 CCC(O)(CC)CO MCULE-5622837545 [0,0,0,0,0,0|4,0,0]=4 16 B7R0.18 CC[N+](C)(CC)CC MCULE-2512202419 [0,0,0,0,0,0|3,0,0]=3 17 B7R0.18 CC[N+](C)(CC)CC MCULE-5281245213 [0,0,0,0,0,0|3,0,0]=3 18 B7R0.18 CC[N+](C)(CC)CC MCULE-7528774114 [0,0,0,0,0,0|3,0,0]=3 19 B7R0.18 CC[N+](C)(CC)CC MCULE-8262867632 [0,0,0,0,0,0|3,0,0]=3 20 B7R0.18 CC[N+](C)(CC)CC MCULE-9192965151 [0,0,0,0,0,0|3,0,0]=3 21 B7R0.18 CC[N+]([O-])(CC)CC MCULE-7507190077 [0,0,0,0,0,0|4,0,0]=4 22 B7R0.18 COC(C)(CN)CO MCULE-1091911796 [0,0,0,0,0,0|4,0,0]=4 23 B7R0.18 COC(N)(CO)CO MCULE-3562349590 [0,0,0,0,0,0|4,0,0]=4 24 B7R0.18 COC(N)(CO)CO MCULE-5361347592 [0,0,0,0,0,0|4,0,0]=4 25 B7R0.18 NC(CO)(CO)CO MCULE-1491189847 [0,0,0,0,0,0|2,0,0]=2 26 B7R0.18 NC(CO)(CO)CO MCULE-2267999286 [0,0,0,0,0,0|2,0,0]=2 27 B7R0.18 NC(CO)(CO)CO MCULE-4100030243 [0,0,0,0,0,0|2,0,0]=2 28 B7R0.18 NC(CO)(CO)CO MCULE-4852633554 [0,0,0,0,0,0|2,0,0]=2 29 B7R0.18 NC(CO)(CO)CO MCULE-6369744326 [0,0,0,0,0,0|2,0,0]=2 30 B7R0.18 NC(CO)(CO)CO MCULE-7300085951 [0,0,0,0,0,0|2,0,0]=2 31 B7R0.18 NC(CO)(CO)CO MCULE-8252586319 [0,0,0,0,0,0|2,0,0]=2 32 B7R0.18 NC(CO)(CO)CO MCULE-8592789920 [0,0,0,0,0,0|2,0,0]=2 33 B7R0.18 NC(CO)(CO)CO MCULE-9200014500 [0,0,0,0,0,0|2,0,0]=2 34 B7R0.18 [NH3+]C(CO)(CO)CO MCULE-6464912245 [0,0,0,0,0,0|2,0,0]=2 35 B6R0.8 C#CC(C)(C)CO MCULE-2912434983 [1,0,0,0,0,0|2,0,1]=4 36 B6R0.8 C=CC(C)(C)CO MCULE-8447675743 [1,0,0,0,0,0|2,0,1]=4 37 B6R0.8 CC(C)(C#N)CO MCULE-3713618417 [1,0,0,0,0,0|2,0,1]=4 38 B6R0.8 CC(C)(C=O)CO MCULE-9744921245 [1,0,0,0,0,0|1,0,2]=4 39 B6R0.8 CC(C)(CBr)CBr MCULE-3867295521 [1,0,0,0,0,0|3,0,0]=4 40 B6R0.8 CC(C)(CCl)CCl MCULE-4414378658 [1,0,0,0,0,0|3,0,0]=4 41 B6R0.8 CC(C)(CN)CF MCULE-4530368386 [1,0,0,0,0,0|3,0,0]=4 42 B6R0.8 CC(C)(CN)CF MCULE-7783060235 [1,0,0,0,0,0|3,0,0]=4 43 B6R0.8 CC(C)(CN)CN MCULE-6969888863 [1,0,0,0,0,0|3,0,0]=4 44 B6R0.8 CC(C)(CN)CO MCULE-5342400231 [1,0,0,0,0,0|2,0,0]=3 45 B6R0.8 CC(C)(CO)CBr MCULE-5392401561 [1,0,0,0,0,0|2,0,0]=3 46 B6R0.8 CC(C)(CO)CCl MCULE-4674403441 [1,0,0,0,0,0|2,0,0]=3 47 B6R0.8 CC(C)(CO)CF MCULE-4462488929 [1,0,0,0,0,0|2,0,0]=3 48 B6R0.8 CC(C)(CO)CO MCULE-3663555151 [1,0,0,0,0,0|1,0,0]=2 49 B6R0.8 CC(C)(CO)CS MCULE-2478254611 [1,0,0,0,0,0|1,1,0]=3 50 B6R0.8 CC(C)(CO)ON MCULE-7229580612 [1,0,0,0,0,0|3,0,0]=4 51 B6R0.8 CC(C)(CO)ON MCULE-9993526575 [1,0,0,0,0,0|3,0,0]=4 52 B6R0.8 CC(F)(CO)CO MCULE-6086305692 [1,0,0,0,0,0|2,0,0]=3 53 B6R0.8 CC(N)(CO)CO MCULE-6546409175 [1,0,0,0,0,0|2,0,0]=3 54 B6R0.8 CC(O)(CN)CO MCULE-2184919268 [1,0,0,0,0,0|2,0,0]=3 55 B6R0.8 CC(O)(CO)CO MCULE-5281000424 [1,0,0,0,0,0|1,0,0]=2 56 B6R0.8 CCC(C)(C)CC MCULE-7259470376 [1,0,0,0,0,0|3,0,0]=4 57 B6R0.8 CCC(C)(C)CN MCULE-2321746087 [1,0,0,0,0,0|3,0,0]=4 58 B6R0.8 CCC(C)(C)CN MCULE-9058132626 [1,0,0,0,0,0|3,0,0]=4 59 B6R0.8 CCC(C)(C)CO MCULE-9731698451 [1,0,0,0,0,0|2,0,0]=3 60 B6R0.8 CCC(C)(N)CO MCULE-3364837123 [1,0,0,0,0,0|3,0,0]=4 61 B6R0.8 CCC(C)(N)CO MCULE-6671299764 [1,0,0,0,0,0|3,0,0]=4 62 B6R0.8 CCC(C)(O)CC MCULE-2300322554 [1,0,0,0,0,0|3,0,0]=4 63 B6R0.8 CCC(C)(O)CN MCULE-2912898926 [1,0,0,0,0,0|3,0,0]=4 64 B6R0.8 CCC(C)(O)CO MCULE-7272709587 [1,0,0,0,0,0|2,0,0]=3 65 B6R0.8 CC[Si](C)(C)CCl MCULE-8740397646 [1,0,0,0,0,0|3,0,0]=4 66 B6R0.8 CNC(C)(C)CO MCULE-6733742999 [1,0,0,0,0,0|3,0,0]=4 67 B6R0.8 CNC(C)(C)CO MCULE-8497514322 [1,0,0,0,0,0|3,0,0]=4 68 B6R0.8 COC(C)(C)CO MCULE-2208581417 [1,0,0,0,0,0|3,0,0]=4 69 B6R0.8 CSC(C)(C)CO MCULE-7955741611 [1,0,0,0,0,0|3,0,0]=4 70 B6R0.8 C[C@](O)(CO)CBr MCULE-3211170790 [1,0,0,0,0,0|2,0,0]=3 71 B6R0.8 C[Si](C)(CCl)CCl MCULE-5945397603 [1,0,0,0,0,0|3,0,0]=4 72 B6R0.8 C[Si](C)(CN)CCl MCULE-1461076093 [1,0,0,0,0,0|3,0,0]=4 73 B6R0.8 C[Si](C)(CN)CCl MCULE-2254305941 [1,0,0,0,0,0|3,0,0]=4 74 B6R0.8 OCC(F)(F)CO MCULE-8504062479 [1,0,0,0,0,0|3,0,0]=4 75 B6R0.9 CCC(CC)CO MCULE-8799293985 [1,0,0,0,0,0|3,0,0]=4 76 B6R0.9 CCC(CN)CO MCULE-5933181303 [1,0,0,0,0,0|3,0,0]=4 77 B6R0.9 CCC(CO)CO MCULE-5204077076 [1,0,0,0,0,0|2,0,0]=3 78 B6R0.9 CCN(CC)CO MCULE-9782453115 [1,0,0,0,0,0|2,0,1]=4 79 B6R0.9 CC[NH+](CC)CC MCULE-2368942907 [1,0,0,0,0,0|3,0,0]=4 80 B6R0.9 CNC(CO)CO MCULE-9323859576 [1,0,0,0,0,0|3,0,0]=4 81 B6R0.9 COC(CO)CO MCULE-4778743592 [1,0,0,0,0,0|3,0,0]=4 82 B6R0.9 OCC(=NO)CO MCULE-1131100831 [1,0,0,0,0,0|2,0,0]=3 83 B6R0.9 OCC(CBr)CBr MCULE-4153091765 [1,0,0,0,0,0|3,0,0]=4 84 B6R0.9 OCC(CO)CO MCULE-7640074192 [1,0,0,0,0,0|1,0,0]=2 85 B6R0.9 OCP(CO)CO MCULE-9792692156 [1,0,0,0,0,0|0,1,0]=2 86 B8R0.10 CCC(CC)(CC)CO MCULE-9495100996 [0,1,0,0,0,0|3,0,0]=4 87 B8R0.10 CCC(CC)(CN)CO MCULE-1639193647 [0,1,0,0,0,0|3,0,0]=4 88 B8R0.10 CCC(CC)(CO)CO MCULE-5040606043 [0,1,0,0,0,0|2,0,0]=3 89 B8R0.10 CCC(CC)(CO)SC MCULE-7532568125 [0,1,0,0,0,0|3,0,0]=4 90 B8R0.10 CCC(CO)(CO)CO MCULE-6600552830 [0,1,0,0,0,0|1,0,0]=2 91 B8R0.10 CC[N+](CC)(CC)CC MCULE-1427226171 [0,1,0,0,0,0|3,0,0]=4 92 B8R0.10 CC[N+](CC)(CC)CC MCULE-2213782763 [0,1,0,0,0,0|3,0,0]=4 93 B8R0.10 CC[N+](CC)(CC)CC MCULE-2396931428 [0,1,0,0,0,0|3,0,0]=4 94 B8R0.10 CC[N+](CC)(CC)CC MCULE-2632908831 [0,1,0,0,0,0|3,0,0]=4 95 B8R0.10 CC[N+](CC)(CC)CC MCULE-2652114073 [0,1,0,0,0,0|3,0,0]=4 96 B8R0.10 CC[N+](CC)(CC)CC MCULE-3266791400 [0,1,0,0,0,0|3,0,0]=4 97 B8R0.10 CC[N+](CC)(CC)CC MCULE-4143993164 [0,1,0,0,0,0|3,0,0]=4 98 B8R0.10 CC[N+](CC)(CC)CC MCULE-5083209823 [0,1,0,0,0,0|3,0,0]=4 99 B8R0.10 CC[N+](CC)(CC)CC MCULE-5895799157 [0,1,0,0,0,0|3,0,0]=4 100 B8R0.10 CC[N+](CC)(CC)CC MCULE-6358446622 [0,1,0,0,0,0|3,0,0]=4 101 B8R0.10 CC[N+](CC)(CC)CC MCULE-6393417828 [0,1,0,0,0,0|3,0,0]=4 102 B8R0.10 CC[N+](CC)(CC)CC MCULE-7118179492 [0,1,0,0,0,0|3,0,0]=4 103 B8R0.10 CC[N+](CC)(CC)CC MCULE-7414553192 [0,1,0,0,0,0|3,0,0]=4 104 B8R0.10 CC[N+](CC)(CC)CC MCULE-7595594581 [0,1,0,0,0,0|3,0,0]=4 105 B8R0.10 CC[N+](CC)(CC)CC MCULE-8726922810 [0,1,0,0,0,0|3,0,0]=4 106 B8R0.10 CC[N+](CC)(CC)CC MCULE-8812335475 [0,1,0,0,0,0|3,0,0]=4 107 B8R0.10 CC[N+](CC)(CC)CC MCULE-9041020911 [0,1,0,0,0,0|3,0,0]=4 108 B8R0.10 CC[N+](CC)(CC)CC MCULE-9707448817 [0,1,0,0,0,0|3,0,0]=4 109 B8R0.10 CC[N+](CC)(CC)CC MCULE-9844873063 [0,1,0,0,0,0|3,0,0]=4 110 B8R0.10 COC(CO)(CO)OC MCULE-8658720521 [0,1,0,0,0,0|3,0,0]=4 111 B8R0.10 NCC(CN)(CO)CO MCULE-2545034466 [0,1,0,0,0,0|2,0,0]=3 112 B8R0.10 NCC(CN)(CO)CO MCULE-8762629992 [0,1,0,0,0,0|2,0,0]=3 113 B8R0.10 OCC(CBr)(CBr)CBr MCULE-6076771996 [0,1,0,0,0,0|3,0,0]=4 114 B8R0.10 OCC(CCl)(CCl)CCl MCULE-4275446964 [0,1,0,0,0,0|3,0,0]=4 115 B8R0.10 OCC(CO)(CBr)CBr MCULE-8124901418 [0,1,0,0,0,0|2,0,0]=3 116 B8R0.10 OCC(CO)(CCl)CCl MCULE-6375142256 [0,1,0,0,0,0|2,0,0]=3 117 B8R0.10 OCC(CO)(CO)CBr MCULE-4643535263 [0,1,0,0,0,0|1,0,0]=2 118 B8R0.10 OCC(CO)(CO)CO MCULE-7635228253 [0,1,0,0,0,0|1,0,0]=2 119 B8R0.10 OC[P+](CO)(CO)CO MCULE-2717917732 [0,1,0,0,0,0|0,1,0]=2 120 B8R0.10 OC[P+](CO)(CO)CO MCULE-4479763587 [0,1,0,0,0,0|0,1,0]=2 121 B8R0.10 OC[P+](CO)(CO)CO MCULE-5923906465 [0,1,0,0,0,0|0,1,0]=2 122 B8R0.10 OC[P+](CO)(CO)CO MCULE-6133870520 [0,1,0,0,0,0|0,1,0]=2 123 B8R0.31 CC(CN)(CO)CCO MCULE-4538062764 [0,1,0,0,0,0|2,0,0]=3 124 B8R0.31 CCCC(C)(CO)CO MCULE-8778153565 [0,1,0,0,0,0|2,0,0]=3 125 B8R0.31 CNC(C)(CO)COC MCULE-6268672798 [0,1,0,0,0,0|3,0,0]=4 126 B8R0.31 CNCC(C)(CO)CO MCULE-7241708238 [0,1,0,0,0,0|2,0,0]=3 127 B8R0.31 COCC(C)(CO)CO MCULE-6360474797 [0,1,0,0,0,0|1,0,0]=2 128 B8R0.36 CC(CO)(CO)C(=O)O MCULE-5702110239 [0,1,0,0,0,0|1,0,1]=3 129 B8R0.36 CC(CO)(CO)N(=O)=O MCULE-2578291849 [0,1,0,0,0,0|2,0,1]=4 130 B8R0.36 CCC(C)(CN)C(C)O MCULE-6950019734 [0,1,0,0,0,0|3,0,0]=4 131 B8R0.36 CCC(C)(CO)C(=O)O MCULE-7481967307 [0,1,0,0,0,0|2,0,1]=4 132 B8R1.52 CC1(CCCC1)CO MCULE-5781311918 [0,0,0,1,0,0|3,0,0]=4 133 B8R1.52 CC1(CCNC1)CO MCULE-4860869358 [0,0,0,1,0,0|3,0,0]=4 134 B8R1.52 CC1(CCNC1)CO MCULE-5952337109 [0,0,0,1,0,0|3,0,0]=4 135 B8R1.52 CC1(CCNC1)CO MCULE-8822036636 [0,0,0,1,0,0|3,0,0]=4 136 B8R1.52 CC1(CCOC1)CBr MCULE-6515619846 [0,0,0,1,0,0|3,0,0]=4 137 B8R1.52 CC1(CCOC1)CN MCULE-4260151246 [0,0,0,1,0,0|3,0,0]=4 138 B8R1.52 CC1(CCOC1)CO MCULE-7949441451 [0,0,0,1,0,0|2,0,0]=3 139 B8R1.52 CC[N+]1(CCCC1)C MCULE-1996992656 [0,0,0,1,0,0|3,0,0]=4 140 B8R1.52 CC[N+]1(CCCC1)C MCULE-5468205365 [0,0,0,1,0,0|3,0,0]=4 141 B8R1.52 CC[N+]1(CCCC1)C MCULE-6004225859 [0,0,0,1,0,0|3,0,0]=4 142 B8R1.52 C[C@@]1(CCNC1)CO MCULE-4028027381 [0,0,0,1,0,0|3,0,0]=4 143 B8R1.52 C[C@@]1(CCNC1)CO MCULE-5703640559 [0,0,0,1,0,0|3,0,0]=4 144 B8R1.52 C[C@@]1(CCOC1)CN MCULE-6847854708 [0,0,0,1,0,0|3,0,0]=4 145 B8R1.52 C[C@@]1(CCOC1)CO MCULE-7732534995 [0,0,0,1,0,0|2,0,0]=3 146 B8R1.52 C[C@]1(CCNC1)CO MCULE-3181896367 [0,0,0,1,0,0|3,0,0]=4 147 B8R1.52 C[C@]1(CCNC1)CO MCULE-5981712550 [0,0,0,1,0,0|3,0,0]=4 148 B8R1.52 C[C@]1(CCOC1)CO MCULE-3142340099 [0,0,0,1,0,0|2,0,0]=3 149 B8R1.52 NC1(CCOC1)CO MCULE-9666933944 [0,0,0,1,0,0|3,0,0]=4 150 B8R1.52 N[C@]1(CCOC1)CO MCULE-4577771704 [0,0,0,1,0,0|3,0,0]=4 151 B8R1.52 OCC1(CCOC1)O MCULE-3033948661 [0,0,0,1,0,0|3,0,0]=4 152 B8R1.60 BrCC1(COC1)CBr MCULE-4860924419 [0,0,0,1,0,0|3,0,0]=4 153 B8R1.60 CCC1(CCC1)CO MCULE-8935555636 [0,0,0,1,0,0|3,0,0]=4 154 B8R1.60 CCC1(CNC1)CO MCULE-9540597124 [0,0,0,1,0,0|3,0,0]=4 155 B8R1.60 CCC1(CNC1)CO MCULE-9559629754 [0,0,0,1,0,0|3,0,0]=4 156 B8R1.60 CCC1(COC1)CN MCULE-3839708172 [0,0,0,1,0,0|3,0,0]=4 157 B8R1.60 CCC1(COC1)CO MCULE-2897589234 [0,0,0,1,0,0|2,0,0]=3 158 B8R1.60 CNC1(COC1)CO MCULE-8641401682 [0,0,0,1,0,0|3,0,0]=4 159 B8R1.60 COC1(COC1)CO MCULE-6211074024 [0,0,0,1,0,0|3,0,0]=4 160 B8R1.60 ClCC1(COC1)CBr MCULE-9413512791 [0,0,0,1,0,0|3,0,0]=4 161 B8R1.60 ClCC1(COC1)CCl MCULE-7409787863 [0,0,0,1,0,0|3,0,0]=4 162 B8R1.60 ClCC1(COC1)CI MCULE-8535806215 [0,0,0,1,0,0|3,0,0]=4 163 B8R1.60 FCC1(COC1)CBr MCULE-8987480717 [0,0,0,1,0,0|3,0,0]=4 164 B8R1.60 FCC1(COC1)CF MCULE-1500682746 [0,0,0,1,0,0|3,0,0]=4 165 B8R1.60 ICC1(COC1)CI MCULE-7784735292 [0,0,0,1,0,0|3,0,0]=4 166 B8R1.60 N#CC1(COC1)CO MCULE-2271504822 [0,0,0,1,0,0|2,0,1]=4 167 B8R1.60 NCC1(CCC1)CO MCULE-1172328932 [0,0,0,1,0,0|3,0,0]=4 168 B8R1.60 NCC1(COC1)CN MCULE-1064736831 [0,0,0,1,0,0|3,0,0]=4 169 B8R1.60 NCC1(COC1)CN MCULE-6465943815 [0,0,0,1,0,0|3,0,0]=4 170 B8R1.60 NCC1(COC1)CN MCULE-7809081629 [0,0,0,1,0,0|3,0,0]=4 171 B8R1.60 NCC1(COC1)CO MCULE-1783285626 [0,0,0,1,0,0|2,0,0]=3 172 B8R1.60 NCC1(COC1)CO MCULE-3048601000 [0,0,0,1,0,0|2,0,0]=3 173 B8R1.60 NCC1(COC1)CO MCULE-3898272893 [0,0,0,1,0,0|2,0,0]=3 174 B8R1.60 NCC1(COC1)CO MCULE-4439878564 [0,0,0,1,0,0|2,0,0]=3 175 B8R1.60 OCC1(CCC1)CO MCULE-9363912183 [0,0,0,1,0,0|2,0,0]=3 176 B8R1.60 OCC1(CNC1)CO MCULE-5014363995 [0,0,0,1,0,0|2,0,0]=3 177 B8R1.60 OCC1(CNC1)CO MCULE-6901944160 [0,0,0,1,0,0|2,0,0]=3 178 B8R1.60 OCC1(COC1)CBr MCULE-3087523910 [0,0,0,1,0,0|2,0,0]=3 179 B8R1.60 OCC1(COC1)CCl MCULE-9506954362 [0,0,0,1,0,0|2,0,0]=3 180 B8R1.60 OCC1(COC1)CF MCULE-6736999824 [0,0,0,1,0,0|2,0,0]=3 181 B8R1.60 OCC1(COC1)CO MCULE-8593151308 [0,0,0,1,0,0|1,0,0]=2 182 B8R1.64 OCC1(CC1F)CO MCULE-3851227748 [0,0,0,1,0,0|2,0,0]=3 183 B5R0.3 C=C(CO)CO MCULE-2682601949 [2,0,0,0,0,0|1,0,1]=4 184 B5R0.3 CC(CN)CO MCULE-5880795484 [2,0,0,0,0,0|2,0,0]=4 185 B5R0.3 CC(CN)CO MCULE-8083007887 [2,0,0,0,0,0|2,0,0]=4 186 B5R0.3 CC(CO)CBr MCULE-3815333295 [2,0,0,0,0,0|2,0,0]=4 187 B5R0.3 CC(CO)CBr MCULE-5695891877 [2,0,0,0,0,0|2,0,0]=4 188 B5R0.3 CC(CO)CO MCULE-2340730326 [2,0,0,0,0,0|1,0,0]=3 189 B5R0.3 CC(CO)CS MCULE-1990992504 [2,0,0,0,0,0|1,1,0]=4 190 B5R0.3 CCC(C)CO MCULE-6521026296 [2,0,0,0,0,0|2,0,0]=4 191 B5R0.3 CCC(O)CO MCULE-2488753438 [2,0,0,0,0,0|2,0,0]=4 192 B5R0.3 CCC(O)CO MCULE-7297282094 [2,0,0,0,0,0|2,0,0]=4 193 B5R0.3 CC[C@@H](C)CO MCULE-6700783698 [2,0,0,0,0,0|2,0,0]=4 194 B5R0.3 CC[C@@H](C)CO MCULE-8175790803 [2,0,0,0,0,0|2,0,0]=4 195 B5R0.3 CC[C@@H](O)CO MCULE-3948477298 [2,0,0,0,0,0|2,0,0]=4 196 B5R0.3 CC[C@@H](O)CO MCULE-5098109795 [2,0,0,0,0,0|2,0,0]=4 197 B5R0.3 CC[C@H](C)CO MCULE-1493424061 [2,0,0,0,0,0|2,0,0]=4 198 B5R0.3 CC[C@H](C)CO MCULE-6879443668 [2,0,0,0,0,0|2,0,0]=4 199 B5R0.3 CC[C@H](O)CO MCULE-2194264642 [2,0,0,0,0,0|2,0,0]=4 200 B5R0.3 CC[C@H](O)CO MCULE-5503575962 [2,0,0,0,0,0|2,0,0]=4 201 B5R0.3 C[C@@H](CN)CO MCULE-4662215148 [2,0,0,0,0,0|2,0,0]=4 202 B5R0.3 C[C@@H](CN)CO MCULE-7870198689 [2,0,0,0,0,0|2,0,0]=4 203 B5R0.3 C[C@@H](CO)CBr MCULE-3691541800 [2,0,0,0,0,0|2,0,0]=4 204 B5R0.3 C[C@@H](CO)CBr MCULE-4447849056 [2,0,0,0,0,0|2,0,0]=4 205 B5R0.3 C[C@H](CO)CBr MCULE-4031825779 [2,0,0,0,0,0|2,0,0]=4 206 B5R0.3 C[C@H](CO)CBr MCULE-6846167456 [2,0,0,0,0,0|2,0,0]=4 207 B5R0.3 NC(CO)CO MCULE-1559988016 [2,0,0,0,0,0|2,0,0]=4 208 B5R0.3 NC(CO)CO MCULE-4954119952 [2,0,0,0,0,0|2,0,0]=4 209 B5R0.3 NCC(O)CO MCULE-2689763818 [2,0,0,0,0,0|2,0,0]=4 210 B5R0.3 NCC(O)CO MCULE-6096620010 [2,0,0,0,0,0|2,0,0]=4 211 B5R0.3 NCC(O)CO MCULE-7307777212 [2,0,0,0,0,0|2,0,0]=4 212 B5R0.3 NC[C@@H](O)CO MCULE-7897503444 [2,0,0,0,0,0|2,0,0]=4 213 B5R0.3 NC[C@@H](O)CO MCULE-8044821624 [2,0,0,0,0,0|2,0,0]=4 214 B5R0.3 NC[C@@H](O)CO MCULE-9443333756 [2,0,0,0,0,0|2,0,0]=4 215 B5R0.3 NC[C@H](O)CO MCULE-5835551322 [2,0,0,0,0,0|2,0,0]=4 216 B5R0.3 NC[C@H](O)CO MCULE-6021133883 [2,0,0,0,0,0|2,0,0]=4 217 B5R0.3 NC[C@H](O)CO MCULE-7461568841 [2,0,0,0,0,0|2,0,0]=4 218 B5R0.3 NC[C@H](O)CO MCULE-8112454132 [2,0,0,0,0,0|2,0,0]=4 219 B5R0.3 O=C(CO)CO MCULE-7188810449 [2,0,0,0,0,0|1,0,1]=4 220 B5R0.3 OCC(Br)CO MCULE-9272628834 [2,0,0,0,0,0|2,0,0]=4 221 B5R0.3 OCC(Cl)CO MCULE-7487945326 [2,0,0,0,0,0|2,0,0]=4 222 B5R0.3 OCC(F)CO MCULE-2970537690 [2,0,0,0,0,0|2,0,0]=4 223 B5R0.3 OCC(O)CBr MCULE-9116190245 [2,0,0,0,0,0|2,0,0]=4 224 B5R0.3 OCC(O)CCl MCULE-7895191088 [2,0,0,0,0,0|2,0,0]=4 225 B5R0.3 OCC(O)CCl MCULE-8992242488 [2,0,0,0,0,0|2,0,0]=4 226 B5R0.3 OCC(O)CF MCULE-3575952891 [2,0,0,0,0,0|2,0,0]=4 227 B5R0.3 OCC(O)CF MCULE-8981430411 [2,0,0,0,0,0|2,0,0]=4 228 B5R0.3 OCC(O)CI MCULE-6705992930 [2,0,0,0,0,0|2,0,0]=4 229 B5R0.3 OCC(O)CO MCULE-6349111826 [2,0,0,0,0,0|1,0,0]=3 230 B5R0.3 OCC(O)CS MCULE-6300188207 [2,0,0,0,0,0|1,1,0]=4 231 B5R0.3 OC[C@@H](O)CCl MCULE-1311776512 [2,0,0,0,0,0|2,0,0]=4 232 B5R0.3 OC[C@@H](O)CCl MCULE-2685107404 [2,0,0,0,0,0|2,0,0]=4 233 B5R0.3 OC[C@@H](O)CF MCULE-3274443966 [2,0,0,0,0,0|2,0,0]=4 234 B5R0.3 OC[C@@H](O)CF MCULE-5908395855 [2,0,0,0,0,0|2,0,0]=4 235 B5R0.3 OC[C@H](O)CBr MCULE-5035020863 [2,0,0,0,0,0|2,0,0]=4 236 B5R0.3 OC[C@H](O)CCl MCULE-2098232262 [2,0,0,0,0,0|2,0,0]=4 237 B5R0.3 OC[C@H](O)CCl MCULE-5801605349 [2,0,0,0,0,0|2,0,0]=4 238 B5R0.3 OC[C@H](O)CF MCULE-3309672397 [2,0,0,0,0,0|2,0,0]=4 239 B5R0.3 OC[C@H](O)CF MCULE-7695783253 [2,0,0,0,0,0|2,0,0]=4 240 B5R0.4 C=C[N+](C)(C)C MCULE-1874033627 [2,0,0,0,0,0|1,0,1]=4 241 B5R0.4 C=C[N+](C)(C)C MCULE-3871229486 [2,0,0,0,0,0|1,0,1]=4 242 B5R0.4 CC(C)(Br)CO MCULE-5949221311 [2,0,0,0,0,0|2,0,0]=4 243 B5R0.4 CC(C)(C)CBr MCULE-7545541733 [2,0,0,0,0,0|2,0,0]=4 244 B5R0.4 CC(C)(C)CCl MCULE-1595599055 [2,0,0,0,0,0|2,0,0]=4 245 B5R0.4 CC(C)(C)CI MCULE-6879787789 [2,0,0,0,0,0|2,0,0]=4 246 B5R0.4 CC(C)(C)CN MCULE-1062894260 [2,0,0,0,0,0|2,0,0]=4 247 B5R0.4 CC(C)(C)CN MCULE-2736289460 [2,0,0,0,0,0|2,0,0]=4 248 B5R0.4 CC(C)(C)CN MCULE-5919012916 [2,0,0,0,0,0|2,0,0]=4 249 B5R0.4 CC(C)(C)CN MCULE-6772338754 [2,0,0,0,0,0|2,0,0]=4 250 B5R0.4 CC(C)(C)CN MCULE-8882959753 [2,0,0,0,0,0|2,0,0]=4 251 B5R0.4 CC(C)(C)CO MCULE-4399535684 [2,0,0,0,0,0|1,0,0]=3 252 B5R0.4 CC(C)(C)CS MCULE-7279455818 [2,0,0,0,0,0|1,1,0]=4 253 B5R0.4 CC(C)(C)NO MCULE-4676405280 [2,0,0,0,0,0|2,0,0]=4 254 B5R0.4 CC(C)(C)NO MCULE-6482556352 [2,0,0,0,0,0|2,0,0]=4 255 B5R0.4 CC(C)(C)NO MCULE-7368313644 [2,0,0,0,0,0|2,0,0]=4 256 B5R0.4 CC(C)(C)OO MCULE-2835127745 [2,0,0,0,0,0|2,0,0]=4 257 B5R0.4 CC(C)(F)CO MCULE-1700621997 [2,0,0,0,0,0|2,0,0]=4 258 B5R0.4 CC(C)(N)CO MCULE-4072416202 [2,0,0,0,0,0|2,0,0]=4 259 B5R0.4 CC(C)(N)CO MCULE-4209651459 [2,0,0,0,0,0|2,0,0]=4 260 B5R0.4 CC(C)(N)CO MCULE-6047079177 [2,0,0,0,0,0|2,0,0]=4 261 B5R0.4 CC(C)(O)CBr MCULE-6366129174 [2,0,0,0,0,0|2,0,0]=4 262 B5R0.4 CC(C)(O)CCl MCULE-3118028441 [2,0,0,0,0,0|2,0,0]=4 263 B5R0.4 CC(C)(O)CF MCULE-6616447132 [2,0,0,0,0,0|2,0,0]=4 264 B5R0.4 CC(C)(O)CI MCULE-5132198363 [2,0,0,0,0,0|2,0,0]=4 265 B5R0.4 CC(C)(O)CN MCULE-5270413077 [2,0,0,0,0,0|2,0,0]=4 266 B5R0.4 CC(C)(O)CN MCULE-7438555366 [2,0,0,0,0,0|2,0,0]=4 267 B5R0.4 CC(C)(O)CO MCULE-6797456030 [2,0,0,0,0,0|1,0,0]=3 268 B5R0.4 CC(C)(O)CS MCULE-2370088388 [2,0,0,0,0,0|1,1,0]=4 269 B5R0.4 CC(C)(S)CO MCULE-6119329508 [2,0,0,0,0,0|1,1,0]=4 270 B5R0.4 CCC(C)(C)C MCULE-3388707671 [2,0,0,0,0,0|2,0,0]=4 271 B5R0.4 CCC(C)(C)O MCULE-7894262803 [2,0,0,0,0,0|2,0,0]=4 272 B5R0.4 CC[N+](C)(C)C MCULE-6470651588 [2,0,0,0,0,0|1,0,0]=3 273 B5R0.4 CC[N+](C)(C)C MCULE-9796203912 [2,0,0,0,0,0|1,0,0]=3 274 B5R0.4 CC[Si](C)(C)C MCULE-3153744967 [2,0,0,0,0,0|2,0,0]=4 275 B5R0.4 C[N+](C)(C)CI MCULE-7732841606 [2,0,0,0,0,0|1,0,0]=3 276 B5R0.4 C[N+](C)(C)CI MCULE-9989677070 [2,0,0,0,0,0|1,0,0]=3 277 B5R0.4 C[Si](C)(C)CBr MCULE-6919339761 [2,0,0,0,0,0|2,0,0]=4 278 B5R0.4 C[Si](C)(C)CCl MCULE-5533913994 [2,0,0,0,0,0|2,0,0]=4 279 B5R0.4 C[Si](C)(C)CI MCULE-6651926938 [2,0,0,0,0,0|2,0,0]=4 280 B5R0.4 C[Si](C)(C)CN MCULE-1731145216 [2,0,0,0,0,0|2,0,0]=4 281 B5R0.4 C[Si](C)(C)CO MCULE-7434746060 [2,0,0,0,0,0|1,0,0]=3 282 B5R0.4 O=P(O)(O)CO MCULE-9997097349 [2,0,0,0,0,0|1,1,0]=4 283 B5R0.4 [Li]C[Si](C)(C)C MCULE-2829151657 [2,0,0,0,0,0|2,0,0]=4 284 B7R0.11 C#CCC(C)(C)CO MCULE-6291879237 [1,1,0,0,0,0|2,0,0]=4 285 B7R0.11 C=CCC(C)(C)CO MCULE-7471335170 [1,1,0,0,0,0|2,0,0]=4 286 B7R0.11 CC(C)(CN)CCO MCULE-8453542373 [1,1,0,0,0,0|2,0,0]=4 287 B7R0.11 CC(C)(CO)CC#N MCULE-2362583171 [1,1,0,0,0,0|2,0,0]=4 288 B7R0.11 CC(C)(CO)CCN MCULE-5221703852 [1,1,0,0,0,0|2,0,0]=4 289 B7R0.11 CC(C)(CO)CCN MCULE-7380535368 [1,1,0,0,0,0|2,0,0]=4 290 B7R0.11 CC(C)(CO)CCO MCULE-1756560398 [1,1,0,0,0,0|1,0,0]=3 291 B7R0.11 CC(C)(CO)CNN MCULE-2193719969 [1,1,0,0,0,0|2,0,0]=4 292 B7R0.11 CC(C)(CO)CNN MCULE-7849188244 [1,1,0,0,0,0|2,0,0]=4 293 B7R0.11 CC(O)(CO)CCO MCULE-4148316300 [1,1,0,0,0,0|1,0,0]=3 294 B7R0.11 CCC(C)(C)CCO MCULE-5248034600 [1,1,0,0,0,0|2,0,0]=4 295 B7R0.11 CCC(C)(O)CCO MCULE-6173398477 [1,1,0,0,0,0|2,0,0]=4 296 B7R0.11 CCCC(C)(O)CO MCULE-3737630396 [1,1,0,0,0,0|2,0,0]=4 297 B7R0.11 CCNC(C)(C)CO MCULE-9120392867 [1,1,0,0,0,0|2,0,0]=4 298 B7R0.11 CCNC(C)(C)CO MCULE-9465450982 [1,1,0,0,0,0|2,0,0]=4 299 B7R0.11 CCOC(C)(C)CO MCULE-6294474255 [1,1,0,0,0,0|2,0,0]=4 300 B7R0.11 CCO[C@](C)(O)CO MCULE-2547633573 [1,1,0,0,0,0|2,0,0]=4 301 B7R0.11 CNCC(C)(C)CO MCULE-1912751262 [1,1,0,0,0,0|2,0,0]=4 302 B7R0.11 COCC(C)(C)CBr MCULE-2591763859 [1,1,0,0,0,0|2,0,0]=4 303 B7R0.11 COCC(C)(C)CN MCULE-6321252323 [1,1,0,0,0,0|2,0,0]=4 304 B7R0.11 COCC(C)(C)CN MCULE-8662870324 [1,1,0,0,0,0|2,0,0]=4 305 B7R0.11 COCC(C)(C)CO MCULE-2985367717 [1,1,0,0,0,0|1,0,0]=3 306 B7R0.11 COCC(C)(N)CO MCULE-2603485329 [1,1,0,0,0,0|2,0,0]=4 307 B7R0.11 COCC(C)(N)CO MCULE-3416999559 [1,1,0,0,0,0|2,0,0]=4 308 B7R0.11 COCC(C)(O)CN MCULE-8403551049 [1,1,0,0,0,0|2,0,0]=4 309 B7R0.11 COCC(C)(O)CN MCULE-8479817538 [1,1,0,0,0,0|2,0,0]=4 310 B7R0.11 CSCC(C)(C)CO MCULE-4089291196 [1,1,0,0,0,0|1,1,0]=4 311 B7R0.11 C[N+](C)(CF)CCO MCULE-7470515657 [1,1,0,0,0,0|1,0,0]=3 312 B7R0.11 C[N+](C)(CF)CCO MCULE-8037348431 [1,1,0,0,0,0|1,0,0]=3 313 B7R0.11 C[N+](C)(CI)CCO MCULE-1028701878 [1,1,0,0,0,0|1,0,0]=3 314 B7R0.11 C[N+](C)(CI)CCO MCULE-6877151655 [1,1,0,0,0,0|1,0,0]=3 315 B7R0.13 CC(C)(CO)C(=O)O MCULE-8700273400 [1,1,0,0,0,0|1,0,1]=4 316 B7R0.13 CC(C)(CO)C(F)F MCULE-5444524351 [1,1,0,0,0,0|2,0,0]=4 317 B7R0.13 CC(C)C(C)(C)CO MCULE-1206498909 [1,1,0,0,0,0|2,0,0]=4 318 B7R0.13 CC(C)C(C)(O)CO MCULE-7640109698 [1,1,0,0,0,0|2,0,0]=4 319 B7R0.13 CC(O)(CO)C(=O)O MCULE-5566145169 [1,1,0,0,0,0|1,0,1]=4 320 B7R0.13 CC(O)C(C)(C)CN MCULE-2675460571 [1,1,0,0,0,0|2,0,0]=4 321 B7R0.13 CC(O)C(C)(C)CO MCULE-1064066796 [1,1,0,0,0,0|1,0,0]=3 322 B7R0.13 CCC(C)(O)C(C)O MCULE-5475978311 [1,1,0,0,0,0|2,0,0]=4 323 B7R0.12 C=CCC(CO)CO MCULE-4178696072 [1,1,0,0,0,0|2,0,0]=4 324 B7R0.12 CCCC(CO)CO MCULE-2372919180 [1,1,0,0,0,0|2,0,0]=4 325 B7R0.12 NCCC(CO)CO MCULE-7028267284 [1,1,0,0,0,0|2,0,0]=4 326 B7R0.12 NCCC(CO)CO MCULE-8865812482 [1,1,0,0,0,0|2,0,0]=4 327 B7R0.12 OCCC(CO)CO MCULE-7198799967 [1,1,0,0,0,0|1,0,0]=3 328 B7R0.15 CC(C)C(CO)CO MCULE-8569465631 [1,1,0,0,0,0|2,0,0]=4 329 B7R0.15 CC(O)C(CO)CO MCULE-9986430379 [1,1,0,0,0,0|1,0,0]=3 330 B9R0.62 CCNC(CO)(CO)CO MCULE-9722970786 [0,2,0,0,0,0|1,0,0]=3 331 B9R0.62 CC[N+](CC)(CC)CCO MCULE-4695797021 [0,2,0,0,0,0|2,0,0]=4 332 B9R0.62 CC[N+](CC)(CC)CCO MCULE-8970781878 [0,2,0,0,0,0|2,0,0]=4 333 B9R0.62 CC[N+](CC)(CC)CCO MCULE-9715160196 [0,2,0,0,0,0|2,0,0]=4 334 B9R0.78 CC(=O)C(CO)(CO)CO MCULE-4861886359 [0,2,0,0,0,0|1,0,0]=3 335 B9R0.78 CC(C)C(CO)(CO)CO MCULE-5742483747 [0,2,0,0,0,0|1,0,0]=3 336 B9R0.78 CCC(CO)(CO)C(=O)O MCULE-9340744825 [0,2,0,0,0,0|1,0,1]=4 337 B9R0.78 CN(C)C(CO)(CO)CO MCULE-7239584566 [0,2,0,0,0,0|1,0,0]=3 338 B9R0.78 O=C(O)C(CO)(CO)CO MCULE-5931961935 [0,2,0,0,0,0|1,0,1]=4 339 B9R0.78 O=N(=O)C(CO)(CO)CO MCULE-8637892145 [0,2,0,0,0,0|2,0,0]=4 340 B9R0.63 CC(CN)(CO)CC(=O)O MCULE-3238773867 [0,2,0,0,0,0|2,0,0]=4 341 B9R0.63 CC(CN)(CO)CC(=O)O MCULE-9021134491 [0,2,0,0,0,0|2,0,0]=4 342 B9R0.67 CC(CO)(CO)CN=N#N MCULE-6076470140 [0,2,0,0,0,0|2,0,0]=4 343 B9R0.67 CC[N+](C)(CC)CCOC MCULE-3010976108 [0,2,0,0,0,0|2,0,0]=4 344 B9R0.67 CC[N+](C)(CC)CCOC MCULE-8515741730 [0,2,0,0,0,0|2,0,0]=4 345 B9R0.69 COC(=O)C(C)(CO)CO MCULE-3441914987 [0,2,0,0,0,0|1,0,1]=4 346 B9R0.69 O=CC(O)C(O)(CO)CO MCULE-7860921259 [0,2,0,0,0,0|2,0,0]=4 347 B9R0.73 CC(C)(C)C(C)(CO)CO MCULE-9644530713 [0,2,0,0,0,0|2,0,0]=4 348 B7R1.14 CC1(CCOC1)O MCULE-5065022086 [1,0,0,1,0,0|2,0,0]=4 349 B7R1.14 C[C@@]1(CNOC1)O MCULE-2135476163 [1,0,0,1,0,0|2,0,0]=4 350 B7R1.14 C[C@@]1(CNOC1)O MCULE-2596956621 [1,0,0,1,0,0|2,0,0]=4 351 B7R1.14 C[C@@]1(CNOC1)O MCULE-6080745149 [1,0,0,1,0,0|2,0,0]=4 352 B7R1.14 C[C@@]1(CNOC1)O MCULE-7091595110 [1,0,0,1,0,0|2,0,0]=4 353 B7R1.14 C[C@]1(CNOC1)O MCULE-1405004782 [1,0,0,1,0,0|2,0,0]=4 354 B7R1.14 C[C@]1(CNOC1)O MCULE-4558122242 [1,0,0,1,0,0|2,0,0]=4 355 B7R1.14 C[N+]1(CCCC1)C MCULE-3715522497 [1,0,0,1,0,0|2,0,0]=4 356 B7R1.14 C[N+]1(CCCC1)C MCULE-9941565311 [1,0,0,1,0,0|2,0,0]=4 357 B7R1.17 CC1(CCC1O)C MCULE-7385359414 [1,0,0,1,0,0|2,0,0]=4 358 B7R1.17 CC1(CC[C@@H]1O)C MCULE-9766955692 [1,0,0,1,0,0|2,0,0]=4 359 B7R1.25 CC1(CCC1)CO MCULE-9646690839 [1,0,0,1,0,0|2,0,0]=4 360 B7R1.25 CC1(CCO1)CO MCULE-6424264752 [1,0,0,1,0,0|2,0,0]=4 361 B7R1.25 CC1(CNC1)CO MCULE-4856424189 [1,0,0,1,0,0|2,0,0]=4 362 B7R1.25 CC1(CNC1)CO MCULE-7118798664 [1,0,0,1,0,0|2,0,0]=4 363 B7R1.25 CC1(COC1)CBr MCULE-5644951797 [1,0,0,1,0,0|2,0,0]=4 364 B7R1.25 CC1(COC1)CCl MCULE-3299014950 [1,0,0,1,0,0|2,0,0]=4 365 B7R1.25 CC1(COC1)CI MCULE-2311899293 [1,0,0,1,0,0|2,0,0]=4 366 B7R1.25 CC1(COC1)CN MCULE-1465461565 [1,0,0,1,0,0|2,0,0]=4 367 B7R1.25 CC1(COC1)CN MCULE-9032740574 [1,0,0,1,0,0|2,0,0]=4 368 B7R1.25 CC1(COC1)CN MCULE-9508101523 [1,0,0,1,0,0|2,0,0]=4 369 B7R1.25 CC1(COC1)CO MCULE-5859568263 [1,0,0,1,0,0|1,0,0]=3 370 B7R1.25 CC1(COC1)CS MCULE-6297617076 [1,0,0,1,0,0|1,1,0]=4 371 B7R1.25 CC1(CSC1)CO MCULE-2267957602 [1,0,0,1,0,0|1,1,0]=4 372 B7R1.25 CCC1(COC1)O MCULE-7543171366 [1,0,0,1,0,0|2,0,0]=4 373 B7R1.25 C[C@@]1(CCO1)CO MCULE-4685471926 [1,0,0,1,0,0|2,0,0]=4 374 B7R1.25 C[C@@]1(CCO1)CO MCULE-5799098537 [1,0,0,1,0,0|2,0,0]=4 375 B7R1.25 C[C@]1(CCO1)CO MCULE-5749345841 [1,0,0,1,0,0|2,0,0]=4 376 B7R1.25 NC1(COC1)CO MCULE-5347414182 [1,0,0,1,0,0|2,0,0]=4 377 B7R1.25 NCC1(COC1)O MCULE-6677052127 [1,0,0,1,0,0|2,0,0]=4 378 B7R1.25 OC1(COC1)CF MCULE-1428128025 [1,0,0,1,0,0|2,0,0]=4 379 B7R1.25 OCC1(CCC1)O MCULE-2830358505 [1,0,0,1,0,0|2,0,0]=4 380 B7R1.25 OCC1(CNC1)O MCULE-1089145184 [1,0,0,1,0,0|2,0,0]=4 381 B7R1.25 OCC1(CNC1)O MCULE-8217738451 [1,0,0,1,0,0|2,0,0]=4 382 B7R1.25 OCC1(CNC1)O MCULE-9215525935 [1,0,0,1,0,0|2,0,0]=4 383 B7R1.25 OCC1(CNC1)O MCULE-9389454165 [1,0,0,1,0,0|2,0,0]=4 384 B7R1.25 OCC1(COC1)F MCULE-9098723776 [1,0,0,1,0,0|2,0,0]=4 385 B7R1.25 OCC1(COC1)O MCULE-4207928663 [1,0,0,1,0,0|1,0,0]=3 386 B7R1.27 CC1(CC1Br)CO MCULE-5286402958 [1,0,0,1,0,0|2,0,0]=4 387 B7R1.27 CC1(CC1F)CO MCULE-9626513813 [1,0,0,1,0,0|2,0,0]=4 388 B7R1.29 CCC1(CC1)CO MCULE-9504231451 [1,0,0,1,0,0|2,0,0]=4 389 B7R1.29 NCC1(CC1)CO MCULE-1328630482 [1,0,0,1,0,0|2,0,0]=4 390 B7R1.29 NCC1(CC1)CO MCULE-3970508474 [1,0,0,1,0,0|2,0,0]=4 391 B7R1.29 OCC1(CC1)CF MCULE-1670499766 [1,0,0,1,0,0|2,0,0]=4 392 B7R1.29 OCC1(CC1)CO MCULE-9312932144 [1,0,0,1,0,0|1,0,0]=3 393 B7R1.1 C1(CCOC1)CO MCULE-2350780678 [1,0,0,1,0,0|2,0,0]=4 394 B7R1.1 OCC1CCOC1 MCULE-8926405046 [1,0,0,1,0,0|2,0,0]=4 395 B7R1.1 OC[C@@H]1CCOC1 MCULE-2004616524 [1,0,0,1,0,0|2,0,0]=4 396 B7R1.1 OC[C@@H]1CCOC1 MCULE-3801423698 [1,0,0,1,0,0|2,0,0]=4 397 B7R1.1 OC[C@H]1CCOC1 MCULE-4226412289 [1,0,0,1,0,0|2,0,0]=4 398 B7R1.1 OC[C@H]1CCOC1 MCULE-9076004118 [1,0,0,1,0,0|2,0,0]=4 399 B7R1.8 OCC1CCC1O MCULE-9764745395 [1,0,0,1,0,0|2,0,0]=4 400 B7R1.8 OC[C@@H]1CC[C@H]1O MCULE-5043281368 [1,0,0,1,0,0|2,0,0]=4 401 B7R1.8 OC[C@H]1CC[C@H]1O MCULE-1536326248 [1,0,0,1,0,0|2,0,0]=4 402 B9R1.120 CC1CCC1(CO)CO MCULE-7776828217 [0,1,0,1,0,0|2,0,0]=4 403 B9R1.204 CNC1(CCOC1)CO MCULE-1597439940 [0,1,0,1,0,0|2,0,0]=4 404 B9R1.204 COC1(CCOC1)CO MCULE-5882769438 [0,1,0,1,0,0|2,0,0]=4 405 B9R1.204 NCC1(CCOC1)CO MCULE-2011513032 [0,1,0,1,0,0|2,0,0]=4 406 B9R1.204 OCC1(CC=CC1)CO MCULE-7429277981 [0,1,0,1,0,0|2,0,0]=4 407 B9R1.204 OCC1(CCCC1)CO MCULE-6896331863 [0,1,0,1,0,0|2,0,0]=4 408 B9R1.204 OCC1(CCCN1)CO MCULE-8513711939 [0,1,0,1,0,0|2,0,0]=4 409 B9R1.204 OCC1(CCCO1)CO MCULE-2056655928 [0,1,0,1,0,0|2,0,0]=4 410 B9R1.204 OCC1(CCNC1)CO MCULE-5448294830 [0,1,0,1,0,0|2,0,0]=4 411 B9R1.94 C=CC1CC1(CO)CO MCULE-8545390173 [0,1,0,1,0,0|2,0,0]=4 412 B9R1.118 CC1(CCCOC1)CO MCULE-5818698089 [0,1,0,1,0,0|2,0,0]=4 413 B9R1.118 CC1(CCOCC1)CO MCULE-5535447172 [0,1,0,1,0,0|2,0,0]=4 414 B9R1.118 CC1(COCCN1)CO MCULE-1204894568 [0,1,0,1,0,0|2,0,0]=4 415 B9R1.118 CC1(COCCO1)CO MCULE-2402682578 [0,1,0,1,0,0|2,0,0]=4 416 B9R1.118 CC1(COCOC1)CO MCULE-8507884308 [0,1,0,1,0,0|1,0,0]=3 417 B9R1.118 CC[N+]1(CCOCC1)C MCULE-2599304590 [0,1,0,1,0,0|2,0,0]=4 418 B9R1.118 CC[N+]1(CCOCC1)C MCULE-4492861318 [0,1,0,1,0,0|2,0,0]=4 419 B9R1.124 NC1CC(C1)(CO)CO MCULE-4363026481 [0,1,0,1,0,0|2,0,0]=4 420 B9R1.124 NC1CC(C1)(CO)CO MCULE-6426369672 [0,1,0,1,0,0|2,0,0]=4 421 B9R1.124 O=C1CC(C1)(CO)CO MCULE-4534541678 [0,1,0,1,0,0|1,0,1]=4 422 B9R1.124 OCC1(CC(C1)F)CO MCULE-5056746535 [0,1,0,1,0,0|2,0,0]=4 423 B9R1.124 OCC1(CC(C1)O)CO MCULE-9253482710 [0,1,0,1,0,0|1,0,0]=3 424 B9R1.125 CC1(COC(=O)C1)CO MCULE-2278000717 [0,1,0,1,0,0|1,0,1]=4 425 B9R1.175 C=CCC1(COC1)CO MCULE-2922605150 [0,1,0,1,0,0|2,0,0]=4 426 B9R1.175 CNCC1(COC1)CO MCULE-7203136138 [0,1,0,1,0,0|2,0,0]=4 427 B9R1.175 COCC1(CCC1)CO MCULE-5051381024 [0,1,0,1,0,0|2,0,0]=4 428 B9R1.175 COCC1(COC1)CO MCULE-6136093323 [0,1,0,1,0,0|1,0,0]=3 429 B9R1.175 N#CCC1(COC1)CO MCULE-8393275630 [0,1,0,1,0,0|2,0,0]=4 430 B9R1.175 NCC1(COC1)CCO MCULE-4867318384 [0,1,0,1,0,0|2,0,0]=4 431 B9R1.119 CC(C)C1(COC1)CO MCULE-3643690887 [0,1,0,1,0,0|2,0,0]=4 432 B9R1.119 O=C(O)C1(COC1)CO MCULE-8517233263 [0,1,0,1,0,0|1,0,1]=4 433 B9R1.119 OCC1(COC1)C(F)F MCULE-3948614973 [0,1,0,1,0,0|2,0,0]=4 434 B9R1.205 CC1(CC1(CO)CO)C MCULE-3929792710 [0,1,0,1,0,0|2,0,0]=4 435 B9R1.205 OCC1(CC1(F)F)CO MCULE-2530789348 [0,1,0,1,0,0|2,0,0]=4 436 B9R2.56 OCC12COCC1C2 MCULE-7115607299 [0,0,0,2,0,0|2,0,0]=4 437 B9R2.56 [C@@H]12COC[C@@]1(C2)CO MCULE-3925746673 [0,0,0,2,0,0|2,0,0]=4 438 B9R2.56 [C@@H]12COC[C@@]1(C2)CO MCULE-6112691555 [0,0,0,2,0,0|2,0,0]=4 439 B9R2.56 [C@H]12COC[C@]1(C2)CO MCULE-8930198647 [0,0,0,2,0,0|2,0,0]=4 440 B9R2.56 [C@H]12COC[C@]1(C2)CO MCULE-9519595251 [0,0,0,2,0,0|2,0,0]=4 441 B9R2.61 OCC12COC(C1)C2 MCULE-1603753975 [0,0,0,2,0,0|2,0,0]=4 442 B9R2.140 OC1CCC12COC2 MCULE-5757589077 [0,0,0,2,0,0|2,0,0]=4 443 B9R2.140 O[C@H]1CCC12COC2 MCULE-6567729778 [0,0,0,2,0,0|2,0,0]=4