0 B12R2.3180 CC(=C)[C@@H]1CCC2(C(C1)O2)C Amb17616508 [0,0,0,0,0,0|0,0,0]=0 1 B12R2.3180 CC(=C)[C@@H]1C[C@@H]2O[C@]2(C)CC1 Amb22747030 [0,0,0,0,0,0|0,0,0]=0 2 B12R2.3180 CC(=C)[C@@H]1C[C@H]2O[C@@]2(C)CC1 Amb22747028 [0,0,0,0,0,0|0,0,0]=0 3 B12R2.3180 CC(=C)[C@H]1CC2NC2(C)CC1 Amb24056774 [0,0,0,0,0,0|1,0,0]=1 4 B12R2.3180 CC(=C)[C@H]1C[C@H]2O[C@@]2(C)CC1 Amb22232220 [0,0,0,0,0,0|0,0,0]=0 5 B12R2.3180 CC(=O)C=1CC2OC2(C)CC1 Amb25378779 [0,0,0,0,0,0|1,0,2]=3 6 B12R2.3180 CC(=O)[C@@H]1CC2OC2(C)CC1 Amb24575937 [0,0,0,0,0,0|1,0,0]=1 7 B12R2.3180 CC(=O)[C@@H]1C[C@@H]2O[C@]2(C)CC1 Amb24545998 [0,0,0,0,0,0|1,0,0]=1 8 B12R2.3180 CC(=O)[C@@H]1C[C@H]2C[C@]2(C)CC1 Amb25179709 [0,0,0,0,0,0|2,0,0]=2 9 B12R2.3180 CC(=O)[C@@H]1C[C@H]2O[C@@]2(C)CC1 Amb22227479 [0,0,0,0,0,0|1,0,0]=1 10 B12R2.3180 CC(=O)[C@@H]1C[C@H]2O[C@]2(C)CC1 Amb22227478 [0,0,0,0,0,0|1,0,0]=1 11 B12R2.3180 CC(=O)[C@H]1CC2OC2(C)CC1 Amb25151467 [0,0,0,0,0,0|1,0,0]=1 12 B12R2.3180 CC(=O)[C@H]1C[C@@H]2O[C@]2(C)CC1 Amb24690515 [0,0,0,0,0,0|1,0,0]=1 13 B12R2.3180 CC(=O)[C@H]1C[C@H]2O[C@@]2(C)CC1 Amb24567992 [0,0,0,0,0,0|1,0,0]=1 14 B12R2.3180 CC(C)C1CC2OC2(C)C=C1 Amb24486001 [0,0,0,0,0,0|0,0,4]=4 15 B12R2.3180 CC(C)C1CC2OC2(C)CC1 Amb25694763 [0,0,0,0,0,0|0,0,2]=2 16 B12R2.3180 CC(C)C=1CC2O[C@]2(C)CC1 Amb25723703 [0,0,0,0,0,0|0,0,4]=4 17 B12R2.3180 CC(C)C=1CCC2(C)OC2C1 Amb25694762 [0,0,0,0,0,0|0,0,4]=4 18 B12R2.3180 CC(C)C=1CCC2(C)O[C@H]2C1 Amb24649803 [0,0,0,0,0,0|0,0,4]=4 19 B12R2.3180 CC(C)N1CC2OC2(C)CC1 Amb23455566 [0,0,0,0,0,0|1,0,2]=3 20 B12R2.3180 CC(C)[C@@H]1CC2OC2(C)CC1 Amb22745469 [0,0,0,0,0,0|0,0,2]=2 21 B11R2.839 CC(=C)C1CC2OC2CC1 Amb25274403 [1,0,0,0,0,0|0,0,0]=1 22 B11R2.839 CC(=O)C1CC2CC2CC1 Amb25713071 [1,0,0,0,0,0|2,0,0]=3 23 B11R2.839 CC(=O)C1CC2OC2CC1 Amb25146491 [1,0,0,0,0,0|1,0,0]=2 24 B11R2.839 CC(=O)N1CC2OC2CC1 Amb23557881 [1,0,0,0,0,0|2,0,0]=3 25 B11R2.839 CC(=O)[C@@H]1C[C@@H]2O[C@@H]2CC1 Amb24612667 [1,0,0,0,0,0|1,0,0]=2 26 B11R2.839 CC(C)C1CC2OC2CC1 Amb24505073 [1,0,0,0,0,0|0,0,2]=3 27 B11R2.839 NC(=O)C1CC2CC2CC1 Amb24482485 [1,0,0,0,0,0|3,0,0]=4 28 B11R2.839 OC(=O)C1CC2OC2CC1 Amb22274789 [1,0,0,0,0,0|2,0,0]=3 29 B11R2.839 OC(=O)C1CC2OC2CC1 Amb24671302 [1,0,0,0,0,0|2,0,0]=3 30 B11R2.839 OC(=O)C1CC2OC2CN1 Amb25849260 [1,0,0,0,0,0|3,0,0]=4 31 B11R2.839 OC(=O)[C@@H]1C[C@@H]2C[C@@H]2CC1 Amb25174795 [1,0,0,0,0,0|3,0,0]=4 32 B11R2.839 OC(=O)[C@H]1C[C@@H]2OC2CC1 Amb24514915 [1,0,0,0,0,0|2,0,0]=3 33 B11R2.839 OC(=O)[C@H]1C[C@@H]2O[C@@H]2CC1 Amb25366365 [1,0,0,0,0,0|2,0,0]=3 34 B11R2.1004 CCN1CC2OC2(C)CC1 Amb23455564 [1,0,0,0,0,0|1,0,1]=3 35 B13R2.5236 CC(=C)C1CC(O)[C@@]2(C)CC2C1 Amb25788143 [0,1,0,0,0,0|1,0,0]=2 36 B13R2.5236 CC(=C)C1CC(O)[C@@]2(C)C[C@H]2C1 Amb24749634 [0,1,0,0,0,0|1,0,0]=2 37 B13R2.5236 CC(=C)C1CC2C[C@@]2(C)C(=O)C1 Amb24647879 [0,1,0,0,0,0|1,0,1]=3 38 B13R2.5236 CC(=C)C1C[C@@H]2O[C@]2(C)C(=O)C1 Amb24577836 [0,1,0,0,0,0|0,0,1]=2 39 B13R2.5236 CC(=C)C1C[C@H](O)[C@]2(C)CC2C1 Amb24576635 [0,1,0,0,0,0|1,0,0]=2 40 B13R2.5236 CC(=C)C1C[C@H]2C[C@@]2(C)C(=O)C1 Amb25264884 [0,1,0,0,0,0|1,0,1]=3 41 B13R2.5236 CC(=C)[C@@H]1CC2CC2(C)C(=O)C1 Amb25285771 [0,1,0,0,0,0|1,0,1]=3 42 B13R2.5236 CC(=C)[C@@H]1CC2OC2(C)C(=C)C1 Amb25719452 [0,1,0,0,0,0|0,0,1]=2 43 B13R2.5236 CC(=C)[C@@H]1C[C@@H](O)[C@@]2(C)C[C@H]2C1 Amb24719523 [0,1,0,0,0,0|1,0,0]=2 44 B13R2.5236 CC(=C)[C@@H]1C[C@@H](O)[C@@]2(C)O[C@H]2C1 Amb19132127 [0,1,0,0,0,0|0,0,0]=1 45 B13R2.5236 CC(=C)[C@@H]1C[C@H](O)[C@@]2(C)C[C@H]2C1 Amb24520170 [0,1,0,0,0,0|1,0,0]=2 46 B13R2.5236 CC(=C)[C@@H]1C[C@H](O)[C@]2(C)O[C@@H]2C1 Amb25289145 [0,1,0,0,0,0|0,0,0]=1 47 B13R2.5236 CC(=C)[C@H]1CC(=O)[C@]2([C@@H](C1)O2)C Amb17610645 [0,1,0,0,0,0|0,0,1]=2 48 B13R2.5236 CC(=C)[C@H]1CC(O)C2(C)OC2C1 Amb24749792 [0,1,0,0,0,0|0,0,0]=1 49 B13R2.5236 CC(=C)[C@H]1C[C@@H](O)[C@]2(C)O[C@@H]2C1 Amb24671378 [0,1,0,0,0,0|0,0,0]=1 50 B13R2.5236 CC(=C)[C@H]1C[C@H](O)[C@@]2(C)O[C@H]2C1 Amb25221438 [0,1,0,0,0,0|0,0,0]=1 51 B13R2.5236 CC(=C)[C@H]1C[C@H](O)[C@]2([C@@H](C1)O2)C Amb17613722 [0,1,0,0,0,0|0,0,0]=1 52 B13R2.5236 CC(=C)[C@H]1C[C@H]2C[C@@]2(C)C(=O)C1 Amb24551077 [0,1,0,0,0,0|1,0,1]=3 53 B13R2.5236 CC(=O)C1CC2CC2(C)C(=O)C1 Amb24424909 [0,1,0,0,0,0|2,0,1]=4 54 B13R2.5236 CC(=O)[C@H]1C[C@@H](O)[C@]2(C)O[C@@H]2C1 Amb25371737 [0,1,0,0,0,0|1,0,0]=2 55 B13R2.5236 CC(C)C1CC2OC2(C)C(O)C1 Amb25350284 [0,1,0,0,0,0|0,0,2]=3 56 B13R2.5236 CC(C)[C@@H]1C[C@@H]2O[C@]2(C)[C@H](O)C1 Amb24619194 [0,1,0,0,0,0|0,0,2]=3 57 B13R2.5236 CC(C)[C@@H]1C[C@H]2O[C@@]2(C)C(=O)C1 Amb25337496 [0,1,0,0,0,0|0,0,3]=4 58 B13R2.10746 CC(=C)C1CCC2(C)OC2C1O Amb24544076 [0,1,0,0,0,0|0,0,0]=1 59 B13R2.10746 CC(=C)[C@H]1CC[C@]2(C)O[C@@H]2C1=O Amb25179596 [0,1,0,0,0,0|0,0,1]=2 60 B13R2.10746 CC(C)=C1CC[C@]2(C)O[C@@H]2C1=O Amb24582561 [0,1,0,0,0,0|0,0,3]=4 61 B13R2.10746 CC(C)[C@@H]1CC[C@]2(C)CC2[C@@H]1O Amb25175568 [0,1,0,0,0,0|1,0,2]=4 62 B13R2.10746 CC(C)[C@@H]1CC[C@]2(C)O[C@@H]2C1=O Amb25373236 [0,1,0,0,0,0|0,0,3]=4 63 B13R2.10746 CC(C)[C@@H]1CC[C@]2(C)O[C@@H]2[C@@H]1O Amb24515484 [0,1,0,0,0,0|0,0,2]=3 64 B13R2.10746 CC(C)[C@@H]1CC[C@]2(C)O[C@@H]2[C@H]1O Amb24515485 [0,1,0,0,0,0|0,0,2]=3 65 B13R2.10746 CC(C)[C@H]1CC[C@@]2(C)O[C@H]2C1=O Amb25205773 [0,1,0,0,0,0|0,0,3]=4 66 B13R2.10746 CC(C)[C@H]1CC[C@]2(C)CC2C1O Amb24705960 [0,1,0,0,0,0|1,0,2]=4 67 B13R2.10746 CC(C)[C@H]1CC[C@]2(C)CC2[C@H]1O Amb25346293 [0,1,0,0,0,0|1,0,2]=4 68 B13R2.10746 CC(C)[C@H]1CC[C@]2(C)O[C@@H]2[C@@H]1O Amb24576555 [0,1,0,0,0,0|0,0,2]=3 69 B13R2.15248 C[C@@]12CC[C@@H](C[C@@H]1O2)C(=C)CCl Amb24545441 [0,1,0,0,0,0|0,0,0]=1 70 B13R2.15248 C[C@H](CO)[C@H]1C[C@H]2O[C@@]2(C)CC1 Amb24588387 [0,1,0,0,0,0|0,0,2]=3 71 B13R2.17256 CC(=C)C1CC2CC2(CO)CC1 Amb25357401 [0,1,0,0,0,0|1,0,0]=2 72 B13R2.17256 CC(=C)C1CC2OC2(CO)CC1 Amb25816597 [0,1,0,0,0,0|0,0,0]=1 73 B13R2.17256 CC(=C)[C@@H]1CC2OC2(CC1)C=O Amb24452206 [0,1,0,0,0,0|0,0,1]=2 74 B13R2.17256 CC(=C)[C@@H]1C[C@@H]2C[C@@]2(CC1)C=O Amb25366239 [0,1,0,0,0,0|1,0,1]=3 75 B13R2.17256 CC(=C)[C@@H]1C[C@H]2C[C@]2(CC1)C=O Amb24512910 [0,1,0,0,0,0|1,0,1]=3 76 B13R2.17256 CC(=C)[C@H]1CC2OC2(CO)CC1 Amb25156847 [0,1,0,0,0,0|0,0,0]=1 77 B13R2.17256 CC(=C)[C@H]1CC2O[C@]2(CO)CC1 Amb24749648 [0,1,0,0,0,0|0,0,0]=1 78 B13R2.17256 CC(=C)[C@H]1C[C@H]2C[C@@]2(CO)CC1 Amb25235676 [0,1,0,0,0,0|1,0,0]=2 79 B13R2.23062 CC12CCC(O)(CC1O2)C(C)C Amb24443816 [0,1,0,0,0,0|0,0,2]=3 80 B11R1.21 CC(=C)C1CC(=C)C(O)CC1 Amb25097757 [0,0,1,0,0,0|2,0,1]=4 81 B11R1.21 CC(=C)C1CC=C(C(C1)N)C Amb2226988 [0,0,1,0,0,0|1,0,2]=4 82 B11R1.21 CC(=C)C1CCC(=C)C(N)C1 Amb25062064 [0,0,1,0,0,0|1,0,2]=4 83 B11R1.21 CC(=C)C1CCC(=C)[C@@H](O)C1 Amb25832704 [0,0,1,0,0,0|0,0,2]=3 84 B11R1.21 CC(=C)C1CCC(=O)C(O)C1 Amb25130598 [0,0,1,0,0,0|1,0,1]=3 85 B11R1.21 CC(=C)C=1CC[C@@H](C)[C@H](O)C1 Amb24618727 [0,0,1,0,0,0|0,0,2]=3 86 B11R1.21 CC(=C)[C@@H]1CC(=O)[C@H](C)CC1 Amb25179493 [0,0,1,0,0,0|0,0,2]=3 87 B11R1.21 CC(=C)[C@@H]1CCC(=C)C(C1)O Amb17617403 [0,0,1,0,0,0|0,0,2]=3 88 B11R1.21 CC(=C)[C@H]1CC(=O)[C@@H](C)CC1 Amb25322223 [0,0,1,0,0,0|0,0,2]=3 89 B11R1.21 CC(=C)[C@H]1CC=C(C(C1)N)C Amb10842059 [0,0,1,0,0,0|1,0,2]=4 90 B11R1.21 CC(=C)[C@H]1CCC(=C)C(Cl)C1 Amb25060773 [0,0,1,0,0,0|1,0,2]=4 91 B11R1.21 CC(=C)[C@H]1C[C@@H](C)C(=O)CC1 Amb24721720 [0,0,1,0,0,0|2,0,1]=4 92 B11R1.21 CC(=O)C1CC(=O)C(C)CC1 Amb24572172 [0,0,1,0,0,0|1,0,2]=4 93 B11R1.21 CC(=O)N1CC(C)C(C)CC1 Amb24488284 [0,0,1,0,0,0|3,0,0]=4 94 B11R1.21 CC(C)C1CC(Cl)C(C)CC1 Amb25275040 [0,0,1,0,0,0|1,0,2]=4 95 B11R1.21 CC(C)C1CC(N)C(C)CC1 Amb20670102 [0,0,1,0,0,0|1,0,2]=4 96 B11R1.21 CC(C)C1CC(O)C(N)CC1 Amb24559217 [0,0,1,0,0,0|1,0,2]=4 97 B11R1.21 CC(C)C1CC(O)C(O)CC1 Amb24430921 [0,0,1,0,0,0|1,0,2]=4 98 B11R1.21 CC(C)C1CCC(C)C(O)C1 Amb17777978 [0,0,1,0,0,0|0,0,2]=3 99 B11R1.21 CC(C)C1C[C@@H](O)C(C)CC1 Amb25343923 [0,0,1,0,0,0|0,0,2]=3 100 B11R1.21 CC(C)[C@@H]1C[C@@H](Cl)[C@H](C)CC1 Amb24540908 [0,0,1,0,0,0|1,0,2]=4 101 B11R1.21 CC(C)[C@@H]1C[C@@H](N)[C@@H](C)CC1 Amb25237915 [0,0,1,0,0,0|1,0,2]=4 102 B11R1.21 CC(C)[C@@H]1C[C@H](N)[C@@H](C)CC1 Amb24692953 [0,0,1,0,0,0|1,0,2]=4 103 B11R1.21 CC(C)[C@@H]1C[C@H](O)C(C)CC1 Amb25204748 [0,0,1,0,0,0|0,0,2]=3 104 B11R1.21 CC(C)[C@H]1CC(O)C(C)CC1 Amb25149666 [0,0,1,0,0,0|0,0,2]=3 105 B11R1.21 CC(C)[C@H]1C[C@@H](Cl)[C@H](C)CC1 Amb24650981 [0,0,1,0,0,0|1,0,2]=4 106 B11R1.21 CC(C)[C@H]1C[C@@H](O)C(C)CC1 Amb24588232 [0,0,1,0,0,0|0,0,2]=3 107 B11R1.21 CC(C)[C@H]1C[C@@H](O)[C@@H](N)CC1 Amb25200886 [0,0,1,0,0,0|1,0,2]=4 108 B11R1.21 CC(C)[C@H]1C[C@H](Cl)[C@@H](C)CC1 Amb24565732 [0,0,1,0,0,0|1,0,2]=4 109 B11R1.21 CC(C)[C@H]1C[C@H](N)[C@@H](C)CC1 Amb24692687 [0,0,1,0,0,0|1,0,2]=4 110 B11R1.21 CC(C)[C@H]1C[C@H](N)[C@H](C)CC1 Amb24512321 [0,0,1,0,0,0|1,0,2]=4 111 B11R1.21 CC1=CCC(CC1Br)C(C)=C Amb24567061 [0,0,1,0,0,0|1,0,2]=4 112 B11R1.21 CC1=CCC(CC1Cl)C(C)=C Amb25362191 [0,0,1,0,0,0|1,0,2]=4 113 B11R1.21 CC1=CCC(C[C@H]1O)C(C)=C Amb24749691 [0,0,1,0,0,0|0,0,2]=3 114 B11R1.21 CC1=CC[C@@H](C[C@@H]1Br)C(C)=C Amb24519668 [0,0,1,0,0,0|1,0,2]=4 115 B11R1.21 CC1=CC[C@@H](C[C@@H]1N)C(C)=C Amb24519134 [0,0,1,0,0,0|1,0,2]=4 116 B11R1.21 CC1=CC[C@@H](C[C@H]1N)C(C)=C Amb25223125 [0,0,1,0,0,0|1,0,2]=4 117 B11R1.21 CC1=CC[C@H](CC1Br)C(C)=C Amb24484923 [0,0,1,0,0,0|1,0,2]=4 118 B11R1.21 CC1=CC[C@H](C[C@@H]1O)C(C)=C Amb24519549 [0,0,1,0,0,0|0,0,2]=3 119 B11R1.21 CC1=CC[C@H](C[C@H]1Cl)C(C)=C Amb24519207 [0,0,1,0,0,0|1,0,2]=4 120 B11R1.21 CC1CC(CCC1C)C(C)Br Amb24573007 [0,0,1,0,0,0|2,0,1]=4 121 B11R1.21 CC1CC(CCC1C)C(C)N Amb24575683 [0,0,1,0,0,0|2,0,1]=4 122 B11R1.21 CC1CC(CCC1C)C(C)O Amb25047137 [0,0,1,0,0,0|2,0,1]=4 123 B11R1.21 CC1CC(CCC1C)C(N)=S Amb24581944 [0,0,1,0,0,0|3,0,0]=4 124 B11R1.21 CC1CC(CCN1C)C(C)=O Amb25376463 [0,0,1,0,0,0|3,0,0]=4 125 B11R1.21 CC1CCC(CC1Br)C(C)=C Amb24402941 [0,0,1,0,0,0|1,0,0]=2 126 B11R1.21 CC1CCC(CC1N)C(N)=O Amb18182132 [0,0,1,0,0,0|3,0,0]=4 127 B11R1.21 CC1CCC(CC1N)C(O)=O Amb25065260 [0,0,1,0,0,0|3,0,0]=4 128 B11R1.21 CC1CCN(CC1Br)C(C)=O Amb25831663 [0,0,1,0,0,0|3,0,0]=4 129 B11R1.21 CC1CCN(CC1O)C(N)=O Amb24334880 [0,0,1,0,0,0|3,0,0]=4 130 B11R1.21 CC1CCN(CC1O)S(C)=O Amb25177307 [0,0,1,0,0,0|3,0,0]=4 131 B11R1.21 CC1CC[C@@H](C[C@@H]1O)C(C)=C Amb25205063 [0,0,1,0,0,0|0,0,0]=1 132 B11R1.21 CC1CC[C@H](CC1O)C(C)=C Amb24685203 [0,0,1,0,0,0|0,0,0]=1 133 B11R1.21 CC=1CC(CCC1C)C(C)=C Amb25258161 [0,0,1,0,0,0|1,0,2]=4 134 B11R1.21 CC=1CCC(CC1O)C(C)=C Amb25027858 [0,0,1,0,0,0|0,0,2]=3 135 B11R1.21 C[C@@H]1C=C[C@H](C[C@H]1O)C(C)=C Amb25261899 [0,0,1,0,0,0|0,0,2]=3 136 B11R1.21 C[C@@H]1CC[C@@H](CC1O)C(C)=C Amb24733230 [0,0,1,0,0,0|0,0,0]=1 137 B11R1.21 C[C@@H]1CC[C@H](CC1O)C(O)=O Amb24677766 [0,0,1,0,0,0|2,0,0]=3 138 B11R1.21 C[C@@H]1CC[C@H](C[C@@H]1O)C(C)=C Amb18511849 [0,0,1,0,0,0|0,0,0]=1 139 B11R1.21 C[C@@H]1CC[C@H](C[C@H]1O)C(C)=C Amb22352956 [0,0,1,0,0,0|0,0,0]=1 140 B11R1.21 C[C@@H]1CC[C@H](C[C@H]1O)C(O)=O Amb24692813 [0,0,1,0,0,0|2,0,0]=3 141 B11R1.21 C[C@@H]1C[C@@H](CC[C@H]1C)C(C)=O Amb25205729 [0,0,1,0,0,0|2,0,0]=3 142 B11R1.21 C[C@H]1C=C[C@@H](C[C@H]1O)C(C)=C Amb25317501 [0,0,1,0,0,0|0,0,2]=3 143 B11R1.21 C[C@H]1CC[C@@H](CC1O)C(C)=C Amb24620931 [0,0,1,0,0,0|0,0,0]=1 144 B11R1.21 C[C@H]1CC[C@@H](C[C@@H]1O)C(C)=C Amb22232072 [0,0,1,0,0,0|0,0,0]=1 145 B11R1.21 C[C@H]1CC[C@@H](C[C@H]1N)C(C)=C Amb25257965 [0,0,1,0,0,0|1,0,0]=2 146 B11R1.21 C[C@H]1CC[C@@H](C[C@H]1O)C(C)=C Amb24674382 [0,0,1,0,0,0|0,0,0]=1 147 B11R1.21 C[C@H]1CC[C@H](C[C@H]1O)C(C)=C Amb25306533 [0,0,1,0,0,0|0,0,0]=1 148 B11R1.21 NC1CCC(CC1O)C(N)=O Amb24732261 [0,0,1,0,0,0|3,0,0]=4 149 B11R1.21 N[C@@H]1CC[C@H](C[C@H]1O)C(N)=O Amb24631873 [0,0,1,0,0,0|3,0,0]=4 150 B11R1.21 OC1CC(CCC1Cl)C(O)=O Amb24484624 [0,0,1,0,0,0|3,0,0]=4 151 B11R1.21 OC1CC(CCC1O)C(O)=O Amb25701852 [0,0,1,0,0,0|3,0,0]=4 152 B11R1.21 O[C@H]1C[C@@H](CC[C@@H]1Cl)C(O)=O Amb24519210 [0,0,1,0,0,0|3,0,0]=4 153 B11R1.565 CC(=C)C1CCC(O)CCC1 Amb25149610 [0,0,1,0,0,0|2,0,0]=3 154 B11R1.565 CC(=C)C1CCCC(=O)CC1 Amb24378945 [0,0,1,0,0,0|2,0,1]=4 155 B11R1.565 CC(C)C1CCOC(C)CN1 Amb25151833 [0,0,1,0,0,0|1,0,2]=4 156 B11R1.565 CC1CCC(CCC1)C(C)Br Amb24673059 [0,0,1,0,0,0|2,0,1]=4 157 B11R1.565 CC1CCC(CCC1)C(C)Cl Amb24371587 [0,0,1,0,0,0|2,0,1]=4 158 B11R1.565 CC1CCC(CCC1)C(C)N Amb24737222 [0,0,1,0,0,0|2,0,1]=4 159 B11R1.565 CC1CCC(CCC1)C(C)O Amb25355473 [0,0,1,0,0,0|2,0,1]=4 160 B11R1.565 CC1CCCC(CC1)C(O)=O Amb24487583 [0,0,1,0,0,0|3,0,0]=4 161 B11R1.565 CC1CCCN(CC1)C(C)=N Amb24477542 [0,0,1,0,0,0|3,0,0]=4 162 B11R1.565 CC1NCCN(CC1)C(=O)C Amb17578147 [0,0,1,0,0,0|3,0,0]=4 163 B11R1.565 C[C@@H]1CCC(CCN1)C(C)=C Amb25685407 [0,0,1,0,0,0|1,0,0]=2 164 B11R1.727 CC(=C)C1CCC(CC1)(C)O Amb17593867 [0,0,1,0,0,0|0,0,0]=1 165 B11R1.727 CC(=C)[C@@H]1CCC(C)(O)C=C1 Amb22745479 [0,0,1,0,0,0|0,0,2]=3 166 B11R1.727 CC(=C)[C@@H]1CC[C@@](C)(O)C=C1 Amb24745526 [0,0,1,0,0,0|0,0,2]=3 167 B11R1.727 CC(=C)[C@@H]1CC[C@](C=C1)(C)O Amb16231165 [0,0,1,0,0,0|0,0,2]=3 168 B11R1.727 CC(=C1CCC(CC1)(C)O)C Amb17593868 [0,0,1,0,0,0|0,0,2]=3 169 B11R1.727 CC(=O)C1CCC(C)(O)CC1 Amb24486267 [0,0,1,0,0,0|1,0,0]=2 170 B11R1.727 CC(=O)C1CCC(CC1)(N)O Amb16233808 [0,0,1,0,0,0|2,0,0]=3 171 B11R1.727 CC(=O)C1CCC(F)(F)CC1 Amb23412174 [0,0,1,0,0,0|3,0,0]=4 172 B11R1.727 CC(=O)N1CCC(C)(F)CC1 Amb25114419 [0,0,1,0,0,0|3,0,0]=4 173 B11R1.727 CC(=O)[C@@H]1CC[C@](C)(N)CC1 Amb25255660 [0,0,1,0,0,0|2,0,0]=3 174 B11R1.727 CC(C)C1CCC(C)(N)CC1 Amb18948128 [0,0,1,0,0,0|1,0,2]=4 175 B11R1.727 CC(C)C1CCC(C)(O)CC1 Amb18182150 [0,0,1,0,0,0|0,0,2]=3 176 B11R1.727 CC(C)N1CCC(C)(O)CC1 Amb18179760 [0,0,1,0,0,0|1,0,2]=4 177 B11R1.727 CC(Cl)C1CCC(C)(C)CC1 Amb24594039 [0,0,1,0,0,0|2,0,1]=4 178 B11R1.727 CC(Cl)C1CCC(C)(Cl)CC1 Amb24602475 [0,0,1,0,0,0|2,0,1]=4 179 B11R1.727 CC(N)C1CCC(C)(O)CC1 Amb25238542 [0,0,1,0,0,0|1,0,1]=3 180 B11R1.727 CC(O)C1CCC(C)(C)CC1 Amb25343086 [0,0,1,0,0,0|2,0,1]=4 181 B11R1.727 CC1(C)CCC(CC1)C(N)=N Amb25698704 [0,0,1,0,0,0|3,0,0]=4 182 B11R1.727 CC1(C)CCC(CC1)C(N)=O Amb24538173 [0,0,1,0,0,0|3,0,0]=4 183 B11R1.727 CC1(C)CCC(CC1)C(N)=S Amb24538149 [0,0,1,0,0,0|3,0,0]=4 184 B11R1.727 CC1(C)CCC(CC1)C(O)=O Amb18644844 [0,0,1,0,0,0|3,0,0]=4 185 B11R1.727 CC1(Cl)CCC(CC1)C(O)=O Amb18648011 [0,0,1,0,0,0|3,0,0]=4 186 B11R1.727 CN(C)C1CCC(C)(C)CC1 Amb24393591 [0,0,1,0,0,0|2,0,1]=4 187 B11R1.727 CN(N)C1CCC(C)(C)CC1 Amb25766149 [0,0,1,0,0,0|3,0,0]=4 188 B11R1.727 C[C@@H](N)C1CCC(C)(C)CC1 Amb24471238 [0,0,1,0,0,0|2,0,1]=4 189 B11R1.727 C[C@@H](O)C1CCC(C)(C)CC1 Amb24384674 [0,0,1,0,0,0|2,0,1]=4 190 B11R1.727 C[C@H](N)C1CCC(C)(C)CC1 Amb24593090 [0,0,1,0,0,0|2,0,1]=4 191 B11R1.727 C[C@H](O)C1CCC(C)(C)CC1 Amb24447339 [0,0,1,0,0,0|2,0,1]=4 192 B11R1.727 C[C@]1(O)CC[C@H](CC1)C(O)=O Amb25059131 [0,0,1,0,0,0|2,0,0]=3 193 B11R1.1044 CC(=O)CC[C@@H]1O[C@@]1(C)CO Amb24766737 [0,0,1,0,0,0|2,0,0]=3 194 B11R1.1044 CC(C)=CCC1OC1(C)CO Amb25284516 [0,0,1,0,0,0|1,0,2]=4 195 B11R1.1111 CC(C)C(O)CC1OC1(C)C Amb25763947 [0,0,1,0,0,0|1,0,2]=4 196 B11R1.1111 CC(C)[C@@H](O)C[C@@H]1OC1(C)C Amb25206622 [0,0,1,0,0,0|1,0,2]=4 197 B11R1.1111 CC(C)[C@H](O)C[C@@H]1OC1(C)C Amb24520276 [0,0,1,0,0,0|1,0,2]=4 198 B13R3.20538 CC1(C)[C@H]2C[C@@H]1C[C@H]3O[C@]32C Amb25289541 [0,0,0,1,0,0|0,0,2]=3 199 B13R3.20538 CC12OC1CC3CC2C3(C)C Amb17844470 [0,0,0,1,0,0|0,0,2]=3 200 B10R1.13 C=C1CCC(CC1)C(=C)C Amb10845321 [1,0,1,0,0,0|0,0,2]=4 201 B10R1.13 CC(=C)C1OCC(O)CO1 Amb25842582 [1,0,1,0,0,0|2,0,0]=4 202 B10R1.13 CC(=C)C=1CCC(C)CC1 Amb24364313 [1,0,1,0,0,0|0,0,2]=4 203 B10R1.13 CC(=C)N1CCC(Cl)CC1 Amb25060764 [1,0,1,0,0,0|2,0,0]=4 204 B10R1.13 CC(=N)N1CCC(O)CC1 Amb24099462 [1,0,1,0,0,0|2,0,0]=4 205 B10R1.13 CC(=O)C1CCC(Cl)CC1 Amb24433457 [1,0,1,0,0,0|2,0,0]=4 206 B10R1.13 CC(=O)C1CCC(F)CC1 Amb25127678 [1,0,1,0,0,0|2,0,0]=4 207 B10R1.13 CC(=O)C1CCN(C)CC1 Amb22756855 [1,0,1,0,0,0|2,0,0]=4 208 B10R1.13 CC(=O)C1CCN(O)CC1 Amb25134063 [1,0,1,0,0,0|2,0,0]=4 209 B10R1.13 CC(=O)[C@H]1CC[C@@H](O)CC1 Amb24689931 [1,0,1,0,0,0|1,0,0]=3 210 B10R1.13 CC(C)=C1CCC(O)CC1 Amb24482530 [1,0,1,0,0,0|0,0,2]=4 211 B10R1.13 CC(C)[C@@H]1CC[C@@H](C)CC1 Amb22231657 [1,0,1,0,0,0|0,0,2]=4 212 B10R1.13 CC(C)[C@@H]1CC[C@H](C)CC1 Amb22230417 [1,0,1,0,0,0|0,0,2]=4 213 B10R1.13 CC(O)C1CCC(O)CC1 Amb25741333 [1,0,1,0,0,0|1,0,1]=4 214 B10R1.13 CC(O)[C@@H]1CC[C@H](O)CC1 Amb25234713 [1,0,1,0,0,0|1,0,1]=4 215 B10R1.13 CC1CCC(CC1)C(C)=C Amb25340292 [1,0,1,0,0,0|0,0,0]=2 216 B10R1.13 CC1CCC(CC1)C(C)=O Amb24518062 [1,0,1,0,0,0|1,0,0]=3 217 B10R1.13 CC1CCC(CC1)C(C)Cl Amb24463515 [1,0,1,0,0,0|1,0,1]=4 218 B10R1.13 CC1CCC(CC1)C(C)N Amb18946301 [1,0,1,0,0,0|1,0,1]=4 219 B10R1.13 CC1CCC(CC1)C(N)=N Amb20630201 [1,0,1,0,0,0|2,0,0]=4 220 B10R1.13 CC1CCC(CC1)C(N)=N Amb22059037 [1,0,1,0,0,0|2,0,0]=4 221 B10R1.13 CC1CCC(CC1)C(N)=S Amb18799860 [1,0,1,0,0,0|2,0,0]=4 222 B10R1.13 CC1CCC(CC1)N(C)C Amb10553778 [1,0,1,0,0,0|1,0,1]=4 223 B10R1.13 CC1CCC(CC1)N(C)N Amb24704081 [1,0,1,0,0,0|2,0,0]=4 224 B10R1.13 CC1CCC(CC1)[C@H](C)N Amb25048061 [1,0,1,0,0,0|1,0,1]=4 225 B10R1.13 CC1CCN(CC1)C(C)=S Amb24101091 [1,0,1,0,0,0|2,0,0]=4 226 B10R1.13 CN(C)C1CCC(O)CC1 Amb19958953 [1,0,1,0,0,0|1,0,1]=4 227 B10R1.13 CN(C)[C@@H]1CC[C@@H](O)CC1 Amb22231675 [1,0,1,0,0,0|1,0,1]=4 228 B10R1.13 C[C@@H]1CC[C@@H](CC1)C(=O)O Amb10843977 [1,0,1,0,0,0|2,0,0]=4 229 B10R1.13 C[C@@H]1CC[C@@H](CC1)C(N)=O Amb24385858 [1,0,1,0,0,0|2,0,0]=4 230 B10R1.13 C[C@@H]1CC[C@H](C=C1)C(C)=C Amb22232036 [1,0,1,0,0,0|0,0,2]=4 231 B10R1.13 C[C@@H]1CC[C@H](CC1)C(=O)Cl Amb24052918 [1,0,1,0,0,0|2,0,0]=4 232 B10R1.13 C[C@@H]1CC[C@H](CC1)C(C)=O Amb25093628 [1,0,1,0,0,0|1,0,0]=3 233 B10R1.13 C[C@H]1CC[C@H](CC1)C(C)=O Amb24505101 [1,0,1,0,0,0|1,0,0]=3 234 B10R1.13 NC(=O)[C@@H]1CC[C@@H](O)CC1 Amb24351197 [1,0,1,0,0,0|2,0,0]=4 235 B10R1.13 OC1CCC(CC1)C(=O)Cl Amb21961740 [1,0,1,0,0,0|2,0,0]=4 236 B10R1.13 OC1CCC(CC1)C(=O)N Amb13951716 [1,0,1,0,0,0|2,0,0]=4 237 B10R1.13 O[C@@H]1CC[C@@H](CC1)C(=O)Cl Amb24541595 [1,0,1,0,0,0|2,0,0]=4 238 B10R1.13 O[C@@H]1CC[C@@H](CC1)N(C)C Amb10072128 [1,0,1,0,0,0|1,0,1]=4 239 B10R1.13 O[C@@H]1CC[C@H](CC1)C(O)=O Amb22387641 [1,0,1,0,0,0|2,0,0]=4 240 B10R1.13 O[C@H]1CC[C@H](CC1)C(O)=O Amb22387642 [1,0,1,0,0,0|2,0,0]=4 241 B10R1.113 CC(=O)C1CCCC(O)C1 Amb25859196 [1,0,1,0,0,0|1,0,0]=3 242 B10R1.113 CC(=O)C1CCCC(O)O1 Amb25295371 [1,0,1,0,0,0|2,0,0]=4 243 B10R1.113 CC(=O)N1C[C@@H](O)CCC1 Amb22227529 [1,0,1,0,0,0|2,0,0]=4 244 B10R1.113 CC(=O)N1C[C@H](O)CCC1 Amb22227493 [1,0,1,0,0,0|2,0,0]=4 245 B10R1.113 CC(=O)[C@@H]1CCC[C@@H](O)C1 Amb24533315 [1,0,1,0,0,0|1,0,0]=3 246 B10R1.113 CC(C)=C1CC(O)CCC1 Amb25296421 [1,0,1,0,0,0|0,0,2]=4 247 B10R1.113 CC(C)C1CC(O)CCC1 Amb25684558 [1,0,1,0,0,0|0,0,2]=4 248 B10R1.113 CC(C)[C@@H]1C[C@@H](O)CCC1 Amb24666651 [1,0,1,0,0,0|0,0,2]=4 249 B10R1.113 CC(C)[C@@H]1C[C@H](O)CCC1 Amb25176279 [1,0,1,0,0,0|0,0,2]=4 250 B10R1.113 CC(C)[C@H]1C[C@@H](O)CCC1 Amb24592029 [1,0,1,0,0,0|0,0,2]=4 251 B10R1.113 CC1CCCC(C1)C(C)=O Amb24505220 [1,0,1,0,0,0|2,0,0]=4 252 B10R1.113 CN(C)[C@@H]1CCC[C@@H](O)C1 Amb24539907 [1,0,1,0,0,0|1,0,1]=4 253 B10R1.113 C[C@@H]1CCCC(C1)C(C)=O Amb25358902 [1,0,1,0,0,0|2,0,0]=4 254 B10R1.113 C[C@@H]1CCC[C@H](C1)C(C)=O Amb24736673 [1,0,1,0,0,0|2,0,0]=4 255 B10R1.113 NC(=N)C1CCCC(O)C1 Amb25239432 [1,0,1,0,0,0|2,0,0]=4 256 B10R1.113 NC(=O)C1CCCC(O)C1 Amb25067304 [1,0,1,0,0,0|2,0,0]=4 257 B10R1.113 O=C1CCCC(C1)C(=C)C Amb17593503 [1,0,1,0,0,0|0,0,2]=4 258 B10R1.113 OC1CCCC(C1)C(O)=O Amb18644123 [1,0,1,0,0,0|2,0,0]=4 259 B10R1.113 O[C@@H]1CCC[C@@H](C1)C(O)=O Amb22899465 [1,0,1,0,0,0|2,0,0]=4 260 B10R1.113 O[C@@H]1CCC[C@H](C1)C(O)=O Amb22899464 [1,0,1,0,0,0|2,0,0]=4 261 B10R1.113 O[C@H]1CCC[C@@H](C1)C(O)=O Amb24546990 [1,0,1,0,0,0|2,0,0]=4 262 B10R1.176 C=CC1CC(Cl)C(Cl)CC1 Amb25287775 [1,0,1,0,0,0|2,0,0]=4 263 B10R1.176 C=CC1CCC(N)C(O)C1 Amb22902728 [1,0,1,0,0,0|1,0,0]=3 264 B10R1.176 C=CC1CCC(O)C(N)C1 Amb25313426 [1,0,1,0,0,0|2,0,0]=4 265 B10R1.176 C=CC1C[C@@H](O)[C@H](O)CC1 Amb25262828 [1,0,1,0,0,0|1,0,0]=3 266 B10R1.176 CC1CCN(CC1O)CC Amb24397109 [1,0,1,0,0,0|1,0,1]=4 267 B10R1.176 CCC1CC(O)C(O)CC1 Amb25191959 [1,0,1,0,0,0|1,0,1]=4 268 B10R1.176 CNC1CC(C)C(C)CC1 Amb24702379 [1,0,1,0,0,0|2,0,0]=4 269 B10R1.176 OC1CC(CCC1Cl)C=O Amb25291367 [1,0,1,0,0,0|2,0,0]=4 270 B10R1.176 O[C@@H]1CC(CCC1Cl)C=O Amb24482264 [1,0,1,0,0,0|2,0,0]=4 271 B10R1.197 CC1OCCC(CO1)C=O Amb24364233 [1,0,1,0,0,0|2,0,0]=4 272 B10R1.348 CC(=C)C1CCCNCC1 Amb25358166 [1,0,1,0,0,0|1,0,0]=3 273 B10R1.348 CC(=O)C1CCCCCC1 Amb24407172 [1,0,1,0,0,0|2,0,0]=4 274 B10R1.348 CC(Br)C1CCOCCC1 Amb25204230 [1,0,1,0,0,0|1,0,1]=4 275 B10R1.348 NC(=O)C1CCCOCC1 Amb24629965 [1,0,1,0,0,0|2,0,0]=4 276 B10R1.348 OC(=O)C1CCCOCC1 Amb18831505 [1,0,1,0,0,0|2,0,0]=4 277 B10R1.73 CC1CC1CNCC(C)=C Amb25147717 [1,0,1,0,0,0|2,0,0]=4 278 B10R1.350 CC(=C)CCNC1(C)CC1 Amb25204819 [1,0,1,0,0,0|2,0,0]=4 279 B10R1.350 CC(=C)CNCC1(C)CC1 Amb24359374 [1,0,1,0,0,0|2,0,0]=4 280 B10R1.26 CC1(C)CCC(CC1)C=C Amb25845509 [1,0,1,0,0,0|1,0,0]=3 281 B10R1.26 CC1(C)CCC(CC1)C=O Amb20669516 [1,0,1,0,0,0|2,0,0]=4 282 B10R1.26 CC1(O)CCC(CN)CC1 Amb18644017 [1,0,1,0,0,0|1,0,1]=4 283 B10R1.26 CC1(O)CCN(CC1)C=O Amb24340154 [1,0,1,0,0,0|2,0,0]=4 284 B10R1.26 CNC1CCC(C)(C)CC1 Amb20667929 [1,0,1,0,0,0|2,0,0]=4 285 B10R1.26 CNC1CCC(C)(O)CC1 Amb24478862 [1,0,1,0,0,0|1,0,0]=3 286 B10R1.26 CSC1CCC(C)(C)CC1 Amb24509196 [1,0,1,0,0,0|2,0,0]=4 287 B10R1.152 CC(C=C)NCC1(C)CC1 Amb24394076 [1,0,1,0,0,0|2,0,0]=4 288 B10R1.205 CC(=C)C(N)CCC1CC1 Amb25299618 [1,0,1,0,0,0|2,0,0]=4 289 B10R1.145 CC1(CO)OC1CCC=C Amb25831833 [1,0,1,0,0,0|1,0,0]=3 290 B10R1.145 C[C@@]1(CO)O[C@@H]1CCC=C Amb25205033 [1,0,1,0,0,0|1,0,0]=3 291 B10R1.145 C[C@]1(CO)O[C@H]1CCC=C Amb24581808 [1,0,1,0,0,0|1,0,0]=3 292 B10R1.156 CC[C@@H]1O[C@H]1CCC(C)=O Amb25179266 [1,0,1,0,0,0|1,0,0]=3 293 B10R1.156 CC[C@H]1O[C@H]1CCC(C)=O Amb25179391 [1,0,1,0,0,0|1,0,0]=3 294 B10R1.352 CC(=C)CNC1CC1(C)C Amb18988477 [1,0,1,0,0,0|2,0,0]=4 295 B10R1.352 CC(=O)CCC1CC1(C)C Amb24380872 [1,0,1,0,0,0|2,0,0]=4 296 B10R1.352 CC(=O)CCC1SC1(C)C Amb24478275 [1,0,1,0,0,0|1,1,0]=4 297 B10R1.352 CC(=O)CC[C@@H]1OC1(C)C Amb25146563 [1,0,1,0,0,0|1,0,0]=3 298 B10R1.352 CC(=O)OCC1OC1(C)C Amb24117529 [1,0,1,0,0,0|2,0,0]=4 299 B10R1.352 CC(Br)CCC1OC1(C)C Amb25756157 [1,0,1,0,0,0|1,0,1]=4 300 B10R1.428 CC1(C)O[C@H]1C[C@H](O)C=C Amb24560971 [1,0,1,0,0,0|1,0,0]=3 301 B10R2.109 CCC1CCC2C(C1)O2 Amb1128069 [2,0,0,0,0,0|0,0,1]=3 302 B10R2.109 CCN1CC2OC2CC1 Amb23557984 [2,0,0,0,0,0|1,0,1]=4 303 B10R2.109 CNC1CC2CC2CC1 Amb25756132 [2,0,0,0,0,0|2,0,0]=4 304 B10R2.109 CNC1CC2OC2CC1 Amb24674159 [2,0,0,0,0,0|1,0,0]=3 305 B10R2.109 CN[C@@H]1C[C@@H]2O[C@@H]2CC1 Amb24567377 [2,0,0,0,0,0|1,0,0]=3 306 B10R2.109 CN[C@H]1C[C@@H]2O[C@@H]2CC1 Amb24760697 [2,0,0,0,0,0|1,0,0]=3 307 B10R2.109 C\C=C\1/CC2OC2CC1 Amb25163718 [2,0,0,0,0,0|0,0,1]=3 308 B10R2.109 N#CC1CC2OC2CC1 Amb25251832 [2,0,0,0,0,0|1,0,1]=4 309 B10R2.109 NCC1CC2OC2CC1 Amb24477691 [2,0,0,0,0,0|1,0,1]=4 310 B10R2.328 CC12CCC(=O)CC1O2 Amb25101686 [2,0,0,0,0,0|1,0,1]=4 311 B10R2.328 CC12CC[C@H](O)CC1O2 Amb25215672 [2,0,0,0,0,0|1,0,0]=3 312 B10R2.328 CN1CC2OC2(C)CC1 Amb23455356 [2,0,0,0,0,0|1,0,0]=3 313 B10R2.328 C[C@]12CCC(O)C[C@H]1O2 Amb25256150 [2,0,0,0,0,0|1,0,0]=3 314 B12R1.22 CC1CCC(CC1(C)O)C(C)=C Amb17778034 [0,1,1,0,0,0|0,0,0]=2 315 B12R1.22 CC1CCC(CC1(C)O)C(C)=O Amb24378481 [0,1,1,0,0,0|1,0,0]=3 316 B12R1.23 CC1CCC(CC1O)C(C)(C)C Amb25792461 [0,1,1,0,0,0|0,0,2]=4 317 B12R1.23 CC1CCC(CC1O)C(O)(C)C Amb2232672 [0,1,1,0,0,0|0,0,2]=4 318 B12R1.23 C[C@@H]1CC[C@H](C[C@H]1O)C(C)(C)C Amb25176488 [0,1,1,0,0,0|0,0,2]=4 319 B12R1.23 C[C@H]1CC[C@H](C[C@H]1O)C(C)(C)C Amb24544321 [0,1,1,0,0,0|0,0,2]=4 320 B12R1.48 CC(=O)N1CC(O)C(CC1)CO Amb24420552 [0,1,1,0,0,0|2,0,0]=4 321 B12R1.48 CC(=O)N1CCC(CBr)C(O)C1 Amb24694629 [0,1,1,0,0,0|2,0,0]=4 322 B12R1.56 CC(=C)C1CC(CO)C(=C)CC1 Amb24524816 [0,1,1,0,0,0|0,0,2]=4 323 B12R1.56 CC(=C)[C@@H]1C[C@H](OC)C(=O)CC1 Amb24512627 [0,1,1,0,0,0|1,0,1]=4 324 B12R1.56 CC1CCC(CC1C=O)C(C)=C Amb24382713 [0,1,1,0,0,0|0,0,1]=3 325 B12R1.56 CC1CCC(CC1NC)C(C)=C Amb24419798 [0,1,1,0,0,0|1,0,0]=3 326 B12R1.56 CC1CC[C@@H](CC1NC)C(C)=C Amb25760802 [0,1,1,0,0,0|1,0,0]=3 327 B12R1.56 CC1CC[C@H](CC1NC)C(C)=C Amb25667248 [0,1,1,0,0,0|1,0,0]=3 328 B12R1.56 C[C@H]1CC[C@@H](C[C@H]1CO)C(C)=C Amb24559797 [0,1,1,0,0,0|0,0,0]=2 329 B12R1.232 CC(=C)C1CC(=O)C(C)CC1O Amb24646678 [0,1,1,0,0,0|0,0,2]=4 330 B12R1.232 CC(=C)[C@H]1CC(=O)[C@H](C)C[C@H]1O Amb24577806 [0,1,1,0,0,0|0,0,2]=4 331 B12R1.232 CC(C)C1CC(O)C(C)CC1O Amb24718492 [0,1,1,0,0,0|0,0,2]=4 332 B12R1.232 CC(C)[C@@H]1C[C@@H](O)[C@@H](C)C[C@H]1O Amb24675279 [0,1,1,0,0,0|0,0,2]=4 333 B12R1.232 CC(C)[C@@H]1C[C@H](O)[C@@H](C)C[C@@H]1O Amb25220916 [0,1,1,0,0,0|0,0,2]=4 334 B12R1.232 CC(C)[C@@H]1C[C@H](O)[C@@H](C)C[C@H]1O Amb24618741 [0,1,1,0,0,0|0,0,2]=4 335 B12R1.232 CC(C)[C@H]1C[C@@H](O)[C@@H](C)C[C@@H]1O Amb24519921 [0,1,1,0,0,0|0,0,2]=4 336 B12R1.232 CC(C)[C@H]1C[C@H](O)[C@H](C)C[C@@H]1O Amb25176447 [0,1,1,0,0,0|0,0,2]=4 337 B12R1.232 CC(C)[C@H]1C[C@H](O)[C@H](C)C[C@H]1O Amb25332448 [0,1,1,0,0,0|0,0,2]=4 338 B12R1.232 CC1CC(O)C(CC1O)C(C)=C Amb25852880 [0,1,1,0,0,0|0,0,0]=2 339 B12R1.232 C[C@@H]1C[C@@H](O)[C@H](C[C@@H]1O)C(C)=C Amb25236581 [0,1,1,0,0,0|0,0,0]=2 340 B12R1.367 CC(CO)C1CC(O)C(C)CC1 Amb21618966 [0,1,1,0,0,0|0,0,2]=4 341 B12R1.367 CC(CO)[C@@H]1C[C@H](O)[C@@H](C)CC1 Amb24555495 [0,1,1,0,0,0|0,0,2]=4 342 B12R1.367 CC(CO)[C@H]1C[C@H](O)[C@H](C)CC1 Amb24748620 [0,1,1,0,0,0|0,0,2]=4 343 B12R1.367 CC1=CCC(CC1O)C(=C)CO Amb25192023 [0,1,1,0,0,0|0,0,2]=4 344 B12R1.367 CC1CC(CCC1C)C(=O)CN Amb24446654 [0,1,1,0,0,0|2,0,0]=4 345 B12R1.367 CC1CCC(CC1N)C(=C)CO Amb25799042 [0,1,1,0,0,0|1,0,0]=3 346 B12R1.367 CC1CCC(CC1N)C(=O)NC Amb18801993 [0,1,1,0,0,0|2,0,0]=4 347 B12R1.367 CC1CCC(CC1N)\C(\C)=N\O Amb25152390 [0,1,1,0,0,0|2,0,0]=4 348 B12R1.367 CC1CCC(CC1O)C(C)=NO Amb25158190 [0,1,1,0,0,0|1,0,0]=3 349 B12R1.367 CC1CCC(CC1O)C(C)C=O Amb25263598 [0,1,1,0,0,0|0,0,1]=3 350 B12R1.367 CC1CCN(CC1O)C(=O)CBr Amb24698140 [0,1,1,0,0,0|2,0,0]=4 351 B12R1.367 CC1CCN(CC1O)C(=O)CCl Amb25314804 [0,1,1,0,0,0|2,0,0]=4 352 B12R1.367 CC1CCN(CC1O)C(=O)CN Amb25302486 [0,1,1,0,0,0|2,0,0]=4 353 B12R1.367 CC1CCN(CC1O)C(=O)CS Amb25682289 [0,1,1,0,0,0|2,0,0]=4 354 B12R1.367 CC1CCN(CC1O)C(=O)OC Amb24358426 [0,1,1,0,0,0|2,0,0]=4 355 B12R1.367 CC1CCN(CC1O)C(=S)NC Amb24525523 [0,1,1,0,0,0|2,0,0]=4 356 B12R1.367 CC1CC[C@@H](CC1O)[C@@H](C)C=C Amb25235740 [0,1,1,0,0,0|0,0,1]=3 357 B12R1.367 CC1CC[C@@H](CC1O)[C@H](C)C=C Amb25234347 [0,1,1,0,0,0|0,0,1]=3 358 B12R1.367 CCC(=O)C1CC(C)C(C)CC1 Amb25313729 [0,1,1,0,0,0|2,0,0]=4 359 B12R1.367 COC(=O)C1CC(C)C(C)CC1 Amb25738158 [0,1,1,0,0,0|2,0,0]=4 360 B12R1.367 COC(=O)C1CCC(N)C(O)C1 Amb25732008 [0,1,1,0,0,0|2,0,0]=4 361 B12R1.367 COC(=O)C1C[C@@H](O)[C@H](O)CC1 Amb25257188 [0,1,1,0,0,0|2,0,0]=4 362 B12R1.367 C[C@@H](CO)[C@H]1C[C@H](O)[C@H](C)CC1 Amb25206640 [0,1,1,0,0,0|0,0,2]=4 363 B12R1.367 C[C@H]1CC[C@@H](C[C@H]1O)C(C)C=O Amb25302380 [0,1,1,0,0,0|0,0,1]=3 364 B12R1.893 CC(=C)C1CCC(C)C(=O)C1O Amb25353389 [0,1,1,0,0,0|0,0,2]=4 365 B12R1.893 CC(=C)[C@@H]1CC[C@@H](C)C(=O)[C@@H]1C Amb24621675 [0,1,1,0,0,0|0,0,2]=4 366 B12R1.893 CC(=C)[C@@H]1CC[C@H](C)C(=O)[C@H]1C Amb24752495 [0,1,1,0,0,0|0,0,2]=4 367 B12R1.893 CC(=C)[C@H]1CC[C@H](C)C(=O)[C@@H]1O Amb24617347 [0,1,1,0,0,0|0,0,2]=4 368 B12R1.893 CC(C)=C1CCC(C)C(O)C1O Amb25680494 [0,1,1,0,0,0|0,0,2]=4 369 B12R1.893 CC(C)C1CCC(C)C(O)C1Cl Amb25159651 [0,1,1,0,0,0|0,0,2]=4 370 B12R1.893 CC(C)[C@@H]1CC[C@@H](C)C(O)C1O Amb24592554 [0,1,1,0,0,0|0,0,2]=4 371 B12R1.893 CC(C)[C@@H]1CC[C@@H](C)[C@@H](O)[C@H]1O Amb25299279 [0,1,1,0,0,0|0,0,2]=4 372 B12R1.893 CC(C)[C@@H]1CC[C@@H](C)[C@H](O)[C@@H]1O Amb24743365 [0,1,1,0,0,0|0,0,2]=4 373 B12R1.893 CC(C)[C@@H]1CC[C@@H](C)[C@H](O)[C@H]1O Amb25174923 [0,1,1,0,0,0|0,0,2]=4 374 B12R1.893 CC(C)[C@H]1CC[C@@H](C)[C@H](O)[C@H]1O Amb24592083 [0,1,1,0,0,0|0,0,2]=4 375 B12R1.893 CC(C)[C@H]1CC[C@H](C)[C@H](O)[C@H]1O Amb24519832 [0,1,1,0,0,0|0,0,2]=4 376 B12R1.893 CC1=CCC(C(O)C1O)C(C)=C Amb24398050 [0,1,1,0,0,0|0,0,2]=4 377 B12R1.893 CC1=CC[C@@H]([C@@H](O)[C@@H]1O)C(C)=C Amb25366600 [0,1,1,0,0,0|0,0,2]=4 378 B12R1.893 CC1=CC[C@@H]([C@H](O)[C@H]1O)C(C)=C Amb24519790 [0,1,1,0,0,0|0,0,2]=4 379 B12R1.893 CC1=CC[C@H](C(O)C1O)C(C)=C Amb25333522 [0,1,1,0,0,0|0,0,2]=4 380 B12R1.893 CC1=CC[C@H]([C@@H](O)[C@@H]1O)C(C)=C Amb24674381 [0,1,1,0,0,0|0,0,2]=4 381 B12R1.893 CC1=CC[C@H]([C@@H](O)[C@H]1O)C(C)=C Amb25208980 [0,1,1,0,0,0|0,0,2]=4 382 B12R1.893 CC1=CC[C@H]([C@H](O)[C@H]1O)C(C)=C Amb25208979 [0,1,1,0,0,0|0,0,2]=4 383 B12R1.893 CC1C(O)C(C)=CCC1C(C)=C Amb24613413 [0,1,1,0,0,0|0,0,2]=4 384 B12R1.893 C[C@@H]1CC[C@H]([C@H](O)[C@@H]1O)C(C)=C Amb24674277 [0,1,1,0,0,0|0,0,0]=2 385 B12R1.1005 CC(=C)[C@@H]1C[C@@H](C)[C@@H](C)C(=O)C1 Amb25370662 [0,1,1,0,0,0|0,0,2]=4 386 B12R1.1005 CC(=C)[C@@H]1C[C@@H](O)C(C)C(=O)C1 Amb24690668 [0,1,1,0,0,0|0,0,1]=3 387 B12R1.1005 CC(=C)[C@@H]1C[C@@H](O)[C@H](C)C(=O)C1 Amb24551495 [0,1,1,0,0,0|0,0,1]=3 388 B12R1.1005 CC(=C)[C@H]1CC(C)=C(C)[C@@H](O)C1 Amb24596391 [0,1,1,0,0,0|0,0,2]=4 389 B12R1.1005 CC(=C)[C@H]1CC(C)C(C)C(=O)C1 Amb25350025 [0,1,1,0,0,0|0,0,2]=4 390 B12R1.1005 CC(=C)[C@H]1C[C@H](O)C(=C)[C@H](O)C1 Amb25158035 [0,1,1,0,0,0|0,0,2]=4 391 B12R1.1005 CC(=C)[C@H]1C[C@H](O)C(C)C(=O)C1 Amb24577792 [0,1,1,0,0,0|0,0,1]=3 392 B12R1.1005 CC(=C)[C@H]1C[C@H](O)[C@@H](C)C(=O)C1 Amb25320016 [0,1,1,0,0,0|0,0,1]=3 393 B12R1.1005 CC(=O)[C@@H]1C[C@@H](O)[C@@H](C)C(=O)C1 Amb24602962 [0,1,1,0,0,0|1,0,1]=4 394 B12R1.1005 CC(C)C1CC(O)C(C)C(C)C1 Amb25222241 [0,1,1,0,0,0|0,0,2]=4 395 B12R1.1005 CC(C)[C@@H]1CC(O)C(C)C(C)C1 Amb25741363 [0,1,1,0,0,0|0,0,2]=4 396 B12R1.1005 CC1C(N)CC(CC1N)C(C)=C Amb24537829 [0,1,1,0,0,0|1,0,0]=3 397 B12R1.1005 CC1C(O)CC(CC1O)C(O)=O Amb25122173 [0,1,1,0,0,0|2,0,0]=4 398 B12R1.1005 C[C@H]1[C@@H](O)C[C@@H](C[C@@H]1O)C(C)=C Amb25215438 [0,1,1,0,0,0|0,0,0]=2 399 B12R1.1274 CC(=C)C1CC(=O)C(C)(O)CC1 Amb25370882 [0,1,1,0,0,0|0,0,2]=4 400 B12R1.1274 CC(=C)C1CC(O)C(C)(O)CC1 Amb22168743 [0,1,1,0,0,0|0,0,0]=2 401 B12R1.1274 CC(=C)C1CCC(C)(C)C(O)C1 Amb24430933 [0,1,1,0,0,0|0,0,0]=2 402 B12R1.1274 CC(=C)C1CCC(C)(C)[C@H](O)C1 Amb25333613 [0,1,1,0,0,0|0,0,0]=2 403 B12R1.1274 CC(=C)C1CCC(C)(Cl)C(O)C1 Amb25294509 [0,1,1,0,0,0|0,0,0]=2 404 B12R1.1274 CC(=C)C1CCC(C)(O)C(Cl)C1 Amb25779251 [0,1,1,0,0,0|1,0,0]=3 405 B12R1.1274 CC(=C)C1CCC(C)(S)C(O)C1 Amb25795595 [0,1,1,0,0,0|0,0,0]=2 406 B12R1.1274 CC(=C)C1COC(C)(C)C(O)C1 Amb25817038 [0,1,1,0,0,0|1,0,0]=3 407 B12R1.1274 CC(=C)[C@@H]1CC(=O)[C@@](C)(O)CC1 Amb25179786 [0,1,1,0,0,0|0,0,2]=4 408 B12R1.1274 CC(=C)[C@@H]1CC(O)[C@](C)(O)CC1 Amb25177043 [0,1,1,0,0,0|0,0,0]=2 409 B12R1.1274 CC(=C)[C@@H]1CCC(C)(O)C(Cl)C1 Amb25109286 [0,1,1,0,0,0|1,0,0]=3 410 B12R1.1274 CC(=C)[C@@H]1CCC(C)(O)C(N)C1 Amb24711240 [0,1,1,0,0,0|1,0,0]=3 411 B12R1.1274 CC(=C)[C@@H]1CC[C@@](C)(O)[C@H](N)C1 Amb24107551 [0,1,1,0,0,0|1,0,0]=3 412 B12R1.1274 CC(=C)[C@@H]1CC[C@](C)(O)[C@@H](Cl)C1 Amb24519427 [0,1,1,0,0,0|1,0,0]=3 413 B12R1.1274 CC(=C)[C@@H]1CC[C@](C)(S)[C@H](O)C1 Amb25333409 [0,1,1,0,0,0|0,0,0]=2 414 B12R1.1274 CC(=C)[C@@H]1C[C@@H](Cl)[C@](C)(Cl)CC1 Amb24666696 [0,1,1,0,0,0|1,0,0]=3 415 B12R1.1274 CC(=C)[C@@H]1C[C@@H](O)[C@@](C)(O)CC1 Amb25246233 [0,1,1,0,0,0|0,0,0]=2 416 B12R1.1274 CC(=C)[C@@H]1C[C@H](O)[C@@](C)(O)CC1 Amb24759086 [0,1,1,0,0,0|0,0,0]=2 417 B12R1.1274 CC(=C)[C@@H]1C[C@H](O)[C@](C)(O)CC1 Amb25201621 [0,1,1,0,0,0|0,0,0]=2 418 B12R1.1274 CC(=C)[C@H]1CC(=O)C(C)(O)CC1 Amb24706830 [0,1,1,0,0,0|0,0,2]=4 419 B12R1.1274 CC(=C)[C@H]1CC(=O)[C@@](C)(O)CC1 Amb24686548 [0,1,1,0,0,0|0,0,2]=4 420 B12R1.1274 CC(=C)[C@H]1CC(Cl)C(C)(Cl)CC1 Amb25159251 [0,1,1,0,0,0|1,0,0]=3 421 B12R1.1274 CC(=C)[C@H]1CC[C@@](C)(N)[C@H](O)C1 Amb24606659 [0,1,1,0,0,0|0,0,0]=2 422 B12R1.1274 CC(=C)[C@H]1CC[C@@](C)(O)[C@H](N)C1 Amb25337566 [0,1,1,0,0,0|1,0,0]=3 423 B12R1.1274 CC(=C)[C@H]1CC[C@](C)(O)C(N)C1 Amb25268927 [0,1,1,0,0,0|1,0,0]=3 424 B12R1.1274 CC(=C)[C@H]1COC(C)(C)[C@@H](O)C1 Amb24515553 [0,1,1,0,0,0|1,0,0]=3 425 B12R1.1274 CC(=C)[C@H]1C[C@@H](O)[C@](C)(O)CC1 Amb25176361 [0,1,1,0,0,0|0,0,0]=2 426 B12R1.1274 CC(=C)[C@H]1C[C@H](O)[C@@](C)(O)CC1 Amb22337012 [0,1,1,0,0,0|0,0,0]=2 427 B12R1.1274 CC(=C)[C@H]1C[C@H](O)[C@](C)(O)CC1 Amb24705598 [0,1,1,0,0,0|0,0,0]=2 428 B12R1.1274 CC(=O)C1CCC(C)(C)C(O)C1 Amb25319904 [0,1,1,0,0,0|1,0,0]=3 429 B12R1.1274 CC(=O)C1CCC(C)(C)[C@H](O)C1 Amb25142593 [0,1,1,0,0,0|1,0,0]=3 430 B12R1.1274 CC(C)=C1C[C@@H](O)[C@@](C)(O)CC1 Amb25175266 [0,1,1,0,0,0|0,0,2]=4 431 B12R1.1274 CC(C)=C1C[C@H](O)[C@](C)(O)CC1 Amb25344972 [0,1,1,0,0,0|0,0,2]=4 432 B12R1.1274 CC(C)C1CC(O)C(C)(C)CC1 Amb25332340 [0,1,1,0,0,0|0,0,2]=4 433 B12R1.1274 CC(C)C1CC(O)C(C)(F)CC1 Amb25220928 [0,1,1,0,0,0|0,0,2]=4 434 B12R1.1274 CC(C)C1CC(O)C(C)(O)CC1 Amb24565823 [0,1,1,0,0,0|0,0,2]=4 435 B12R1.1274 CC(C)[C@@H]1CC(O)C(C)(O)CC1 Amb25073140 [0,1,1,0,0,0|0,0,2]=4 436 B12R1.1274 CC(C)[C@@H]1C[C@H](O)[C@@](C)(O)CC1 Amb25381236 [0,1,1,0,0,0|0,0,2]=4 437 B12R1.1274 CC(C)[C@H]1C[C@@H](O)[C@@](C)(O)CC1 Amb25175407 [0,1,1,0,0,0|0,0,2]=4 438 B12R1.1645 CC(=C)C1(C)CC(=O)C(C)CC1 Amb25730279 [0,1,1,0,0,0|0,0,2]=4 439 B12R1.1645 CC(C)[C@@]1(O)C[C@@H](O)[C@@H](C)CC1 Amb24618898 [0,1,1,0,0,0|0,0,2]=4 440 B12R1.1645 CC(C)[C@]1(C)CC[C@@H](C)C(O)C1 Amb25226308 [0,1,1,0,0,0|0,0,2]=4 441 B12R1.1645 CC1=CC[C@](C)(C[C@@H]1O)C(C)=C Amb25284522 [0,1,1,0,0,0|0,0,2]=4 442 B12R1.1645 CC1CC(O)(CCN1C)C(C)=C Amb25282416 [0,1,1,0,0,0|2,0,0]=4 443 B12R1.1218 CC(=C)C1CC(=O)CC(C)CC1 Amb25713008 [0,1,1,0,0,0|1,0,1]=4 444 B12R1.1218 CC(=C)[C@@H]1CC(=O)C[C@H](C)CC1 Amb24512346 [0,1,1,0,0,0|1,0,1]=4 445 B12R1.1218 CC(=O)C1CC(=O)OC(C)CC1 Amb25263565 [0,1,1,0,0,0|1,0,1]=4 446 B12R1.1218 CC(C)[C@H]1CC(O)OC(C)CC1 Amb25158080 [0,1,1,0,0,0|0,0,2]=4 447 B12R1.1891 CCC1CCCC(CC1)C(C)=O Amb25795640 [0,1,1,0,0,0|2,0,0]=4 448 B12R1.2869 CC1CCCC(O)(CC1)C(C)=C Amb25148872 [0,1,1,0,0,0|1,0,0]=3 449 B12R1.3092 CC(=O)C1CCCC(C)(C)CC1 Amb25739879 [0,1,1,0,0,0|2,0,0]=4 450 B12R1.829 CC(=C)C1CCC(C)(O)CC1O Amb24493237 [0,1,1,0,0,0|0,0,0]=2 451 B12R1.829 CC(=C)[C@@H]1CCC(C)(C)CC1=O Amb25729053 [0,1,1,0,0,0|1,0,1]=4 452 B12R1.829 CC(=C)[C@@H]1CCC(C)(C)C[C@@H]1O Amb24519675 [0,1,1,0,0,0|1,0,0]=3 453 B12R1.829 CC(=C)[C@@H]1CC[C@](C)(O)C[C@@H]1O Amb24577014 [0,1,1,0,0,0|0,0,0]=2 454 B12R1.829 CC(=C)[C@H]1CCC(C)(C)C[C@@H]1O Amb24544017 [0,1,1,0,0,0|1,0,0]=3 455 B12R1.829 CC(=C)[C@H]1CCC(C)(C)C[C@H]1O Amb25176964 [0,1,1,0,0,0|1,0,0]=3 456 B12R1.829 CC(=C)[C@H]1CC[C@@](C)(O)C[C@@H]1O Amb25220650 [0,1,1,0,0,0|0,0,0]=2 457 B12R1.829 CC(C)=C1CCC(C)(O)CC1O Amb25795597 [0,1,1,0,0,0|0,0,2]=4 458 B12R1.829 CC(C)=C1CC[C@](C)(O)CC1O Amb25788957 [0,1,1,0,0,0|0,0,2]=4 459 B12R1.829 CC(C)=C1CC[C@](C)(O)C[C@@H]1O Amb25175485 [0,1,1,0,0,0|0,0,2]=4 460 B12R1.829 CC(C)C1CCC(C)(O)CC1O Amb25043673 [0,1,1,0,0,0|0,0,2]=4 461 B12R1.829 CC(C)[C@H]1CC[C@@](C)(O)C[C@@H]1O Amb25204312 [0,1,1,0,0,0|0,0,2]=4 462 B12R1.829 CC(C)[C@H]1CC[C@](C)(O)C[C@@H]1O Amb25220978 [0,1,1,0,0,0|0,0,2]=4 463 B12R1.829 CC1CC(C)(O)CCC1C(O)=O Amb25189524 [0,1,1,0,0,0|2,0,0]=4 464 B12R1.829 CC1OC(C)(C)CCC1C(C)=C Amb25376077 [0,1,1,0,0,0|2,0,0]=4 465 B12R1.976 CC(C)(O)C1CCC(C)(O)CC1 Amb22263916 [0,1,1,0,0,0|0,0,2]=4 466 B12R1.976 CC(C)(O)C1CCC(C)(O)CC1 Amb22349285 [0,1,1,0,0,0|0,0,2]=4 467 B12R1.976 C[C@]1(O)CC[C@H](CC1)C(O)(C)C Amb10807846 [0,1,1,0,0,0|0,0,2]=4 468 B12R1.1704 CC(=C=O)C1CCC(C)(O)CC1 Amb25121758 [0,1,1,0,0,0|0,0,1]=3 469 B12R1.1704 CC(C=C)N1CCC(C)(O)CC1 Amb25104489 [0,1,1,0,0,0|1,0,1]=4 470 B12R1.1704 CC(C=O)[C@@H]1CC[C@](C)(O)CC1 Amb25770024 [0,1,1,0,0,0|0,0,1]=3 471 B12R1.1704 CC(CO)=C1CCC(C)(O)CC1 Amb24457823 [0,1,1,0,0,0|0,0,2]=4 472 B12R1.1704 CC(CO)C1CCC(C)(O)CC1 Amb25120044 [0,1,1,0,0,0|0,0,2]=4 473 B12R1.1704 CC1(C)CCC(CC1)C(=O)C=C Amb25244407 [0,1,1,0,0,0|2,0,0]=4 474 B12R1.1704 CC1(O)CCC(C=C1)C(=C)CCl Amb25344372 [0,1,1,0,0,0|0,0,2]=4 475 B12R1.1704 CC1(O)CCC(CC1)C(=C)C=O Amb25122830 [0,1,1,0,0,0|0,0,1]=3 476 B12R1.1704 CC1(O)CCN(CC1)C(=O)C=C Amb25215551 [0,1,1,0,0,0|2,0,0]=4 477 B12R1.1704 CC1(O)CCN(CC1)C(=O)CN Amb25710691 [0,1,1,0,0,0|2,0,0]=4 478 B12R1.1704 CC1(O)CC[C@@H](C=C1)C(=C)CO Amb25261808 [0,1,1,0,0,0|0,0,2]=4 479 B12R1.1704 CC1(O)CC[C@H](C=C1)C(=C)CO Amb25823042 [0,1,1,0,0,0|0,0,2]=4 480 B12R1.1704 CCC(=O)C1CCC(C)(C)CC1 Amb25732058 [0,1,1,0,0,0|2,0,0]=4 481 B12R1.1704 CNC(=O)C1CCC(C)(C)CC1 Amb25080758 [0,1,1,0,0,0|2,0,0]=4 482 B12R1.1704 COC(=N)C1CCC(C)(C)CC1 Amb25048626 [0,1,1,0,0,0|2,0,0]=4 483 B12R1.1704 C[C@@]1(O)CC[C@H](C=C1)C(=C)CCl Amb25326655 [0,1,1,0,0,0|0,0,2]=4 484 B12R1.1704 C[C@]1(O)CC[C@H](CC1)C(=C)CO Amb24450149 [0,1,1,0,0,0|0,0,0]=2 485 B12R1.3088 CC1(C)CCC(C)(CC1)C(C)=O Amb24444652 [0,1,1,0,0,0|2,0,0]=4 486 B12R1.3088 CC1(C)CCC(O)(CC1)C(C)=C Amb24342020 [0,1,1,0,0,0|1,0,0]=3 487 B12R1.3825 CC(=C)C1CCC(O)(CC1)CO Amb24493578 [0,1,1,0,0,0|0,0,0]=2 488 B12R1.3825 CC(=O)N1CCC(C)(CO)CC1 Amb25051872 [0,1,1,0,0,0|2,0,0]=4 489 B12R1.3825 CC(=O)N1CCC(O)(CC1)CO Amb25825538 [0,1,1,0,0,0|2,0,0]=4 490 B12R1.3825 CC(C)C1CCC(O)(CC1)CC Amb18802050 [0,1,1,0,0,0|0,0,2]=4 491 B12R1.3825 CC(C)C1CCC(O)(CN)CC1 Amb18964297 [0,1,1,0,0,0|0,0,2]=4 492 B12R1.3825 CC(C)C1CCC(O)(CO)CC1 Amb24731719 [0,1,1,0,0,0|0,0,2]=4 493 B12R1.3825 CC(C)[C@@H]1CC[C@@](O)(CO)CC1 Amb25837938 [0,1,1,0,0,0|0,0,2]=4 494 B12R1.3825 COC1(C)CCC(CC1)C(=C)C Amb15693464 [0,1,1,0,0,0|0,0,0]=2 495 B12R1.3825 COC1(C)CCN(CC1)C(C)=O Amb24744262 [0,1,1,0,0,0|2,0,0]=4 496 B12R1.3825 NCC1(O)CCC(CC1)C(O)=O Amb25674784 [0,1,1,0,0,0|2,0,0]=4 497 B12R1.3825 NCC1(O)CCN(CC1)C(=O)C Amb17081093 [0,1,1,0,0,0|2,0,0]=4 498 B12R1.3825 OCC1(O)CC[C@H](C=C1)C(=C)C Amb17615543 [0,1,1,0,0,0|0,0,2]=4 499 B12R1.3825 [C-]#[N+]C1(C)CCC(CC1)C(C)=O Amb25713564 [0,1,1,0,0,0|2,0,0]=4 500 B12R1.3825 [C-]#[N+][C@]1(C)CC[C@H](CC1)C(C)=O Amb25718328 [0,1,1,0,0,0|2,0,0]=4 501 B12R1.1349 CC(O)C1(C)OC1CC=C(C)C Amb24354335 [0,1,1,0,0,0|0,0,2]=4 502 B12R1.1349 C[C@@H](O)[C@@]1(C)O[C@@H]1CC=C(C)C Amb24577425 [0,1,1,0,0,0|0,0,2]=4 503 B12R2.1247 CC(C)C1CC2OC2C(O)C1 Amb24414925 [1,1,0,0,0,0|0,0,2]=4 504 B12R2.1585 CCC(=O)N1CC2OC2CC1 Amb23455553 [1,1,0,0,0,0|2,0,0]=4 505 B12R2.1585 COC(=O)C1CCC2OC2C1 Amb20242009 [1,1,0,0,0,0|1,0,0]=3 506 B12R2.4356 CC(C1CCC2C(C1)O2)(C)C Amb1130458 [1,1,0,0,0,0|0,0,2]=4 507 B12R2.6439 CC12CC(CC1(C)O2)C(O)=O Amb25846131 [0,1,0,0,1,0|2,0,0]=4 508 B12R2.6439 C[C@@]12C[C@@H](C[C@]1(C)O2)C(O)=O Amb24397023 [0,1,0,0,1,0|2,0,0]=4 509 B12R2.788 CC(=C)C1CC(O)C2(C)CC21 Amb24457864 [0,1,0,0,1,0|1,0,0]=3 510 B12R2.788 CC(=C)[C@@H]1C[C@@H](O)[C@@]2(C)C[C@H]21 Amb25245113 [0,1,0,0,1,0|1,0,0]=3 511 B12R2.788 CC(=C)[C@@H]1C[C@H](O)[C@]2(C)C[C@@H]21 Amb24668920 [0,1,0,0,1,0|1,0,0]=3 512 B14R2.8830 CC(=O)OC1CC(O)C2(C)OC2C1 Amb25343570 [0,1,0,0,0,1|1,0,0]=3 513 B14R2.8830 CC(=O)O[C@H]1C[C@H](O)[C@]2(C)O[C@@H]2C1 Amb24705940 [0,1,0,0,0,1|1,0,0]=3 514 B14R2.54383 CC1C(CC2OC2(C)C1O)C(C)=C Amb25048567 [0,2,0,0,0,0|0,0,0]=2 515 B14R2.1949 CC(=O)[C@H]1C[C@@H](CO)[C@@]2(C)O[C@H]2C1 Amb25221447 [0,2,0,0,0,0|1,0,0]=3 516 B14R2.8809 CC(C)(O)[C@@H]1C[C@@H]2O[C@]2(C)[C@@H](Cl)C1 Amb24639116 [0,2,0,0,0,0|0,0,2]=4 517 B14R2.30028 CC(=C)C1CC2(C)OC2(C)C(O)C1 Amb25802084 [0,2,0,0,0,0|0,0,0]=2 518 B14R2.34983 CC12OC1CC(CC2=O)C(=C)CO Amb24430905 [0,2,0,0,0,0|0,0,1]=3 519 B14R2.27501 CC(O)(CO)[C@H]1CC2OC2(C)CC1 Amb24407520 [0,2,0,0,0,0|0,0,2]=4 520 B14R2.27501 C[C@@](O)(CO)[C@H]1C[C@@H]2O[C@]2(C)CC1 Amb25206733 [0,2,0,0,0,0|0,0,2]=4 521 B14R2.27501 C[C@@](O)(CO)[C@H]1C[C@H]2O[C@@]2(C)CC1 Amb24584068 [0,2,0,0,0,0|0,0,2]=4 522 B14R2.25114 CC(=C)C1(C)CCC2(C)CC2C1=O Amb25262255 [0,2,0,0,0,0|1,0,1]=4 523 B14R2.33830 CC(=CCO)C1CC2OC2(C)CC1 Amb25802896 [0,2,0,0,0,0|0,0,0]=2 524 B14R2.33830 CC(=CCO)[C@@H]1C[C@@H]2O[C@]2(C)CC1 Amb25284389 [0,2,0,0,0,0|0,0,0]=2 525 B14R2.33830 CC(=CCO)[C@H]1C[C@@H]2O[C@]2(C)CC1 Amb25346238 [0,2,0,0,0,0|0,0,0]=2 526 B14R2.33830 CC(=CCO)[C@H]1C[C@H]2O[C@@]2(C)CC1 Amb24675379 [0,2,0,0,0,0|0,0,0]=2 527 B10R0.57 CC(CC)C(O)CNC(C)=O Amb24755799 [0,0,2,0,0,0|2,0,0]=4 528 B10R0.93 CC(C)C(C)CC(C)C(C)=O Amb24765133 [0,0,2,0,0,0|2,0,0]=4 529 B10R0.93 CC(C)C(O)CC(C)C(O)=O Amb18182511 [0,0,2,0,0,0|2,0,0]=4 530 B10R0.93 CC(C)C(O)\C=C(\C)/C(C)=C Amb25689161 [0,0,2,0,0,0|0,0,2]=4 531 B10R0.98 C[C@@H](CCC=C(C)C)[C@H](C)O Amb25386098 [0,0,2,0,0,0|0,0,2]=4 532 B10R0.3 CC(CCBr)CCCC(C)=C Amb17777840 [0,0,2,0,0,0|2,0,0]=4 533 B10R0.3 CC(CCO)CCCC(C)=C Amb17777839 [0,0,2,0,0,0|2,0,0]=4 534 B10R0.3 C[C@@H](CCO)CCCC(C)=C Amb22801340 [0,0,2,0,0,0|2,0,0]=4 535 B10R0.55 CCC(CCCCC(=O)C)C Amb17619474 [0,0,2,0,0,0|2,0,0]=4 536 B10R0.65 CCC(C)(O)CCC=C(C)C Amb21963204 [0,0,2,0,0,0|0,0,2]=4 537 B10R0.92 CC(CCC(C)(C)C)C(C)=O Amb18791772 [0,0,2,0,0,0|2,0,0]=4 538 B12R2.130 C=C1CCC2CC1CCC2O Amb24544153 [0,0,1,1,0,0|2,0,0]=4 539 B12R2.1046 CC(C)C12CC1C(C)C(O)C2 Amb25149678 [0,0,1,1,0,0|0,0,2]=4 540 B12R2.1046 CC(C)[C@@]12C[C@@H]1C(C)C(O)C2 Amb24515293 [0,0,1,1,0,0|0,0,2]=4 541 B12R2.1046 CC(C)[C@@]12C[C@@H]1[C@H](C)C(O)C2 Amb25175257 [0,0,1,1,0,0|0,0,2]=4 542 B12R2.1046 CC(C)[C@@]12C[C@@H]1[C@H](C)[C@H](O)C2 Amb24588226 [0,0,1,1,0,0|0,0,2]=4 543 B12R2.1046 CC(C)[C@@]12C[C@H]1C(C)[C@H](O)C2 Amb24515305 [0,0,1,1,0,0|0,0,2]=4 544 B12R2.1136 CC1C(O)CC2CC1OC2=O Amb25233465 [0,0,1,1,0,0|2,0,0]=4 545 B12R2.1136 C[C@H]1[C@@H]2CC(=C)[C@H](CC1=O)C2 Amb24582563 [0,0,1,1,0,0|0,0,2]=4 546 B12R2.2426 CC1=CC2(O)CCC1CC2N Amb24468274 [0,0,1,1,0,0|2,0,0]=4 547 B12R2.2426 CC1=C[C@@]2(O)CC[C@@H]1C[C@H]2N Amb24617287 [0,0,1,1,0,0|2,0,0]=4 548 B12R2.2426 CC1=C[C@]2(C)CC[C@H]1C[C@@H]2O Amb25206699 [0,0,1,1,0,0|0,0,0]=2 549 B12R2.2426 C[C@@]12CC[C@@H](C[C@H]1O)C(=O)O2 Amb25280786 [0,0,1,1,0,0|2,0,0]=4 550 B12R2.2786 CC1(C)C2CC(O)[C@@]1(C)CC2 Amb18511842 [0,0,1,1,0,0|0,0,2]=4 551 B12R2.2786 CC1(C)C2CC(O)[C@]1(C)CC2 Amb25214960 [0,0,1,1,0,0|0,0,2]=4 552 B12R2.2786 CC1(C)C2C[C@@H](O)[C@@]1(C)CC2 Amb22800783 [0,0,1,1,0,0|0,0,2]=4 553 B12R2.2786 CC1(C)C2C[C@@H](O)[C@]1(C)CC2 Amb22799646 [0,0,1,1,0,0|0,0,2]=4 554 B12R2.2786 CC1(C)C2C[C@H](O)[C@]1(C)CC2 Amb25174940 [0,0,1,1,0,0|0,0,2]=4 555 B12R2.2786 CC1(C)[C@@H]2C[C@H](O)[C@@]1(C)CC2 Amb25176358 [0,0,1,1,0,0|0,0,2]=4 556 B12R2.2786 CC1(C)[C@@H]2C[C@H](O)[C@]1(C)CC2 Amb24520455 [0,0,1,1,0,0|0,0,2]=4 557 B12R2.2786 CC12CCC(CC1O)C2(C)N Amb24374678 [0,0,1,1,0,0|1,0,1]=4 558 B12R2.2786 OC1CC2C(C1(C)CC2)(C)C Amb1933831 [0,0,1,1,0,0|0,0,2]=4 559 B12R2.2824 CC(=O)[C@@]12C[C@@H](CC1)[C@H](O)C2 Amb25231298 [0,0,1,1,0,0|1,0,0]=3 560 B12R2.2863 CC1[C@H]2C[C@@H](CC1O)C2(C)C Amb24520456 [0,0,1,1,0,0|0,0,2]=4 561 B12R2.2863 C[C@@H]1C2CC(CC1O)C2(C)C Amb24733402 [0,0,1,1,0,0|0,0,2]=4 562 B12R2.2863 C[C@@H]1C2CC(C[C@H]1O)C2(C)C Amb22362987 [0,0,1,1,0,0|0,0,2]=4 563 B12R2.2863 C[C@@H]1[C@@H]2C[C@H](C[C@@H]1O)C2(C)C Amb24610560 [0,0,1,1,0,0|0,0,2]=4 564 B12R2.2863 C[C@H]1C2CC(C[C@@H]1O)C2(C)C Amb17940856 [0,0,1,1,0,0|0,0,2]=4 565 B12R2.2863 C[C@H]1C2CC(C[C@H]1O)C2(C)C Amb24661318 [0,0,1,1,0,0|0,0,2]=4 566 B12R2.2863 C[C@H]1[C@H]2C[C@H](C[C@@H]1O)C2(C)C Amb24620904 [0,0,1,1,0,0|0,0,2]=4 567 B12R2.2953 CC1CCC2C(C1O)C2(C)C Amb24734948 [0,0,1,1,0,0|0,0,2]=4 568 B12R2.2953 CC1CC[C@@H]2[C@H](C1O)C2(C)C Amb25175258 [0,0,1,1,0,0|0,0,2]=4 569 B12R2.2953 C[C@H]1CC[C@@H]2[C@H]([C@@H]1O)C2(C)C Amb25220637 [0,0,1,1,0,0|0,0,2]=4 570 B12R2.2953 C[C@H]1CC[C@@H]2[C@H]([C@H]1O)C2(C)C Amb25212867 [0,0,1,1,0,0|0,0,2]=4 571 B12R2.3906 CC1CC2C(CC1O)C2(C)C Amb25258847 [0,0,1,1,0,0|0,0,2]=4 572 B12R2.3906 C[C@@H]1C[C@H]2[C@@H](C[C@H]1O)C2(C)C Amb25175125 [0,0,1,1,0,0|0,0,2]=4 573 B12R2.3906 C[C@H]1CC2C(C[C@H]1O)C2(C)C Amb24733443 [0,0,1,1,0,0|0,0,2]=4 574 B12R2.3906 C[C@H]1C[C@@H]2[C@H](CC1O)C2(C)C Amb24733488 [0,0,1,1,0,0|0,0,2]=4 575 B12R2.127 O=C1CC[C@H]2CCC[C@@H]1CC2 Amb24534232 [0,0,1,1,0,0|2,0,0]=4 576 B12R2.1385 CC(=O)C1CC[C@@H]2C[C@H]2CC1 Amb25370666 [0,0,1,1,0,0|2,0,0]=4 577 B12R2.3099 CC(=O)C12CC(CCC1)CC2 Amb25728661 [0,0,1,1,0,0|2,0,0]=4 578 B12R2.1156 CC12CCC(CC1)C(=O)C=C2 Amb25150325 [0,0,1,1,0,0|2,0,0]=4 579 B12R2.1156 OC12CCC(=O)N(CC1)CC2 Amb24536146 [0,0,1,1,0,0|2,0,0]=4 580 B12R2.3187 CC(=O)C1CC2C(C1)C2(C)C Amb24621672 [0,0,1,1,0,0|2,0,0]=4 581 B12R2.3199 CC(C)C1CCC2(CO2)CC1 Amb18796801 [0,0,1,1,0,0|0,0,2]=4 582 B12R2.5294 CC1(C)[C@@H]2C[C@H]1CC[C@@]2(C)O Amb24514865 [0,0,1,1,0,0|0,0,2]=4 583 B12R2.5294 CC1(O)CCC2CC1C2(C)C Amb1953636 [0,0,1,1,0,0|0,0,2]=4 584 B12R2.6448 CC(=O)C12CC(F)(CC1)CC2 Amb25353335 [0,0,1,1,0,0|2,0,0]=4 585 B12R2.6448 CC12CCC(CC1)(O2)C(C)C Amb22337789 [0,0,1,1,0,0|0,0,2]=4 586 B12R2.6452 CC1(O)CCC2(CC12)C(C)C Amb22229884 [0,0,1,1,0,0|0,0,2]=4 587 B12R2.6452 CC1(O)CCC2(CC12)C(C)C Amb22352980 [0,0,1,1,0,0|0,0,2]=4 588 B12R2.6452 C[C@@]1(O)CC[C@@]2(C[C@H]12)C(C)C Amb22800872 [0,0,1,1,0,0|0,0,2]=4 589 B12R2.6452 C[C@@]1(O)CC[C@]2(C[C@@H]12)C(C)C Amb24665751 [0,0,1,1,0,0|0,0,2]=4 590 B12R3.23 C1OC1C2CCC3OC3C2 Amb17678854 [1,0,0,1,0,0|1,0,1]=4 591 B12R3.55 O=C1CC2C3CCC1CC23 Amb24456579 [1,0,0,1,0,0|2,0,0]=4 592 B12R3.4012 CC1(C)[C@H]2C[C@@H]3O[C@@H]3C[C@@H]12 Amb25264348 [1,0,0,1,0,0|0,0,2]=4 593 B12R3.1686 C[C@]12CC[C@@H]3C[C@H]1[C@H]2C3=O Amb24690632 [1,0,0,1,0,0|2,0,0]=4 594 B14R3.43581 CC1(C)C2C1CC(O)C3(C)OC32 Amb25763802 [0,1,0,1,0,0|0,0,2]=4 595 B14R3.23297 CC1(C)C2CC1C(O)C3OC32C Amb25734455 [0,1,0,1,0,0|0,0,2]=4 596 B14R3.27966 CC1(C)C2CC3(C)OC3C(O)C12 Amb25079282 [0,1,0,1,0,0|0,0,2]=4 597 B14R3.27966 CC1(C)C2C[C@]3(C)O[C@@H]3[C@H](O)C12 Amb25261921 [0,1,0,1,0,0|0,0,2]=4 598 B14R3.52745 CC12CC3C(CC1O2)C3(C)CO Amb25296104 [0,1,0,1,0,0|0,0,2]=4 599 B14R3.52745 C[C@]12C[C@H]3[C@@H](C[C@H]1O2)[C@]3(C)CO Amb24604911 [0,1,0,1,0,0|0,0,2]=4 600 B14R3.44977 CC1(C)C2CC1CC3OC32CCl Amb24535404 [0,1,0,1,0,0|0,0,2]=4 601 B14R3.44977 CC1(C)[C@@H]2C[C@H]1C[C@H]3O[C@]32CO Amb24675599 [0,1,0,1,0,0|0,0,2]=4 602 B10R1.58 CC(C)C1CC(O)C(C)C1 Amb24536744 [0,0,1,0,1,0|0,0,2]=4 603 B10R1.58 CC(C)[C@@H]1C[C@@H](O)[C@H](C)C1 Amb25236556 [0,0,1,0,1,0|0,0,2]=4 604 B10R1.58 CC1CC(CC1O)C(O)=O Amb25072588 [0,0,1,0,1,0|2,0,0]=4 605 B10R1.58 C[C@H]1CC(C[C@@H]1O)C(C)=C Amb25176799 [0,0,1,0,1,0|0,0,0]=2 606 B10R1.194 CC(=C)[C@H]1OC[C@H](O)[C@H]1O Amb25219298 [0,0,1,0,1,0|2,0,0]=4 607 B10R1.194 CC(C)C1CCC(C)C1O Amb24684737 [0,0,1,0,1,0|0,0,2]=4 608 B10R1.194 CC(C)[C@@H]1CC[C@H](C)[C@H]1O Amb25285263 [0,0,1,0,1,0|0,0,2]=4 609 B10R1.194 CC(C)[C@H]1CC[C@H](C)[C@@H]1O Amb25220692 [0,0,1,0,1,0|0,0,2]=4 610 B10R1.194 CC1C(O)CCC1C(C)=C Amb25234666 [0,0,1,0,1,0|2,0,0]=4 611 B10R1.194 CC1CCC(C1O)C(C)=C Amb25358135 [0,0,1,0,1,0|0,0,0]=2 612 B10R1.194 CC1[C@H](O)CCC1C(C)=C Amb25271457 [0,0,1,0,1,0|2,0,0]=4 613 B10R1.194 C[C@@H]1C(O)CC[C@@H]1C(C)=C Amb25175332 [0,0,1,0,1,0|2,0,0]=4 614 B10R1.194 C[C@@H]1[C@H](O)CC[C@@H]1C(C)=C Amb25176800 [0,0,1,0,1,0|2,0,0]=4 615 B10R1.194 C[C@H]1CC[C@@H]([C@H]1O)C(C)=C Amb25205903 [0,0,1,0,1,0|0,0,0]=2 616 B10R1.194 C[C@H]1CC[C@H]([C@H]1C)C(C)=O Amb24723003 [0,0,1,0,1,0|2,0,0]=4 617 B10R1.194 C[C@H]1CC[C@H]([C@H]1O)C(C)=C Amb25215690 [0,0,1,0,1,0|0,0,0]=2 618 B10R1.194 C[C@H]1[C@H](O)CC[C@@H]1C(C)=C Amb25206349 [0,0,1,0,1,0|2,0,0]=4 619 B10R1.74 CC(=C)CCC1(C)CC1Cl Amb24340332 [0,0,1,0,1,0|2,0,0]=4 620 B10R1.359 CC(=O)C1CC(C)(C)CC1 Amb25136434 [0,0,1,0,1,0|2,0,0]=4 621 B10R1.359 CC1(O)CC(CC1)C(O)=O Amb23454111 [0,0,1,0,1,0|2,0,0]=4 622 B10R1.494 CC(=C)C(O)C1OC1(C)C Amb24360330 [0,0,1,0,1,0|1,0,0]=3 623 B10R1.494 CC(C1OC1(C)C)C(C)O Amb24556852 [0,0,1,0,1,0|1,0,1]=4 624 B10R1.494 C[C@H]([C@@H]1OC1(C)C)[C@H](C)O Amb25296253 [0,0,1,0,1,0|1,0,1]=4 625 B10R2.355 CC(=O)C1CCC2CC21 Amb25312943 [1,0,0,0,1,0|2,0,0]=4 626 B10R2.357 OC(=O)C1CC2C(C1)O2 Amb16233359 [1,0,0,0,1,0|2,0,0]=4 627 B10R2.101 CC12CC1C(C=C)NC2 Amb24595879 [1,0,0,0,1,0|2,0,0]=4 628 B10R2.101 C[C@@]12C[C@@H]1[C@@H](C=C)NC2 Amb24585244 [1,0,0,0,1,0|2,0,0]=4 629 B12R1.19 CC(=C)C[C@H]1CC(=O)[C@H](C)CC1 Amb24724011 [0,0,1,0,0,1|0,0,2]=4 630 B12R1.19 CC1CC(CCC1C)OC(C)=O Amb25079973 [0,0,1,0,0,1|2,0,0]=4 631 B12R1.19 CC1CCC(CC1C)CC(C)=O Amb25716256 [0,0,1,0,0,1|2,0,0]=4 632 B12R1.19 CC1CCN(CC1N)CC(C)=C Amb25057952 [0,0,1,0,0,1|2,0,0]=4 633 B12R1.19 CC1CCN(CC1O)CC(=C)Cl Amb25850516 [0,0,1,0,0,1|2,0,0]=4 634 B12R1.19 CC1CCN(CC1O)CC(C)=C Amb25198172 [0,0,1,0,0,1|1,0,0]=3 635 B12R1.1020 CC1CCC(CCC1)NC(C)=O Amb24360321 [0,0,1,0,0,1|2,0,0]=4 636 B12R1.1819 CC(=N)NC1CCC(C)(C)CC1 Amb25150943 [0,0,1,0,0,1|2,0,0]=4 637 B12R1.1819 CC(=O)CC1CCC(C)(C)CC1 Amb25323824 [0,0,1,0,0,1|2,0,0]=4 638 B12R1.1819 CC(=O)CN1CCC(C)(O)CC1 Amb25065111 [0,0,1,0,0,1|2,0,0]=4 639 B12R1.1819 CC(=O)NC1CCC(C)(O)CC1 Amb25137387 [0,0,1,0,0,1|1,0,0]=3 640 B12R1.1819 CC(C)NC1CCC(C)(O)CC1 Amb24660932 [0,0,1,0,0,1|0,0,2]=4 641 B12R1.1819 CC1(O)CCC(CC(O)=O)CC1 Amb21520460 [0,0,1,0,0,1|2,0,0]=4 642 B12R1.1819 CC1(O)CCC(CC1)NC(N)=O Amb25344448 [0,0,1,0,0,1|2,0,0]=4 643 B12R1.1819 CC1(O)CCN(CC(=C)Br)CC1 Amb25708207 [0,0,1,0,0,1|2,0,0]=4 644 B12R1.1819 CC1(O)CCN(CC(=C)Cl)CC1 Amb25757184 [0,0,1,0,0,1|2,0,0]=4 645 B12R1.1819 C[C@]1(O)CC[C@@H](CC(O)=O)CC1 Amb25061298 [0,0,1,0,0,1|2,0,0]=4 646 B12R2.1655 CC(=O)NC1CC2OC2CC1 Amb24401681 [1,0,0,0,0,1|1,0,0]=3