0 B9R0.15 C#CCC(CC#C)C(=O)O Amb26873791 [0,0,0,0,0,0|0,0,4]=4 1 B9R0.15 C=C(Br)C(OCC)OCC Amb8389936 [0,0,0,0,0,0|4,0,0]=4 2 B9R0.15 C=C(Cl)C(OCC)OCC Amb25864302 [0,0,0,0,0,0|4,0,0]=4 3 B9R0.15 C=C=CC(CCC)C(=O)O Amb17593546 [0,0,0,0,0,0|0,0,3]=3 4 B9R0.15 C=CCC(CC=C)C(=O)O Amb18643544 [0,0,0,0,0,0|0,0,4]=4 5 B9R0.15 C=CCC(CCC)C(=O)O Amb17619617 [0,0,0,0,0,0|0,0,2]=2 6 B9R0.15 C=CCC(CCC)C(N)=O Amb28050033 [0,0,0,0,0,0|1,0,2]=3 7 B9R0.15 C=CCC(COC)C(=O)O Amb18644105 [0,0,0,0,0,0|1,0,2]=3 8 B9R0.15 C=CCC(OCC)C(=O)O Amb27592786 [0,0,0,0,0,0|1,0,2]=3 9 B9R0.15 C=CCC(OCC)C(C)=O Amb25088299 [0,0,0,0,0,0|2,0,2]=4 10 B9R0.15 C=CCC(OCC)C(N)=O Amb27842047 [0,0,0,0,0,0|2,0,2]=4 11 B9R0.15 C=C\C=C(/CCC)C(=O)O Amb17619615 [0,0,0,0,0,0|0,0,4]=4 12 B9R0.15 CC#CC(CCC)C(=O)O Amb27590192 [0,0,0,0,0,0|0,0,2]=2 13 B9R0.15 CC(=O)C(CCN)CCN Amb27591645 [0,0,0,0,0,0|3,0,0]=3 14 B9R0.15 CC(=O)N(CCBr)CCBr Amb22750991 [0,0,0,0,0,0|4,0,0]=4 15 B9R0.15 CC(=O)N(CCCl)CCCl Amb17234052 [0,0,0,0,0,0|4,0,0]=4 16 B9R0.15 CC(=O)N(CCO)CCO Amb17232028 [0,0,0,0,0,0|4,0,0]=4 17 B9R0.15 CCCC(CC=O)C(=O)O Amb27786319 [0,0,0,0,0,0|1,0,1]=2 18 B9R0.15 CCCC(CCC)C(=N)N Amb25858014 [0,0,0,0,0,0|2,0,0]=2 19 B9R0.15 CCCC(CCC)C(=O)Cl Amb3939568 [0,0,0,0,0,0|1,0,0]=1 20 B9R0.15 CCCC(CCC)C(=O)I Amb27478658 [0,0,0,0,0,0|1,0,0]=1 21 B9R0.15 CCCC(CCC)C(=O)O Amb3940097 [0,0,0,0,0,0|0,0,0]=0 22 B9R0.15 CCCC(CCC)C(=O)[O-] Amb3499360 [0,0,0,0,0,0|0,0,1]=1 23 B9R0.15 CCCC(CCC)C(C)=O Amb25146280 [0,0,0,0,0,0|1,0,0]=1 24 B9R0.15 CCCC(CCC)C(C)N Amb27593426 [0,0,0,0,0,0|2,0,1]=3 25 B9R0.15 CCCC(CCC)C(N)=O Amb6336479 [0,0,0,0,0,0|1,0,0]=1 26 B9R0.15 CCCC(CCC)C(N)=S Amb33423890 [0,0,0,0,0,0|1,1,0]=2 27 B9R0.15 CCCC(CCC)S(=O)Cl Amb32720501 [0,0,0,0,0,0|2,0,0]=2 28 B9R0.15 CCCC(CCC)S(=O)[O-] Amb32754841 [0,0,0,0,0,0|1,0,1]=2 29 B9R0.15 CCCC(CCC)S(N)=O Amb32720502 [0,0,0,0,0,0|2,0,0]=2 30 B9R0.15 CCCC(CCC)[C@@H](C)N Amb32731128 [0,0,0,0,0,0|2,0,1]=3 31 B9R0.15 CCCC(CCC)[C@@H](C)O Amb32731126 [0,0,0,0,0,0|1,0,1]=2 32 B9R0.15 CCCC(CCC)[C@H](C)N Amb32731127 [0,0,0,0,0,0|2,0,1]=3 33 B9R0.15 CCCC(CCC)[C@H](C)O Amb32731125 [0,0,0,0,0,0|1,0,1]=2 34 B9R0.15 CCCC(CCCl)C(=O)O Amb27427463 [0,0,0,0,0,0|1,0,0]=1 35 B9R0.15 CCCC(CCF)C(=O)O Amb27837855 [0,0,0,0,0,0|1,0,0]=1 36 B9R0.15 CCCC(CCN)C(=O)O Amb33756786 [0,0,0,0,0,0|1,0,0]=1 37 B9R0.15 CCCC(CCO)C(C)N Amb27794045 [0,0,0,0,0,0|3,0,1]=4 38 B9R0.15 CCCC(CNC)N(C)C Amb28350912 [0,0,0,0,0,0|4,0,0]=4 39 B9R0.15 CCCC(N=C=S)C(=O)O Amb33471537 [0,0,0,0,0,0|2,0,1]=3 40 B9R0.15 CCCC(N=[N+]=[N-])C(=O)Cl Amb27790590 [0,0,0,0,0,0|4,0,0]=4 41 B9R0.15 CCCC(NC=O)C(=O)O Amb9871545 [0,0,0,0,0,0|2,0,1]=3 42 B9R0.15 CCCC(NCC)C(=O)O Amb9496319 [0,0,0,0,0,0|1,0,0]=1 43 B9R0.15 CCCC(NCC)C(F)F Amb27167376 [0,0,0,0,0,0|3,0,1]=4 44 B9R0.15 CCCC(OCC)C(=O)O Amb28050125 [0,0,0,0,0,0|1,0,0]=1 45 B9R0.15 CCCC(OCC)C(C)=O Amb26475888 [0,0,0,0,0,0|2,0,0]=2 46 B9R0.15 CCCC(OCC)[C@@H](C)N Amb27239586 [0,0,0,0,0,0|3,0,1]=4 47 B9R0.15 CCCC(SCC)C(=O)[O-] Amb2610616 [0,0,0,0,0,0|1,0,1]=2 48 B9R0.15 CCCC(SCC)C(N)=O Amb27983703 [0,0,0,0,0,0|2,0,0]=2 49 B9R0.15 CCCN(CCC)C(=N)N Amb6682753 [0,0,0,0,0,0|3,0,0]=3 50 B9R0.15 CCCN(CCC)C(=O)Cl Amb17563076 [0,0,0,0,0,0|2,0,0]=2 51 B9R0.15 CCCN(CCC)C(C)=O Amb2721240 [0,0,0,0,0,0|2,0,0]=2 52 B9R0.15 CCCN(CCC)C(N)=S Amb1134658 [0,0,0,0,0,0|2,1,0]=3 53 B9R0.15 CCCN(CCO)S(C)=O Amb27617568 [0,0,0,0,0,0|4,0,0]=4 54 B9R0.15 CCCP(CCC)N(C)C Amb27837756 [0,0,0,0,0,0|4,0,0]=4 55 B9R0.15 CCC[C@@H](N=C=O)C(=O)O Amb33471348 [0,0,0,0,0,0|2,0,1]=3 56 B9R0.15 CCC[C@@H](N=C=S)C(=O)O Amb33471577 [0,0,0,0,0,0|2,0,1]=3 57 B9R0.15 CCC[C@@H](NC=O)C(=O)O Amb27831939 [0,0,0,0,0,0|2,0,1]=3 58 B9R0.15 CCC[C@@H](NCC)C(=O)O Amb33347491 [0,0,0,0,0,0|1,0,0]=1 59 B9R0.15 CCC[C@H](N=C=O)C(=O)O Amb33471344 [0,0,0,0,0,0|2,0,1]=3 60 B9R0.15 CCC[C@H](N=C=S)C(=O)O Amb33471574 [0,0,0,0,0,0|2,0,1]=3 61 B9R0.15 CCC[C@H](NCC)C(=O)O Amb33347483 [0,0,0,0,0,0|1,0,0]=1 62 B9R0.15 CCC[N+](CCO)=C(N)N Amb28369621 [0,0,0,0,0,0|4,0,0]=4 63 B9R0.15 CCC\C(=N/OC)C(C)=O Amb28201036 [0,0,0,0,0,0|3,0,1]=4 64 B9R0.15 CCNC(CCN)C(=O)O Amb27830036 [0,0,0,0,0,0|2,0,0]=2 65 B9R0.15 CCNC(CSC)C(N)=O Amb18788150 [0,0,0,0,0,0|3,0,0]=3 66 B9R0.15 CCN[C@H](COC)C(=O)O Amb33347499 [0,0,0,0,0,0|2,0,0]=2 67 B9R0.15 CCOC(COC)C(=O)O Amb28348050 [0,0,0,0,0,0|2,0,0]=2 68 B9R0.15 CCOC(OCC)C(=N)N Amb30640116 [0,0,0,0,0,0|4,0,0]=4 69 B9R0.15 CCOC(OCC)C(=N)N Amb4297071 [0,0,0,0,0,0|4,0,0]=4 70 B9R0.15 CCOC(OCC)C(=O)O Amb27175491 [0,0,0,0,0,0|2,0,0]=2 71 B9R0.15 CCOC(OCC)C(C)=O Amb28050208 [0,0,0,0,0,0|3,0,0]=3 72 B9R0.15 CCOC(OCC)C(C)O Amb27256615 [0,0,0,0,0,0|3,0,1]=4 73 B9R0.15 CCOC(OCC)C(N)=O Amb9825947 [0,0,0,0,0,0|3,0,0]=3 74 B9R0.15 CCOC(OCC)C(N)=S Amb2724907 [0,0,0,0,0,0|3,1,0]=4 75 B9R0.15 CCOC(OCC)[C@@H](C)O Amb25763968 [0,0,0,0,0,0|3,0,1]=4 76 B9R0.15 CCOC(OCC)[C@H](C)O Amb26895796 [0,0,0,0,0,0|3,0,1]=4 77 B9R0.15 CCSC(SCC)C(N)=O Amb2439276 [0,0,0,0,0,0|3,0,0]=3 78 B9R0.15 CC\C=C(/CCC)C(=O)O Amb27961497 [0,0,0,0,0,0|0,0,2]=2 79 B9R0.15 CC\C=C(/CCC)C(C)=O Amb27802632 [0,0,0,0,0,0|1,0,2]=3 80 B9R0.15 CC\C=C(/CCO)C(=O)O Amb27832032 [0,0,0,0,0,0|1,0,2]=3 81 B9R0.15 CC\C=C(/CCO)C(C)=O Amb28145901 [0,0,0,0,0,0|2,0,2]=4 82 B9R0.15 CC\C=C(\OCC)C(=O)O Amb27254120 [0,0,0,0,0,0|1,0,2]=3 83 B9R0.15 COCC(COC)S(=O)Cl Amb32720730 [0,0,0,0,0,0|4,0,0]=4 84 B9R0.15 COCC(COC)S(=O)[O-] Amb32754933 [0,0,0,0,0,0|3,0,1]=4 85 B9R0.15 COCC(COC)S(N)=O Amb32720731 [0,0,0,0,0,0|4,0,0]=4 86 B9R0.15 COCC(N=C=O)C(=O)O Amb33471318 [0,0,0,0,0,0|3,0,1]=4 87 B9R0.15 COCC(N=C=S)C(=O)O Amb33471549 [0,0,0,0,0,0|3,0,1]=4 88 B9R0.15 COCC(NC=O)C(=O)O Amb25378764 [0,0,0,0,0,0|3,0,1]=4 89 B9R0.15 COC[C@H](N=C=O)C(=O)O Amb33471381 [0,0,0,0,0,0|3,0,1]=4 90 B9R0.15 COC[C@H](N=C=S)C(=O)O Amb33471601 [0,0,0,0,0,0|3,0,1]=4 91 B9R0.15 COC[C@H](NC=O)C(=O)O Amb27390202 [0,0,0,0,0,0|3,0,1]=4 92 B9R0.15 CSCC(CSC)C(=O)O Amb26392213 [0,0,0,0,0,0|2,0,0]=2 93 B9R0.15 CSCC(N=C=O)C(=O)O Amb33471313 [0,0,0,0,0,0|3,0,1]=4 94 B9R0.15 CSCC(N=C=S)C(=O)O Amb33471543 [0,0,0,0,0,0|3,0,1]=4 95 B9R0.15 CSCC(NCO)C(=O)O Amb28137810 [0,0,0,0,0,0|3,0,0]=3 96 B9R0.15 C\C=C\C(CCC)C(=O)O Amb18643916 [0,0,0,0,0,0|0,0,2]=2 97 B9R0.15 NC(=O)N(CCO)CCO Amb9871607 [0,0,0,0,0,0|4,0,0]=4 98 B9R0.15 NCCC(CCF)C(=O)O Amb27870809 [0,0,0,0,0,0|2,0,0]=2 99 B9R0.15 NCCC(CCN)C(=O)O Amb20622689 [0,0,0,0,0,0|2,0,0]=2 100 B9R0.15 NCCC(CCN)C(=O)O Amb24120603 [0,0,0,0,0,0|2,0,0]=2 101 B9R0.15 NCCN(CCO)C(=O)O Amb24100350 [0,0,0,0,0,0|3,0,0]=3 102 B9R0.15 O=C(Cl)N(CCCl)CCCl Amb22388500 [0,0,0,0,0,0|4,0,0]=4 103 B9R0.15 O=C(F)N(CCCl)CCCl Amb28325617 [0,0,0,0,0,0|4,0,0]=4 104 B9R0.15 O=C(O)C(CCF)N=C=S Amb33471664 [0,0,0,0,0,0|3,0,1]=4 105 B9R0.15 O=C(O)C(CCO)CCBr Amb24616904 [0,0,0,0,0,0|2,0,0]=2 106 B9R0.15 O=C(O)C(CCS)CCS Amb27955283 [0,0,0,0,0,0|2,0,0]=2 107 B9R0.15 O=C=NC(CCF)C(=O)O Amb33471426 [0,0,0,0,0,0|3,0,1]=4 108 B9R0.15 O=CNC(CCF)C(=O)O Amb26995646 [0,0,0,0,0,0|3,0,1]=4 109 B9R0.15 O=CNC(CCO)C(=O)O Amb18305692 [0,0,0,0,0,0|3,0,1]=4 110 B9R0.15 O=CN[C@H](CCO)C(=O)O Amb27238455 [0,0,0,0,0,0|3,0,1]=4 111 B9R0.15 O=S(O)N(CCO)CCO Amb27839296 [0,0,0,0,0,0|4,0,0]=4 112 B9R0.15 OCCN(CCO)C(O)=S Amb25299180 [0,0,0,0,0,0|3,1,0]=4 113 B9R0.15 [N-]=[N+]=NC(CCN)C(=O)O Amb28397765 [0,0,0,0,0,0|4,0,0]=4 114 B8R0.15 C#CC[C@H](CC)C(=O)O Amb28120786 [1,0,0,0,0,0|0,0,2]=3 115 B8R0.15 C=C(C)C(CC)CCO Amb28321566 [1,0,0,0,0,0|3,0,0]=4 116 B8R0.15 C=C(C)C(CCC)NC Amb27667465 [1,0,0,0,0,0|3,0,0]=4 117 B8R0.15 C=C=C(CCC)C(=O)O Amb28045352 [1,0,0,0,0,0|0,0,3]=4 118 B8R0.15 C=CC(SCC)C(=O)O Amb27757608 [1,0,0,0,0,0|1,0,2]=4 119 B8R0.15 C=CCC(CC)C(=O)O Amb18642632 [1,0,0,0,0,0|0,0,2]=3 120 B8R0.15 C=CCC(CC)C(C)=O Amb28366808 [1,0,0,0,0,0|1,0,2]=4 121 B8R0.15 C=CCC(CC)C(N)=O Amb28398083 [1,0,0,0,0,0|1,0,2]=4 122 B8R0.15 C=CC[C@@H](CC)C(N)=O Amb27222326 [1,0,0,0,0,0|1,0,2]=4 123 B8R0.15 C=C[C@@H](CCC)C(=O)O Amb27658640 [1,0,0,0,0,0|0,0,2]=3 124 B8R0.15 CC=C=C(CC)C(=O)O Amb28289600 [1,0,0,0,0,0|0,0,3]=4 125 B8R0.15 CCC(CCF)C(=O)O Amb26321627 [1,0,0,0,0,0|1,0,0]=2 126 B8R0.15 CCC(CCN)C(=O)O Amb24699884 [1,0,0,0,0,0|1,0,0]=2 127 B8R0.15 CCC(CCN)C(=O)O Amb32662662 [1,0,0,0,0,0|1,0,0]=2 128 B8R0.15 CCC(CCN)S(C)=O Amb27873664 [1,0,0,0,0,0|3,0,0]=4 129 B8R0.15 CCC(CCO)C(=O)O Amb18642884 [1,0,0,0,0,0|1,0,0]=2 130 B8R0.15 CCC(COC)C(=O)O Amb18124352 [1,0,0,0,0,0|1,0,0]=2 131 B8R0.15 CCC(COC)C(C)=O Amb27593031 [1,0,0,0,0,0|2,0,0]=3 132 B8R0.15 CCC(COC)C(C)O Amb27460240 [1,0,0,0,0,0|2,0,1]=4 133 B8R0.15 CCC(CSC)C(=O)O Amb33272061 [1,0,0,0,0,0|1,0,0]=2 134 B8R0.15 CCC(N=C=O)C(=O)O Amb33471298 [1,0,0,0,0,0|2,0,1]=4 135 B8R0.15 CCC(N=C=S)C(=O)O Amb27265491 [1,0,0,0,0,0|2,0,1]=4 136 B8R0.15 CCC(NC#N)C(=O)O Amb35634498 [1,0,0,0,0,0|2,0,1]=4 137 B8R0.15 CCC(NC=O)C(=O)O Amb4016839 [1,0,0,0,0,0|2,0,1]=4 138 B8R0.15 CCC(SSC)C(=O)O Amb27236075 [1,0,0,0,0,0|2,0,0]=3 139 B8R0.15 CCCC(C#N)C(C)=O Amb24053569 [1,0,0,0,0,0|2,0,1]=4 140 B8R0.15 CCCC(C=O)C(=O)O Amb27464964 [1,0,0,0,0,0|1,0,1]=3 141 B8R0.15 CCCC(CBr)C(=O)Cl Amb27639323 [1,0,0,0,0,0|2,0,0]=3 142 B8R0.15 CCCC(CC)B(O)O Amb24464750 [1,0,0,0,0,0|1,0,1]=3 143 B8R0.15 CCCC(CC)C(=O)O Amb19009626 [1,0,0,0,0,0|0,0,0]=1 144 B8R0.15 CCCC(CC)C(C)C Amb26444655 [1,0,0,0,0,0|2,0,1]=4 145 B8R0.15 CCCC(CC)C(C)Cl Amb27837438 [1,0,0,0,0,0|2,0,1]=4 146 B8R0.15 CCCC(CC)C(C)N Amb19007899 [1,0,0,0,0,0|2,0,1]=4 147 B8R0.15 CCCC(CC)S(=O)Cl Amb32720451 [1,0,0,0,0,0|2,0,0]=3 148 B8R0.15 CCCC(CC)S(=O)[O-] Amb32754970 [1,0,0,0,0,0|1,0,1]=3 149 B8R0.15 CCCC(CC)S(N)=O Amb32720452 [1,0,0,0,0,0|2,0,0]=3 150 B8R0.15 CCCC(CC)[C@@H](C)N Amb33738431 [1,0,0,0,0,0|2,0,1]=4 151 B8R0.15 CCCC(CC)[C@H](C)N Amb33743273 [1,0,0,0,0,0|2,0,1]=4 152 B8R0.15 CCCC(CF)C(=O)O Amb27186472 [1,0,0,0,0,0|1,0,0]=2 153 B8R0.15 CCCC(CN)C(=O)O Amb19373497 [1,0,0,0,0,0|1,0,0]=2 154 B8R0.15 CCCC(CN)C(C)O Amb27253919 [1,0,0,0,0,0|2,0,1]=4 155 B8R0.15 CCCC(CO)C(=O)O Amb25881510 [1,0,0,0,0,0|1,0,0]=2 156 B8R0.15 CCCC(NC)C(=O)O Amb21961534 [1,0,0,0,0,0|1,0,0]=2 157 B8R0.15 CCCC(NC)C(=O)O Amb22587444 [1,0,0,0,0,0|1,0,0]=2 158 B8R0.15 CCCC(NC)C(=O)O Amb9496293 [1,0,0,0,0,0|1,0,0]=2 159 B8R0.15 CCCC(NC)C(N)=O Amb19006602 [1,0,0,0,0,0|2,0,0]=3 160 B8R0.15 CCCC(NO)C(=O)O Amb22372057 [1,0,0,0,0,0|2,0,0]=3 161 B8R0.15 CCCC(OC)C(=N)N Amb27860491 [1,0,0,0,0,0|3,0,0]=4 162 B8R0.15 CCCC(OC)C(=O)O Amb8455302 [1,0,0,0,0,0|1,0,0]=2 163 B8R0.15 CCCC(OC)C(C)=O Amb27207958 [1,0,0,0,0,0|2,0,0]=3 164 B8R0.15 CCCC(SC)C(=O)O Amb28289849 [1,0,0,0,0,0|1,0,0]=2 165 B8R0.15 CCCN(CC)C(=O)Cl Amb26023426 [1,0,0,0,0,0|2,0,0]=3 166 B8R0.15 CCCN(CO)C(C)=O Amb27956592 [1,0,0,0,0,0|3,0,0]=4 167 B8R0.15 CCCN(OC)C(C)=O Amb27409304 [1,0,0,0,0,0|3,0,0]=4 168 B8R0.15 CCC[C@@H](CC)B(O)O Amb27947027 [1,0,0,0,0,0|1,0,1]=3 169 B8R0.15 CCC[C@@H](CO)C(=O)O Amb24571859 [1,0,0,0,0,0|1,0,0]=2 170 B8R0.15 CCC[C@@H](CO)[C@H](C)O Amb28315465 [1,0,0,0,0,0|2,0,1]=4 171 B8R0.15 CCC[C@@H](NC)C(=O)O Amb25771939 [1,0,0,0,0,0|1,0,0]=2 172 B8R0.15 CCC[C@@H](NC)C(=O)O Amb33801471 [1,0,0,0,0,0|1,0,0]=2 173 B8R0.15 CCC[C@H](CN)C(=O)O Amb27460612 [1,0,0,0,0,0|1,0,0]=2 174 B8R0.15 CCC[C@H](CO)C(=O)O Amb25063310 [1,0,0,0,0,0|1,0,0]=2 175 B8R0.15 CCC[C@H](NC)C(=O)O Amb25062610 [1,0,0,0,0,0|1,0,0]=2 176 B8R0.15 CCC[C@H](NC)C(=O)O Amb33456398 [1,0,0,0,0,0|1,0,0]=2 177 B8R0.15 CCC[C@H](NC)C(N)=O Amb27475077 [1,0,0,0,0,0|2,0,0]=3 178 B8R0.15 CCN(CCCl)C(C)=O Amb27487959 [1,0,0,0,0,0|3,0,0]=4 179 B8R0.15 CCN(CCN)C(C)=O Amb17046897 [1,0,0,0,0,0|3,0,0]=4 180 B8R0.15 CCN(CCO)C(N)=O Amb27466149 [1,0,0,0,0,0|3,0,0]=4 181 B8R0.15 CCNC(CC)C(=O)O Amb33339265 [1,0,0,0,0,0|1,0,0]=2 182 B8R0.15 CCNC(CC)C(=O)O Amb9620054 [1,0,0,0,0,0|1,0,0]=2 183 B8R0.15 CCNC(CC)C(N)=O Amb19006590 [1,0,0,0,0,0|2,0,0]=3 184 B8R0.15 CCN[C@@H](CC)C(=O)O Amb26019582 [1,0,0,0,0,0|1,0,0]=2 185 B8R0.15 CCN[C@H](CC)C(=O)O Amb33347493 [1,0,0,0,0,0|1,0,0]=2 186 B8R0.15 CCOC(CC)C(=N)N Amb27834386 [1,0,0,0,0,0|3,0,0]=4 187 B8R0.15 CCOC(CC)C(=O)O Amb9675410 [1,0,0,0,0,0|1,0,0]=2 188 B8R0.15 CCOC(CC)C(C)O Amb27476457 [1,0,0,0,0,0|2,0,1]=4 189 B8R0.15 CCOC(CC)C(N)=O Amb8073028 [1,0,0,0,0,0|2,0,0]=3 190 B8R0.15 CCOC(CC)C(N)=S Amb27968746 [1,0,0,0,0,0|2,1,0]=4 191 B8R0.15 CCOC(CCl)C(C)=O Amb27254122 [1,0,0,0,0,0|3,0,0]=4 192 B8R0.15 CCOC(CS)C(=O)O Amb19037339 [1,0,0,0,0,0|2,0,0]=3 193 B8R0.15 CCSC(CC)C(=O)O Amb9675503 [1,0,0,0,0,0|1,0,0]=2 194 B8R0.15 CC[C@@H](N=C=O)C(=O)O Amb33471357 [1,0,0,0,0,0|2,0,1]=4 195 B8R0.15 CC[C@@H](N=C=S)C(=O)O Amb33471337 [1,0,0,0,0,0|2,0,1]=4 196 B8R0.15 CC[C@@H](NC#N)C(=O)O Amb35634501 [1,0,0,0,0,0|2,0,1]=4 197 B8R0.15 CC[C@H](CCCl)[C@@H](C)O Amb28312845 [1,0,0,0,0,0|2,0,1]=4 198 B8R0.15 CC[C@H](CCN)C(=O)O Amb27754665 [1,0,0,0,0,0|1,0,0]=2 199 B8R0.15 CC[C@H](NC#N)C(=O)O Amb35634500 [1,0,0,0,0,0|2,0,1]=4 200 B8R0.15 CC\C(=C/CBr)C(=O)O Amb27650570 [1,0,0,0,0,0|1,0,2]=4 201 B8R0.15 CC\C(=C/OC)C(=O)O Amb28369278 [1,0,0,0,0,0|1,0,2]=4 202 B8R0.15 CC\C(=N/OC)C(=O)O Amb27974474 [1,0,0,0,0,0|2,0,1]=4 203 B8R0.15 CC\C=C(/CC)C(N)=O Amb27799023 [1,0,0,0,0,0|1,0,2]=4 204 B8R0.15 CC\C=C(\CC)C(=O)O Amb27195307 [1,0,0,0,0,0|0,0,2]=3 205 B8R0.15 CNC(CCO)C(=O)O Amb27390592 [1,0,0,0,0,0|2,0,0]=3 206 B8R0.15 CNC(COC)C(=O)O Amb19304133 [1,0,0,0,0,0|2,0,0]=3 207 B8R0.15 CNC(COC)C(=O)O Amb22059040 [1,0,0,0,0,0|2,0,0]=3 208 B8R0.15 CNC(COC)C(N)=O Amb24120142 [1,0,0,0,0,0|3,0,0]=4 209 B8R0.15 CNC(COC)C(N)=O Amb32666305 [1,0,0,0,0,0|3,0,0]=4 210 B8R0.15 CNCC(C#N)C(=O)O Amb25756304 [1,0,0,0,0,0|2,0,1]=4 211 B8R0.15 CNCC(CO)C(=O)O Amb26352745 [1,0,0,0,0,0|2,0,0]=3 212 B8R0.15 CNCC(CO)C(=O)O Amb32661056 [1,0,0,0,0,0|2,0,0]=3 213 B8R0.15 CN[C@@H](COC)C(N)=O Amb26458948 [1,0,0,0,0,0|3,0,0]=4 214 B8R0.15 CN[C@@H](COC)C(N)=O Amb28935003 [1,0,0,0,0,0|3,0,0]=4 215 B8R0.15 CN[C@H](COC)C(=O)O Amb33347473 [1,0,0,0,0,0|2,0,0]=3 216 B8R0.15 CN[C@H](COC)C(N)=O Amb26507221 [1,0,0,0,0,0|3,0,0]=4 217 B8R0.15 CN[C@H](COC)C(N)=O Amb32661128 [1,0,0,0,0,0|3,0,0]=4 218 B8R0.15 COC(CC#N)C(=O)O Amb27157791 [1,0,0,0,0,0|2,0,1]=4 219 B8R0.15 COC(CCF)C(=O)O Amb33379286 [1,0,0,0,0,0|2,0,0]=3 220 B8R0.15 COC(CCN)C(=O)O Amb26631814 [1,0,0,0,0,0|2,0,0]=3 221 B8R0.15 COC(CCN)C(=O)O Amb32661022 [1,0,0,0,0,0|2,0,0]=3 222 B8R0.15 COCC(CN)C(=O)O Amb27219429 [1,0,0,0,0,0|2,0,0]=3 223 B8R0.15 COCC(NO)C(=O)O Amb27247213 [1,0,0,0,0,0|3,0,0]=4 224 B8R0.15 COCC(OC)C(=O)O Amb26627988 [1,0,0,0,0,0|2,0,0]=3 225 B8R0.15 COCC(ON)C(=O)O Amb27251693 [1,0,0,0,0,0|3,0,0]=4 226 B8R0.15 COCC(ON)C(=O)O Amb32670944 [1,0,0,0,0,0|3,0,0]=4 227 B8R0.15 COCC(SC)C(=O)O Amb28046503 [1,0,0,0,0,0|2,0,0]=3 228 B8R0.15 CSCC(CN)C(=O)O Amb33272062 [1,0,0,0,0,0|2,0,0]=3 229 B8R0.15 C\C=C(/CCC)C(C)=O Amb27206702 [1,0,0,0,0,0|1,0,2]=4 230 B8R0.15 C\C=C(/CCN)C(=O)O Amb27493438 [1,0,0,0,0,0|1,0,2]=4 231 B8R0.15 C\C=C(/CNC)C(=O)O Amb27881689 [1,0,0,0,0,0|1,0,2]=4 232 B8R0.15 C\C=C(/OCC)C(=O)O Amb18642768 [1,0,0,0,0,0|1,0,2]=4 233 B8R0.15 C\C=C(\CNC)C(=O)O Amb27954442 [1,0,0,0,0,0|1,0,2]=4 234 B8R0.15 C\C=C\[C@@H](CC)C(=O)O Amb28388676 [1,0,0,0,0,0|0,0,2]=3 235 B8R0.15 C\C=N\[C@H](CO)C(=O)O Amb28423512 [1,0,0,0,0,0|2,0,1]=4 236 B8R0.15 N#CC(CCF)C(=O)O Amb35741465 [1,0,0,0,0,0|2,0,1]=4 237 B8R0.15 N#CC(CCO)C(=O)O Amb35741464 [1,0,0,0,0,0|2,0,1]=4 238 B8R0.15 NCC(CCF)C(=O)O Amb33196465 [1,0,0,0,0,0|2,0,0]=3 239 B8R0.15 O=C(O)C(CO)CCF Amb27876842 [1,0,0,0,0,0|2,0,0]=3 240 B8R0.15 O=C(O)C(CS)CCS Amb27477377 [1,0,0,0,0,0|2,0,0]=3 241 B8R0.15 O=C(O)[C@H](CS)NCO Amb27980938 [1,0,0,0,0,0|3,0,0]=4 242 B8R0.22 C#CC(CCC)CCC Amb33169083 [1,0,0,0,0,0|1,0,1]=3 243 B8R0.22 C#CC(CCC)CCO Amb17593315 [1,0,0,0,0,0|2,0,1]=4 244 B8R0.22 C#CN(CCC)CCC Amb2721425 [1,0,0,0,0,0|2,0,1]=4 245 B8R0.22 C=CC(CC=O)CCC Amb18642456 [1,0,0,0,0,0|2,0,1]=4 246 B8R0.22 C=CC(CCC)CCC Amb25976970 [1,0,0,0,0,0|1,0,0]=2 247 B8R0.22 C=CC(COC)NCC Amb27853613 [1,0,0,0,0,0|3,0,0]=4 248 B8R0.22 C=CC(OCC)OCC Amb2694779 [1,0,0,0,0,0|3,0,0]=4 249 B8R0.22 C=CC[C@H](CO)CCC Amb27197462 [1,0,0,0,0,0|0,0,3]=4 250 B8R0.22 CCCC(=CBr)CCC Amb28314597 [1,0,0,0,0,0|1,0,1]=3 251 B8R0.22 CCCC(C#N)CCC Amb8950049 [1,0,0,0,0,0|1,0,1]=3 252 B8R0.22 CCCC(C#N)NCC Amb9205111 [1,0,0,0,0,0|2,0,1]=4 253 B8R0.22 CCCC(C=O)CCC Amb3941072 [1,0,0,0,0,0|0,0,0]=1 254 B8R0.22 CCCC(C=O)CCO Amb28322024 [1,0,0,0,0,0|1,0,0]=2 255 B8R0.22 CCCC(CBr)CCC Amb25709527 [1,0,0,0,0,0|1,0,1]=3 256 B8R0.22 CCCC(CBr)COC Amb27836974 [1,0,0,0,0,0|2,0,1]=4 257 B8R0.22 CCCC(CBr)OCC Amb27614361 [1,0,0,0,0,0|2,0,1]=4 258 B8R0.22 CCCC(CC)CCBr Amb27481671 [1,0,0,0,0,0|2,0,1]=4 259 B8R0.22 CCCC(CC)CNC Amb27837464 [1,0,0,0,0,0|2,0,1]=4 260 B8R0.22 CCCC(CCC)=NN Amb27396753 [1,0,0,0,0,0|2,0,1]=4 261 B8R0.22 CCCC(CCC)=NO Amb27757531 [1,0,0,0,0,0|1,0,1]=3 262 B8R0.22 CCCC(CCC)NN Amb6246889 [1,0,0,0,0,0|2,0,0]=3 263 B8R0.22 CCCC(CCC)[Zn]Br Amb22000410 [1,0,0,0,0,0|2,0,0]=3 264 B8R0.22 CCCC(CCO)OC Amb27981921 [1,0,0,0,0,0|3,0,0]=4 265 B8R0.22 CCCC(CCO)SC Amb8515403 [1,0,0,0,0,0|3,0,0]=4 266 B8R0.22 CCCC(CCl)CCC Amb25821511 [1,0,0,0,0,0|1,0,1]=3 267 B8R0.22 CCCC(CCl)COC Amb27234413 [1,0,0,0,0,0|2,0,1]=4 268 B8R0.22 CCCC(CN)CCBr Amb27205781 [1,0,0,0,0,0|2,0,1]=4 269 B8R0.22 CCCC(CN)CCC Amb8950145 [1,0,0,0,0,0|1,0,1]=3 270 B8R0.22 CCCC(CN)CCO Amb19149196 [1,0,0,0,0,0|2,0,1]=4 271 B8R0.22 CCCC(CN)COC Amb25683544 [1,0,0,0,0,0|2,0,1]=4 272 B8R0.22 CCCC(CN)OCC Amb27655556 [1,0,0,0,0,0|2,0,1]=4 273 B8R0.22 CCCC(CNC)OC Amb28249228 [1,0,0,0,0,0|3,0,0]=4 274 B8R0.22 CCCC(CO)CCC Amb3939150 [1,0,0,0,0,0|0,0,1]=2 275 B8R0.22 CCCC(CO)COC Amb24481610 [1,0,0,0,0,0|1,0,1]=3 276 B8R0.22 CCCC(CO)NCC Amb27173701 [1,0,0,0,0,0|1,0,1]=3 277 B8R0.22 CCCC(CS)CCC Amb33273117 [1,0,0,0,0,0|0,1,1]=3 278 B8R0.22 CCCN(C#N)CCC Amb25371353 [1,0,0,0,0,0|2,0,1]=4 279 B8R0.22 CCCN(C=O)CCC Amb2720953 [1,0,0,0,0,0|1,0,0]=2 280 B8R0.22 CCCN(C=O)CCO Amb27644220 [1,0,0,0,0,0|2,0,0]=3 281 B8R0.22 CCCN(CBr)CCC Amb28291529 [1,0,0,0,0,0|2,0,1]=4 282 B8R0.22 CCCN(CCC)N=O Amb17672889 [1,0,0,0,0,0|2,0,0]=3 283 B8R0.22 CCCN(CCl)CCC Amb27784746 [1,0,0,0,0,0|2,0,1]=4 284 B8R0.22 CCC[C@@H](C=O)NC=O Amb27438421 [1,0,0,0,0,0|2,0,1]=4 285 B8R0.22 CCC[C@@H](CCO)SC Amb28315487 [1,0,0,0,0,0|3,0,0]=4 286 B8R0.22 CCC[C@H](CC)CCO Amb27972329 [1,0,0,0,0,0|2,0,1]=4 287 B8R0.22 CCC[C@H](CCO)OC Amb27662097 [1,0,0,0,0,0|3,0,0]=4 288 B8R0.22 CCC[C@H](CCO)SC Amb27405245 [1,0,0,0,0,0|3,0,0]=4 289 B8R0.22 CCC[SiH](CCl)CCC Amb27945564 [1,0,0,0,0,0|1,1,1]=4 290 B8R0.22 CCOC(C=O)CC=O Amb17593368 [1,0,0,0,0,0|2,0,1]=4 291 B8R0.22 CCOC(C=O)SCC Amb27411799 [1,0,0,0,0,0|2,0,0]=3 292 B8R0.22 CCOC(CO)OCC Amb8391143 [1,0,0,0,0,0|2,0,1]=4 293 B8R0.22 CCSC(C=O)SCC Amb17609603 [1,0,0,0,0,0|2,0,0]=3 294 B8R0.22 CCSC(CO)SCC Amb28189456 [1,0,0,0,0,0|2,0,1]=4 295 B8R0.22 COCC(CO)COC Amb28348687 [1,0,0,0,0,0|2,0,1]=4 296 B8R0.22 O=CN(CCCl)CCCl Amb28285271 [1,0,0,0,0,0|3,0,0]=4 297 B8R0.22 [C-]#[N+]C(CCC)CCC Amb32731026 [1,0,0,0,0,0|2,0,0]=3 298 B10R0.23 C#CCC(NC(C)C)C(=O)O Amb27986652 [0,1,0,0,0,0|1,0,2]=4 299 B10R0.23 C=CCC(CC(C)C)C(=O)O Amb18126004 [0,1,0,0,0,0|0,0,2]=3 300 B10R0.23 CC(=O)N(CCCl)CC(C)Cl Amb17236716 [0,1,0,0,0,0|3,0,0]=4 301 B10R0.23 CC(=O)N(CCO)CC(C)O Amb17232360 [0,1,0,0,0,0|3,0,0]=4 302 B10R0.23 CC(=O)NC(CCF)C(=O)O Amb26651079 [0,1,0,0,0,0|2,0,1]=4 303 B10R0.23 CC(=O)NC(CCO)C(=O)O Amb8631250 [0,1,0,0,0,0|2,0,1]=4 304 B10R0.23 CC(=O)NC(CCS)C(=O)O Amb18127932 [0,1,0,0,0,0|2,0,1]=4 305 B10R0.23 CC(=O)N[C@@H](CCS)C(=O)O Amb27990115 [0,1,0,0,0,0|2,0,1]=4 306 B10R0.23 CC(C)CC(CCO)C(=O)[O-] Amb32413933 [0,1,0,0,0,0|1,0,1]=3 307 B10R0.23 CC(C)CC(N=C=S)C(=O)O Amb33471520 [0,1,0,0,0,0|2,0,1]=4 308 B10R0.23 CC(C)CC(N=[N+]=[N-])C(=O)O Amb27672112 [0,1,0,0,0,0|3,0,0]=4 309 B10R0.23 CC(C)CC(NC=O)C(=O)O Amb20093368 [0,1,0,0,0,0|2,0,1]=4 310 B10R0.23 CC(C)C[C@@H](CC#N)C(=O)O Amb8388943 [0,1,0,0,0,0|1,0,1]=3 311 B10R0.23 CC(C)C[C@@H](CCN)C(=O)O Amb29838297 [0,1,0,0,0,0|1,0,0]=2 312 B10R0.23 CC(C)C[C@@H](N=C=O)C(=O)O Amb33471341 [0,1,0,0,0,0|2,0,1]=4 313 B10R0.23 CC(C)C[C@@H](N=C=S)C(=O)O Amb33471570 [0,1,0,0,0,0|2,0,1]=4 314 B10R0.23 CC(C)C[C@@H](N=[N+]=[N-])C(=O)O Amb27672119 [0,1,0,0,0,0|3,0,0]=4 315 B10R0.23 CC(C)C[C@@H](N=[N+]=[N-])C(=O)O Amb32620221 [0,1,0,0,0,0|3,0,0]=4 316 B10R0.23 CC(C)C[C@@H](NC=O)C(=O)O Amb10607151 [0,1,0,0,0,0|2,0,1]=4 317 B10R0.23 CC(C)C[C@H](N=C=O)C(=O)O Amb33471338 [0,1,0,0,0,0|2,0,1]=4 318 B10R0.23 CC(C)C[C@H](N=C=S)C(=O)O Amb33471566 [0,1,0,0,0,0|2,0,1]=4 319 B10R0.23 CC(C)C[C@H](N=[N+]=[N-])C(=O)O Amb32620193 [0,1,0,0,0,0|3,0,0]=4 320 B10R0.23 CC(C)C[C@H](NC=O)C(=O)O Amb9813711 [0,1,0,0,0,0|2,0,1]=4 321 B10R0.23 CC(O)CC(NC=O)C(=O)O Amb33066257 [0,1,0,0,0,0|2,0,1]=4 322 B10R0.23 CCCC(CC(=O)O)C(=O)O Amb18645267 [0,1,0,0,0,0|1,0,1]=3 323 B10R0.23 CCCC(CC(C)=O)C(=O)O Amb533160 [0,1,0,0,0,0|0,0,1]=2 324 B10R0.23 CCCC(CC(C)C)C(=O)O Amb18791931 [0,1,0,0,0,0|0,0,0]=1 325 B10R0.23 CCCC(NC(C)=O)C(=O)Cl Amb27673640 [0,1,0,0,0,0|2,0,1]=4 326 B10R0.23 CCCC(NC(C)=O)C(=O)O Amb4013563 [0,1,0,0,0,0|1,0,1]=3 327 B10R0.23 CCCC(NC(C)=O)C(N)=O Amb27988366 [0,1,0,0,0,0|2,0,1]=4 328 B10R0.23 CCCC(NC(C)C)C(=O)O Amb28960316 [0,1,0,0,0,0|1,0,0]=2 329 B10R0.23 CCCC(NC(C)C)C(=O)O Amb9496296 [0,1,0,0,0,0|1,0,0]=2 330 B10R0.23 CCCC(NC(N)=O)C(=O)O Amb9495809 [0,1,0,0,0,0|2,0,1]=4 331 B10R0.23 CCCN(CC(C)O)C(C)=O Amb18265789 [0,1,0,0,0,0|2,0,0]=3 332 B10R0.23 CCC[C@@H](NC(C)=O)C(=O)O Amb3941420 [0,1,0,0,0,0|1,0,1]=3 333 B10R0.23 CCC[C@@H](NC(N)=O)C(=O)O Amb27000197 [0,1,0,0,0,0|2,0,1]=4 334 B10R0.23 CCC[C@H](NC(C)=O)C(=O)O Amb3941421 [0,1,0,0,0,0|1,0,1]=3 335 B10R0.23 CCC[C@H](NC(C)=O)C(N)=O Amb27671257 [0,1,0,0,0,0|2,0,1]=4 336 B10R0.23 CCN[C@@H](CC(C)C)C(=O)O Amb33347488 [0,1,0,0,0,0|1,0,0]=2 337 B10R0.23 CCN[C@H](CC(C)C)C(=O)O Amb33347485 [0,1,0,0,0,0|1,0,0]=2 338 B10R0.23 CCSC(NC(C)=O)C(=O)O Amb27989933 [0,1,0,0,0,0|2,0,1]=4 339 B10R0.23 CC\C=C(/CC(C)C)C(C)=O Amb28080336 [0,1,0,0,0,0|1,0,2]=4 340 B10R0.23 CC\C=C(\CC(C)=O)C(=O)O Amb27001155 [0,1,0,0,0,0|0,0,3]=4 341 B10R0.23 CNCC(NC(C)=O)C(=O)O Amb27269521 [0,1,0,0,0,0|2,0,1]=4 342 B10R0.23 CNC[C@H](NC(C)=O)C(=O)O Amb25383164 [0,1,0,0,0,0|2,0,1]=4 343 B10R0.23 COCC(CC(=O)O)C(=O)O Amb4007524 [0,1,0,0,0,0|2,0,1]=4 344 B10R0.23 COCC(NC(C)=O)C(=O)O Amb8385373 [0,1,0,0,0,0|2,0,1]=4 345 B10R0.23 COC[C@@H](NC(C)=O)C(=O)O Amb27990008 [0,1,0,0,0,0|2,0,1]=4 346 B10R0.23 COC[C@H](NC(C)=O)C(=O)O Amb26999845 [0,1,0,0,0,0|2,0,1]=4 347 B10R0.23 CSCC(CC(=O)O)C(=O)O Amb32953699 [0,1,0,0,0,0|2,0,1]=4 348 B10R0.23 CSCC(NC(C)=O)C(=O)O Amb4013561 [0,1,0,0,0,0|2,0,1]=4 349 B10R0.23 CSC[C@H](NC(C)=O)C(=O)O Amb17607605 [0,1,0,0,0,0|2,0,1]=4 350 B10R0.23 O=C(O)CC(CCF)C(=O)O Amb33196068 [0,1,0,0,0,0|2,0,1]=4 351 B10R0.30 C=CC(N)C(CCC)C(=O)O Amb33036388 [0,1,0,0,0,0|0,0,2]=3 352 B10R0.30 C=CC(O)C(CCC)C(=O)O Amb33036253 [0,1,0,0,0,0|0,0,2]=3 353 B10R0.30 CCC(C)C(N=C=S)C(=O)O Amb33471525 [0,1,0,0,0,0|2,0,1]=4 354 B10R0.30 CCC(C)C(N=[N+]=[N-])C(=O)O Amb26083926 [0,1,0,0,0,0|3,0,0]=4 355 B10R0.30 CCC(C)C(NC=O)C(=O)O Amb18305393 [0,1,0,0,0,0|2,0,1]=4 356 B10R0.30 CCC(C)[C@@H](N=[N+]=[N-])C(=O)O Amb32620201 [0,1,0,0,0,0|3,0,0]=4 357 B10R0.30 CCC(C)[C@H](N=[N+]=[N-])C(=O)O Amb32620190 [0,1,0,0,0,0|3,0,0]=4 358 B10R0.30 CCCC(C(=O)O)C(=O)NN Amb27988463 [0,1,0,0,0,0|2,0,1]=4 359 B10R0.30 CCCC(C(=O)O)C(=O)OC Amb32651668 [0,1,0,0,0,0|1,0,1]=3 360 B10R0.30 CCCC(C(=O)O)C(N)CC Amb31295673 [0,1,0,0,0,0|0,0,0]=1 361 B10R0.30 CCCC(C(=O)O)C(O)CC Amb17615942 [0,1,0,0,0,0|0,0,0]=1 362 B10R0.30 CCN[C@@H](C(=O)O)[C@@H](C)CC Amb33347481 [0,1,0,0,0,0|1,0,0]=2 363 B10R0.30 CCN[C@@H](C(=O)O)[C@@H](C)OC Amb33347479 [0,1,0,0,0,0|2,0,0]=3 364 B10R0.30 CCN[C@H](C(=O)O)[C@H](C)CC Amb33347496 [0,1,0,0,0,0|1,0,0]=2 365 B10R0.30 CC[C@@H](C)[C@@H](N=C=O)C(=O)O Amb33471370 [0,1,0,0,0,0|2,0,1]=4 366 B10R0.30 CC[C@@H](C)[C@@H](N=C=S)C(=O)O Amb33471602 [0,1,0,0,0,0|2,0,1]=4 367 B10R0.30 CC[C@@H](C)[C@@H](NC=O)C(=O)O Amb27990013 [0,1,0,0,0,0|2,0,1]=4 368 B10R0.30 CC[C@H](C)C(N=[N+]=[N-])C(=O)O Amb27673369 [0,1,0,0,0,0|3,0,0]=4 369 B10R0.30 CC[C@H](C)[C@@H](N=[N+]=[N-])C(=O)O Amb27673378 [0,1,0,0,0,0|3,0,0]=4 370 B10R0.30 CC[C@H](C)[C@H](N=C=O)C(=O)O Amb32664353 [0,1,0,0,0,0|2,0,1]=4 371 B10R0.30 CC[C@H](C)[C@H](N=C=S)C(=O)O Amb33471563 [0,1,0,0,0,0|2,0,1]=4 372 B10R0.30 CC[C@H](C)[C@H](NC=O)C(=O)O Amb18179874 [0,1,0,0,0,0|2,0,1]=4 373 B10R0.73 C#CC(C)C(CCC)CCC Amb32730979 [0,1,0,0,0,0|2,0,1]=4 374 B10R0.73 C=C(CN)C(CCC)CCC Amb33273445 [0,1,0,0,0,0|2,0,0]=3 375 B10R0.73 C=CC(=O)C(CCC)CCC Amb33473774 [0,1,0,0,0,0|1,0,0]=2 376 B10R0.73 C=CC(O)C(CCC)CCC Amb33358716 [0,1,0,0,0,0|1,0,1]=3 377 B10R0.73 CCCC(CCC)C(=O)CN Amb32731160 [0,1,0,0,0,0|1,0,0]=2 378 B10R0.73 CCCC(CCC)C(=O)NN Amb31295741 [0,1,0,0,0,0|1,0,0]=2 379 B10R0.73 CCCC(CCC)C(=O)O[Na] Amb17934251 [0,1,0,0,0,0|0,0,0]=1 380 B10R0.73 CCCC(CCC)C(C)C#N Amb32731133 [0,1,0,0,0,0|2,0,1]=4 381 B10R0.73 CCCC(CCC)C(C)C=O Amb32730952 [0,1,0,0,0,0|1,0,1]=3 382 B10R0.73 CCCC(CCC)C(C)CN Amb32731145 [0,1,0,0,0,0|2,0,1]=4 383 B10R0.73 CCCC(CCC)C(C)ON Amb32730998 [0,1,0,0,0,0|1,0,1]=3 384 B10R0.73 CCCC(CCC)C(F)CN Amb32731016 [0,1,0,0,0,0|2,0,1]=4 385 B10R0.73 CCCC(CCC)C(N)CO Amb32954217 [0,1,0,0,0,0|1,0,1]=3 386 B10R0.73 CCCC(CCC)C(O)CF Amb33273452 [0,1,0,0,0,0|1,0,1]=3 387 B10R0.73 CCCC(CCC)C(O)CN Amb33079059 [0,1,0,0,0,0|1,0,1]=3 388 B10R0.73 CCCC(CCC)C(O)CO Amb33273453 [0,1,0,0,0,0|0,0,2]=3 389 B10R0.73 CCCC(CCC)[C@@H](N)CO Amb32731013 [0,1,0,0,0,0|1,0,1]=3 390 B10R0.73 CCCC(CCC)[C@@H](O)CN Amb32731015 [0,1,0,0,0,0|1,0,1]=3 391 B10R0.73 CCCC(CCC)[C@H](N)CO Amb33449251 [0,1,0,0,0,0|1,0,1]=3 392 B10R0.73 CCCC(CCC)[C@H](O)CN Amb32731014 [0,1,0,0,0,0|1,0,1]=3 393 B10R0.73 CCCC(N=C=O)C(=O)OC Amb33471429 [0,1,0,0,0,0|2,0,1]=4 394 B10R0.73 CCCC(N=C=S)C(=O)OC Amb10607688 [0,1,0,0,0,0|2,0,1]=4 395 B10R0.73 CCCC(OCC)\C(N)=N\O Amb33033611 [0,1,0,0,0,0|2,0,0]=3 396 B10R0.73 CCCN(CCC)C(=O)CBr Amb17332773 [0,1,0,0,0,0|2,0,0]=3 397 B10R0.73 CCCN(CCC)C(=O)CCl Amb6273532 [0,1,0,0,0,0|2,0,0]=3 398 B10R0.73 CCCN(CCC)C(=O)CN Amb5783175 [0,1,0,0,0,0|2,0,0]=3 399 B10R0.73 CCCN(CCC)C(=O)CO Amb5798175 [0,1,0,0,0,0|1,0,0]=2 400 B10R0.73 CCCN(CCC)\C(N)=N\O Amb18800174 [0,1,0,0,0,0|2,0,0]=3 401 B10R0.73 CCCN(CCCl)C(=O)OC Amb24095840 [0,1,0,0,0,0|2,0,0]=3 402 B10R0.73 CCC[C@@H](N=C=O)C(=O)OC Amb33471416 [0,1,0,0,0,0|2,0,1]=4 403 B10R0.73 CCC[C@@H](N=C=S)C(=O)OC Amb33471650 [0,1,0,0,0,0|2,0,1]=4 404 B10R0.73 CCC[C@H](N=C=O)C(=O)OC Amb33471410 [0,1,0,0,0,0|2,0,1]=4 405 B10R0.73 CCC[C@H](N=C=S)C(=O)OC Amb33471638 [0,1,0,0,0,0|2,0,1]=4 406 B10R0.73 CCOC(OCC)C(=N)OC Amb15693138 [0,1,0,0,0,0|3,0,0]=4 407 B10R0.73 CCOC(OCC)C(=O)CCl Amb33341994 [0,1,0,0,0,0|3,0,0]=4 408 B10R0.73 CCOC(OCC)C(=O)CN Amb33341372 [0,1,0,0,0,0|3,0,0]=4 409 B10R0.73 COC(=O)C(CCN)CCN Amb29083315 [0,1,0,0,0,0|2,0,0]=3 410 B10R0.73 [C-]#[N+]C(C)C(CCC)CCC Amb32731024 [0,1,0,0,0,0|2,0,1]=4 411 B10R0.88 CCCC(CCCO)C(=O)O Amb33421979 [0,1,0,0,0,0|0,0,0]=1 412 B10R0.88 CCCC(CCCO)C(=O)[O-] Amb17615944 [0,1,0,0,0,0|0,0,1]=2 413 B10R0.88 CCCC(CCCO)C(=O)[O-] Amb33362238 [0,1,0,0,0,0|0,0,1]=2 414 B10R0.88 CCCCC(N=C=S)C(=O)O Amb33471522 [0,1,0,0,0,0|2,0,1]=4 415 B10R0.88 CCCCC(NC=O)C(=O)O Amb18179873 [0,1,0,0,0,0|2,0,1]=4 416 B10R0.88 CCCCC(OCC)C(=O)O Amb33624644 [0,1,0,0,0,0|1,0,0]=2 417 B10R0.88 CCCC[C@@H](N=C=O)C(=O)O Amb33471346 [0,1,0,0,0,0|2,0,1]=4 418 B10R0.88 CCCC[C@@H](N=C=S)C(=O)O Amb33471576 [0,1,0,0,0,0|2,0,1]=4 419 B10R0.88 CCCC[C@@H](NCC)C(=O)O Amb33347490 [0,1,0,0,0,0|1,0,0]=2 420 B10R0.88 CCCC[C@H](N=C=O)C(=O)O Amb33471343 [0,1,0,0,0,0|2,0,1]=4 421 B10R0.88 CCCC[C@H](N=C=S)C(=O)O Amb33471572 [0,1,0,0,0,0|2,0,1]=4 422 B10R0.88 CCCC[C@H](NC=O)C(=O)O Amb33774736 [0,1,0,0,0,0|2,0,1]=4 423 B10R0.88 CCCN(CCCO)C(C)=O Amb18928597 [0,1,0,0,0,0|2,0,0]=3 424 B10R0.88 CCN[C@@H](COCC)C(=O)O Amb33347504 [0,1,0,0,0,0|1,0,0]=2 425 B10R0.88 CCN[C@H](CCSC)C(=O)O Amb33347486 [0,1,0,0,0,0|1,0,0]=2 426 B10R0.88 CCOCC(N=[N+]=[N-])C(=O)O Amb32679570 [0,1,0,0,0,0|3,0,0]=4 427 B10R0.88 CCOCC(NC=O)C(=O)O Amb33309089 [0,1,0,0,0,0|2,0,1]=4 428 B10R0.88 CCOC[C@@H](N=C=O)C(=O)O Amb33471508 [0,1,0,0,0,0|2,0,1]=4 429 B10R0.88 CCOC[C@@H](N=C=S)C(=O)O Amb33471742 [0,1,0,0,0,0|2,0,1]=4 430 B10R0.88 COCCC(N=C=O)C(=O)O Amb33471358 [0,1,0,0,0,0|2,0,1]=4 431 B10R0.88 COCCC(N=C=S)C(=O)O Amb33471588 [0,1,0,0,0,0|2,0,1]=4 432 B10R0.88 COCCC(NC=O)C(=O)O Amb18183451 [0,1,0,0,0,0|2,0,1]=4 433 B10R0.88 COCCN(CCN)C(C)=O Amb32644975 [0,1,0,0,0,0|3,0,0]=4 434 B10R0.88 CSCCC(N=C=O)C(=O)O Amb33471293 [0,1,0,0,0,0|2,0,1]=4 435 B10R0.88 CSCCC(N=C=S)C(=O)O Amb33194605 [0,1,0,0,0,0|2,0,1]=4 436 B10R0.88 CSCC[C@@H](N=[N+]=[N-])C(=O)O Amb32620204 [0,1,0,0,0,0|3,0,0]=4 437 B10R0.88 CSCC[C@@H](NC=O)C(=O)O Amb18180656 [0,1,0,0,0,0|2,0,1]=4 438 B10R0.88 CSCC[C@H](N=C=O)C(=O)O Amb33471339 [0,1,0,0,0,0|2,0,1]=4 439 B10R0.88 CSCC[C@H](N=C=S)C(=O)O Amb33471567 [0,1,0,0,0,0|2,0,1]=4 440 B10R0.88 CSCC[C@H](N=[N+]=[N-])C(=O)O Amb32620233 [0,1,0,0,0,0|3,0,0]=4 441 B10R0.88 CSCC[C@H](NC=O)C(=O)O Amb16232222 [0,1,0,0,0,0|2,0,1]=4 442 B10R0.88 O=CNC(CCCF)C(=O)O Amb33127554 [0,1,0,0,0,0|2,0,1]=4 443 B10R0.88 O=CNC(CCCO)C(=O)O Amb33037084 [0,1,0,0,0,0|2,0,1]=4 444 B10R0.103 C#CCC(C)(CCC)C(=O)O Amb27670926 [0,1,0,0,0,0|0,0,2]=3 445 B10R0.103 CCCC(Br)(CCC)C(=O)O Amb32668938 [0,1,0,0,0,0|0,0,0]=1 446 B10R0.103 CCCC(C)(N=C=O)C(=O)O Amb33471325 [0,1,0,0,0,0|2,0,1]=4 447 B10R0.103 CCCC(C)(N=C=S)C(=O)O Amb33471557 [0,1,0,0,0,0|2,0,1]=4 448 B10R0.103 CCCC(C)(\C=C\Cl)C(=O)O Amb27990047 [0,1,0,0,0,0|1,0,2]=4 449 B10R0.103 CCCC(N)(CCC)C(=O)O Amb4134833 [0,1,0,0,0,0|0,0,0]=1 450 B10R0.103 CCCC(O)(CCC)C(=O)O Amb18177682 [0,1,0,0,0,0|0,0,0]=1 451 B10R0.103 CCOC(C)(OCC)C(C)=O Amb17593999 [0,1,0,0,0,0|3,0,0]=4 452 B10R0.139 CCCC(CCC)C(C)(C)N Amb32731171 [0,1,0,0,0,0|2,0,1]=4 453 B10R0.139 CCCC(CCC)C(C)(C)O Amb32731039 [0,1,0,0,0,0|1,0,1]=3 454 B10R0.139 CCCC(CCC)S(=O)(=O)Cl Amb33539561 [0,1,0,0,0,0|1,0,1]=3 455 B10R0.139 CCCC(CCC)S(=O)(=O)F Amb32717745 [0,1,0,0,0,0|1,0,1]=3 456 B10R0.139 CCCC(CCC)S(N)(=O)=O Amb18809260 [0,1,0,0,0,0|1,0,1]=3 457 B10R0.139 CCCN(CCC)S(=O)(=O)Cl Amb1126564 [0,1,0,0,0,0|2,0,1]=4 458 B10R1.4 C=C1CCCCC1CCBr Amb28437183 [0,0,0,1,0,0|3,0,0]=4 459 B10R1.4 C=C1CCCCC1CCO Amb27839461 [0,0,0,1,0,0|3,0,0]=4 460 B10R1.4 C=CCC1CCCCC1=O Amb2720504 [0,0,0,1,0,0|1,0,2]=4 461 B10R1.4 C=CCC1CCCOC1=O Amb28429739 [0,0,0,1,0,0|0,0,2]=3 462 B10R1.4 CC#CC1CCCCC1=O Amb24736857 [0,0,0,1,0,0|1,0,2]=4 463 B10R1.4 CC1=CCCCC1CCBr Amb27872282 [0,0,0,1,0,0|3,0,0]=4 464 B10R1.4 CC1=CCCCC1CCO Amb27406532 [0,0,0,1,0,0|3,0,0]=4 465 B10R1.4 CCCC1=CCCCC1=O Amb24722898 [0,0,0,1,0,0|1,0,2]=4 466 B10R1.4 CCCC1CCC=CC1=O Amb27750345 [0,0,0,1,0,0|1,0,1]=3 467 B10R1.4 CCCC1CCCCC1=O Amb22228916 [0,0,0,1,0,0|1,0,0]=2 468 B10R1.4 CCCC1CCCCC1C Amb22227983 [0,0,0,1,0,0|2,0,1]=4 469 B10R1.4 CCCC1CCCCC1N Amb18282859 [0,0,0,1,0,0|2,0,1]=4 470 B10R1.4 CCCC1CCCCC1O Amb4016404 [0,0,0,1,0,0|1,0,1]=3 471 B10R1.4 CCCC1CCCCN1N Amb24478422 [0,0,0,1,0,0|3,0,0]=4 472 B10R1.4 CCCC1CCCNC1=O Amb27475482 [0,0,0,1,0,0|1,0,0]=2 473 B10R1.4 CCCC1CCCOC1=O Amb25068420 [0,0,0,1,0,0|0,0,0]=1 474 B10R1.4 CCCC1CCNCC1=O Amb27629020 [0,0,0,1,0,0|2,0,0]=3 475 B10R1.4 CCCC1CSCCC1=O Amb24736412 [0,0,0,1,0,0|2,0,0]=3 476 B10R1.4 CCCC1NCCNC1=O Amb18960335 [0,0,0,1,0,0|2,0,0]=3 477 B10R1.4 CCCN1CCCCC1=S Amb25348522 [0,0,0,1,0,0|2,1,0]=4 478 B10R1.4 CCCN1CCCNC1=O Amb28049410 [0,0,0,1,0,0|2,0,0]=3 479 B10R1.4 CCCN1CCNCC1=O Amb18285094 [0,0,0,1,0,0|3,0,0]=4 480 B10R1.4 CCCN1CCNCC1=O Amb22586868 [0,0,0,1,0,0|3,0,0]=4 481 B10R1.4 CCCN1CCNCC1=O Amb32412620 [0,0,0,1,0,0|3,0,0]=4 482 B10R1.4 CCC[C@@H]1CCCCC1=O Amb25146733 [0,0,0,1,0,0|1,0,0]=2 483 B10R1.4 CCC[C@@H]1CCCC[C@@H]1O Amb28053539 [0,0,0,1,0,0|1,0,1]=3 484 B10R1.4 CCC[C@@H]1CCCC[C@H]1O Amb28455302 [0,0,0,1,0,0|1,0,1]=3 485 B10R1.4 CCC[C@@H]1CSCC[C@@H]1O Amb27206130 [0,0,0,1,0,0|2,0,1]=4 486 B10R1.4 CCC[C@H]1CCCCN1C Amb27975671 [0,0,0,1,0,0|3,0,0]=4 487 B10R1.4 CCC[C@H]1CCCC[C@@H]1C Amb24594797 [0,0,0,1,0,0|2,0,1]=4 488 B10R1.4 CCC[C@H]1CCCC[C@H]1C Amb22230418 [0,0,0,1,0,0|2,0,1]=4 489 B10R1.4 CCC[C@H]1CCCC[C@H]1O Amb27221631 [0,0,0,1,0,0|1,0,1]=3 490 B10R1.4 CCC[C@H]1CCNC[C@H]1O Amb27203949 [0,0,0,1,0,0|2,0,1]=4 491 B10R1.4 CCC[C@H]1CNCC[C@H]1O Amb27263789 [0,0,0,1,0,0|2,0,1]=4 492 B10R1.4 CCC[C@H]1CSCC[C@@H]1O Amb28350245 [0,0,0,1,0,0|2,0,1]=4 493 B10R1.4 CCC[C@H]1CSCC[C@H]1O Amb27880290 [0,0,0,1,0,0|2,0,1]=4 494 B10R1.4 CCC[C@H]1NCCC[C@@H]1O Amb28400045 [0,0,0,1,0,0|2,0,1]=4 495 B10R1.4 CCC[C@H]1SCCNC1=O Amb28042822 [0,0,0,1,0,0|2,0,0]=3 496 B10R1.4 CCNC1CCCNC1=O Amb18284476 [0,0,0,1,0,0|2,0,0]=3 497 B10R1.4 CCN[C@@H]1CCCC[C@@H]1O Amb23263425 [0,0,0,1,0,0|2,0,1]=4 498 B10R1.4 CCN[C@@H]1CCCC[C@H]1O Amb10608084 [0,0,0,1,0,0|2,0,1]=4 499 B10R1.4 CCN[C@H]1CCCNC1=O Amb28367203 [0,0,0,1,0,0|2,0,0]=3 500 B10R1.4 CCOC1CCCCC1=O Amb4605921 [0,0,0,1,0,0|2,0,0]=3 501 B10R1.4 CCOC1CCCCC1O Amb26398852 [0,0,0,1,0,0|2,0,1]=4 502 B10R1.4 CCOC1CNCCC1=O Amb32674193 [0,0,0,1,0,0|3,0,0]=4 503 B10R1.4 CCOC1COCCC1=O Amb25838738 [0,0,0,1,0,0|3,0,0]=4 504 B10R1.4 CCO[C@@H]1CCCC[C@@H]1O Amb28410837 [0,0,0,1,0,0|2,0,1]=4 505 B10R1.4 CCO[C@@H]1CCCC[C@H]1O Amb25310010 [0,0,0,1,0,0|2,0,1]=4 506 B10R1.4 CCO[C@H]1CCCC[C@@H]1O Amb27844174 [0,0,0,1,0,0|2,0,1]=4 507 B10R1.4 CCSC1CCCCC1O Amb18792295 [0,0,0,1,0,0|2,0,1]=4 508 B10R1.4 CCS[C@@H]1CCCC[C@@H]1O Amb27660252 [0,0,0,1,0,0|2,0,1]=4 509 B10R1.4 CC\C=C1/CCCCC1=O Amb24690557 [0,0,0,1,0,0|1,0,2]=4 510 B10R1.4 CNCC1CCCCC1O Amb18644012 [0,0,0,1,0,0|2,0,1]=4 511 B10R1.4 CNCC1CCCOC1C Amb27965346 [0,0,0,1,0,0|2,0,1]=4 512 B10R1.4 CNC[C@@H]1CCCC[C@H]1O Amb28401548 [0,0,0,1,0,0|2,0,1]=4 513 B10R1.4 COCC1CCCCC1=O Amb25265248 [0,0,0,1,0,0|2,0,0]=3 514 B10R1.4 COCC1CCCCC1O Amb24727818 [0,0,0,1,0,0|2,0,1]=4 515 B10R1.4 COCC1COCCC1=O Amb26447203 [0,0,0,1,0,0|3,0,0]=4 516 B10R1.4 COC[C@@H]1CCCC[C@@H]1O Amb27667023 [0,0,0,1,0,0|2,0,1]=4 517 B10R1.4 COC[C@@H]1CCCC[C@H]1O Amb33213668 [0,0,0,1,0,0|2,0,1]=4 518 B10R1.4 N#CCC1CCCCC1=O Amb17593484 [0,0,0,1,0,0|2,0,1]=4 519 B10R1.4 NCCC1CCCCC1=O Amb18202696 [0,0,0,1,0,0|2,0,0]=3 520 B10R1.4 NCCC1CCCCC1O Amb18202445 [0,0,0,1,0,0|2,0,1]=4 521 B10R1.4 NCCC1CCCNC1=O Amb18831625 [0,0,0,1,0,0|2,0,0]=3 522 B10R1.4 NCCC1CCOCC1=O Amb18831579 [0,0,0,1,0,0|3,0,0]=4 523 B10R1.4 NCCC1CCSCC1=O Amb18830316 [0,0,0,1,0,0|3,0,0]=4 524 B10R1.4 NCCC1COCCC1=O Amb18831578 [0,0,0,1,0,0|3,0,0]=4 525 B10R1.4 NCCC1CSCCC1=O Amb18830315 [0,0,0,1,0,0|3,0,0]=4 526 B10R1.4 NCCC1NCCNC1=O Amb25972771 [0,0,0,1,0,0|3,0,0]=4 527 B10R1.4 NCCC1OCCCC1=O Amb18831580 [0,0,0,1,0,0|3,0,0]=4 528 B10R1.4 NCCC1OCCNC1=O Amb32696867 [0,0,0,1,0,0|3,0,0]=4 529 B10R1.4 NCCN1CCCCC1=O Amb13951132 [0,0,0,1,0,0|3,0,0]=4 530 B10R1.4 NCCN1CCCCC1=O Amb21954327 [0,0,0,1,0,0|3,0,0]=4 531 B10R1.4 NCCN1CCCCC1=O Amb2785016 [0,0,0,1,0,0|3,0,0]=4 532 B10R1.4 NCCN1CCCNC1=O Amb18955752 [0,0,0,1,0,0|3,0,0]=4 533 B10R1.4 NCCN1CCCNC1=O Amb32789710 [0,0,0,1,0,0|3,0,0]=4 534 B10R1.4 NCCN1CCCOC1=O Amb10607686 [0,0,0,1,0,0|2,0,0]=3 535 B10R1.4 NCCN1CCCOC1=O Amb22586959 [0,0,0,1,0,0|2,0,0]=3 536 B10R1.4 NCC[C@@H]1CCCC[C@@H]1O Amb32719260 [0,0,0,1,0,0|2,0,1]=4 537 B10R1.4 O=C1CCCCC1CCO Amb26606412 [0,0,0,1,0,0|2,0,0]=3 538 B10R1.4 O=C1CCCCN1CCO Amb9370459 [0,0,0,1,0,0|3,0,0]=4 539 B10R1.4 O=C1CCCCN1CCS Amb27837905 [0,0,0,1,0,0|3,0,0]=4 540 B10R1.4 O=C1NCCCC1CCF Amb25927286 [0,0,0,1,0,0|2,0,0]=3 541 B10R1.4 O=C1NCCCC1CCO Amb28189105 [0,0,0,1,0,0|2,0,0]=3 542 B10R1.4 O=C1NCCCN1CCO Amb28041890 [0,0,0,1,0,0|3,0,0]=4 543 B10R1.4 O=C1NCCNC1CCO Amb6739974 [0,0,0,1,0,0|3,0,0]=4 544 B10R1.4 O=C1NCCOC1CCO Amb27666013 [0,0,0,1,0,0|3,0,0]=4 545 B10R1.4 O=CCC1CCCCC1=O Amb17593548 [0,0,0,1,0,0|2,0,1]=4 546 B10R1.4 O=CCC1CCCNC1=O Amb27874064 [0,0,0,1,0,0|2,0,1]=4 547 B10R1.4 OCCC1CCCCC1O Amb28126038 [0,0,0,1,0,0|2,0,1]=4 548 B10R1.4 OCCC1CCCOC1O Amb27406061 [0,0,0,1,0,0|1,0,2]=4 549 B10R1.39 C#C[C@H]1CCC[C@@H]1C(C)=O Amb27421955 [0,0,0,1,0,0|1,0,2]=4 550 B10R1.39 C=C(C)C1CCCC1CO Amb27220215 [0,0,0,1,0,0|3,0,0]=4 551 B10R1.39 C=C(C)C1CNCC1CC Amb28251039 [0,0,0,1,0,0|3,0,0]=4 552 B10R1.39 C=C(C)[C@@H]1CCC[C@H]1CO Amb27971013 [0,0,0,1,0,0|3,0,0]=4 553 B10R1.39 C=CC1CCOC1C(=O)O Amb27607730 [0,0,0,1,0,0|1,0,2]=4 554 B10R1.39 C=CC1OCCC1C(=O)O Amb24436322 [0,0,0,1,0,0|1,0,2]=4 555 B10R1.39 C=CN1CCC[C@H]1C(=O)O Amb28072906 [0,0,0,1,0,0|1,0,2]=4 556 B10R1.39 C=C[C@@H]1CCN[C@@H]1C(=O)O Amb27961180 [0,0,0,1,0,0|1,0,2]=4 557 B10R1.39 C=C[C@@H]1OCC[C@H]1C(=O)O Amb25262060 [0,0,0,1,0,0|1,0,2]=4 558 B10R1.39 CC(=O)C1CCCC1C#N Amb26618049 [0,0,0,1,0,0|2,0,1]=4 559 B10R1.39 CC(=O)C1CCCC1C=O Amb24611185 [0,0,0,1,0,0|2,0,1]=4 560 B10R1.39 CC(=O)C1CCCC1CCl Amb28251128 [0,0,0,1,0,0|2,0,0]=3 561 B10R1.39 CC(=O)C1CCCC1CN Amb25169358 [0,0,0,1,0,0|2,0,0]=3 562 B10R1.39 CC(=O)C1OCCC1CN Amb33307786 [0,0,0,1,0,0|3,0,0]=4 563 B10R1.39 CC(=O)C1SCCC1CO Amb28324417 [0,0,0,1,0,0|3,0,0]=4 564 B10R1.39 CC(=O)N1CCCC1CBr Amb21861144 [0,0,0,1,0,0|3,0,0]=4 565 B10R1.39 CC(=O)N1CCCC1CCl Amb21861142 [0,0,0,1,0,0|3,0,0]=4 566 B10R1.39 CC(=O)N1CCCC1CN Amb18251238 [0,0,0,1,0,0|3,0,0]=4 567 B10R1.39 CC(=O)N1CCCC1CN Amb20622612 [0,0,0,1,0,0|3,0,0]=4 568 B10R1.39 CC(=O)N1CCCC1CO Amb17102424 [0,0,0,1,0,0|3,0,0]=4 569 B10R1.39 CC(=O)N1CCC[C@@H]1CBr Amb18027506 [0,0,0,1,0,0|3,0,0]=4 570 B10R1.39 CC(=O)N1CCC[C@@H]1CCl Amb18533760 [0,0,0,1,0,0|3,0,0]=4 571 B10R1.39 CC(=O)N1CCC[C@@H]1CN Amb18016514 [0,0,0,1,0,0|3,0,0]=4 572 B10R1.39 CC(=O)N1CCC[C@@H]1CO Amb27843306 [0,0,0,1,0,0|3,0,0]=4 573 B10R1.39 CC(=O)N1CCC[C@H]1CBr Amb17103861 [0,0,0,1,0,0|3,0,0]=4 574 B10R1.39 CC(=O)N1CCC[C@H]1CCl Amb17103489 [0,0,0,1,0,0|3,0,0]=4 575 B10R1.39 CC(=O)N1CCC[C@H]1CI Amb22227517 [0,0,0,1,0,0|3,0,0]=4 576 B10R1.39 CC(=O)N1CCC[C@H]1CN Amb17046511 [0,0,0,1,0,0|3,0,0]=4 577 B10R1.39 CC(=O)N1CCC[C@H]1CO Amb22227516 [0,0,0,1,0,0|3,0,0]=4 578 B10R1.39 CC(=O)[C@@H]1CCC[C@@H]1CN Amb27243633 [0,0,0,1,0,0|2,0,0]=3 579 B10R1.39 CC(=O)[C@@H]1CCC[C@H]1C#N Amb27767989 [0,0,0,1,0,0|2,0,1]=4 580 B10R1.39 CC(=O)[C@@H]1OCC[C@@H]1CN Amb33307819 [0,0,0,1,0,0|3,0,0]=4 581 B10R1.39 CC(=O)[C@H]1CCC[C@@H]1C#N Amb27855018 [0,0,0,1,0,0|2,0,1]=4 582 B10R1.39 CC(=O)[C@H]1COC[C@@H]1CO Amb28344693 [0,0,0,1,0,0|3,0,0]=4 583 B10R1.39 CC(O)C1CCCC1CN Amb35622249 [0,0,0,1,0,0|2,0,1]=4 584 B10R1.39 CC(O)C1CCC[C@@H]1CN Amb35740932 [0,0,0,1,0,0|2,0,1]=4 585 B10R1.39 CCC1=C(C(=O)O)CCC1 Amb29864676 [0,0,0,1,0,0|0,0,2]=3 586 B10R1.39 CCC1=C(C(=O)O)CCO1 Amb27207346 [0,0,0,1,0,0|1,0,2]=4 587 B10R1.39 CCC1CCC=C1C(=O)O Amb27788569 [0,0,0,1,0,0|0,0,2]=3 588 B10R1.39 CCC1CCCC1C(=O)O Amb18643940 [0,0,0,1,0,0|0,0,0]=1 589 B10R1.39 CCC1CCCN1C(=O)Cl Amb26053464 [0,0,0,1,0,0|2,0,0]=3 590 B10R1.39 CCC1CCCN1C(N)=S Amb18179848 [0,0,0,1,0,0|2,1,0]=4 591 B10R1.39 CCC1CCNC1C(=O)O Amb18644001 [0,0,0,1,0,0|1,0,0]=2 592 B10R1.39 CCC1CCNC1C(=O)O Amb32932458 [0,0,0,1,0,0|1,0,0]=2 593 B10R1.39 CCC1CCN[C@@H]1C(=O)O Amb27259157 [0,0,0,1,0,0|1,0,0]=2 594 B10R1.39 CCC1CCOC1C(=O)O Amb32666976 [0,0,0,1,0,0|1,0,0]=2 595 B10R1.39 CCC1CNCC1C(=O)O Amb18831583 [0,0,0,1,0,0|1,0,0]=2 596 B10R1.39 CCC1CNCC1C(N)=O Amb28139079 [0,0,0,1,0,0|2,0,0]=3 597 B10R1.39 CCC1COCC1C(C)=O Amb29882928 [0,0,0,1,0,0|2,0,0]=3 598 B10R1.39 CCC1COCC1C(C)O Amb35651600 [0,0,0,1,0,0|2,0,1]=4 599 B10R1.39 CCC1NCCC1C(=O)O Amb18118150 [0,0,0,1,0,0|1,0,0]=2 600 B10R1.39 CCC1NCCC1C(=O)O Amb28896015 [0,0,0,1,0,0|1,0,0]=2 601 B10R1.39 CCC1NCCC1C(C)=O Amb33131417 [0,0,0,1,0,0|2,0,0]=3 602 B10R1.39 CCC1NCCC1C(C)O Amb35620973 [0,0,0,1,0,0|2,0,1]=4 603 B10R1.39 CCC1NCCC1C(N)=O Amb28057799 [0,0,0,1,0,0|2,0,0]=3 604 B10R1.39 CCC1OCCC1C(=O)O Amb27238092 [0,0,0,1,0,0|1,0,0]=2 605 B10R1.39 CCC1OCCC1C(C)=O Amb27170224 [0,0,0,1,0,0|2,0,0]=3 606 B10R1.39 CCC1SCCN1C(C)=O Amb27837962 [0,0,0,1,0,0|3,0,0]=4 607 B10R1.39 CCN1CCCC1C(=O)O Amb9173743 [0,0,0,1,0,0|1,0,0]=2 608 B10R1.39 CCN1CCCC1C(C)=O Amb27617177 [0,0,0,1,0,0|2,0,0]=3 609 B10R1.39 CCN1CCCC1C(N)=O Amb25233484 [0,0,0,1,0,0|2,0,0]=3 610 B10R1.39 CCN1CCC[C@@H]1C(=O)O Amb22587552 [0,0,0,1,0,0|1,0,0]=2 611 B10R1.39 CCN1CCC[C@@H]1C(=O)O Amb23385271 [0,0,0,1,0,0|1,0,0]=2 612 B10R1.39 CCN1CCC[C@@H]1C(N)=O Amb22799563 [0,0,0,1,0,0|2,0,0]=3 613 B10R1.39 CCN1CCC[C@H]1C(=O)O Amb19516987 [0,0,0,1,0,0|1,0,0]=2 614 B10R1.39 CCN1CCC[C@H]1C(N)=O Amb19944682 [0,0,0,1,0,0|2,0,0]=3 615 B10R1.39 CC[C@@H]1CCN[C@@H]1C(=O)O Amb27846259 [0,0,0,1,0,0|1,0,0]=2 616 B10R1.39 CC[C@@H]1CCN[C@H]1C(=O)O Amb28428507 [0,0,0,1,0,0|1,0,0]=2 617 B10R1.39 CC[C@@H]1CCO[C@@H]1C(=O)O Amb32667304 [0,0,0,1,0,0|1,0,0]=2 618 B10R1.39 CC[C@@H]1CNC[C@@H]1C(=O)O Amb28057536 [0,0,0,1,0,0|1,0,0]=2 619 B10R1.39 CC[C@@H]1NCC[C@H]1C(=O)O Amb18202480 [0,0,0,1,0,0|1,0,0]=2 620 B10R1.39 CC[C@@H]1OCC[C@H]1C(=O)O Amb32685282 [0,0,0,1,0,0|1,0,0]=2 621 B10R1.39 CC[C@@H]1SCCN1C(C)=O Amb27859958 [0,0,0,1,0,0|3,0,0]=4 622 B10R1.39 CC[C@H]1CCC[C@@H]1C(N)=O Amb27786258 [0,0,0,1,0,0|1,0,0]=2 623 B10R1.39 CC[C@H]1CCN[C@@H]1C(=O)O Amb28411335 [0,0,0,1,0,0|1,0,0]=2 624 B10R1.39 CC[C@H]1CCN[C@@H]1C(N)=O Amb27203311 [0,0,0,1,0,0|2,0,0]=3 625 B10R1.39 CNC1CCCC1C(=N)N Amb32672056 [0,0,0,1,0,0|3,0,0]=4 626 B10R1.39 CNC1CCCC1C(=O)O Amb26637848 [0,0,0,1,0,0|1,0,0]=2 627 B10R1.39 CNC1CCCC1C(N)=O Amb25296216 [0,0,0,1,0,0|2,0,0]=3 628 B10R1.39 CNC1CCCC1C(N)=S Amb32672057 [0,0,0,1,0,0|2,1,0]=4 629 B10R1.39 CNC1CCCC1S(C)=O Amb27592708 [0,0,0,1,0,0|3,0,0]=4 630 B10R1.39 CNC1COCC1C(=O)O Amb27409265 [0,0,0,1,0,0|2,0,0]=3 631 B10R1.39 CNC1COCC1C(C)=O Amb24426698 [0,0,0,1,0,0|3,0,0]=4 632 B10R1.39 COC1CCCC1C(=N)N Amb27588493 [0,0,0,1,0,0|3,0,0]=4 633 B10R1.39 COC1CCCC1C(=O)Cl Amb27159232 [0,0,0,1,0,0|2,0,0]=3 634 B10R1.39 COC1CCCC1C(=O)O Amb18967397 [0,0,0,1,0,0|1,0,0]=2 635 B10R1.39 COC1CCCC1C(N)=O Amb24677907 [0,0,0,1,0,0|2,0,0]=3 636 B10R1.39 COC1CCCN1C(C)=O Amb27811858 [0,0,0,1,0,0|3,0,0]=4 637 B10R1.39 COC1CCNC1C(=O)O Amb18644194 [0,0,0,1,0,0|2,0,0]=3 638 B10R1.39 COC1CNCC1C(C)=O Amb33131409 [0,0,0,1,0,0|3,0,0]=4 639 B10R1.39 COC1CNCC1C(N)=O Amb35592671 [0,0,0,1,0,0|3,0,0]=4 640 B10R1.39 COC1COCC1C(=O)Cl Amb25964077 [0,0,0,1,0,0|3,0,0]=4 641 B10R1.39 CO[C@@H]1CCC[C@@H]1C(=O)Cl Amb26426311 [0,0,0,1,0,0|2,0,0]=3 642 B10R1.39 CO[C@@H]1CCC[C@@H]1C(=O)O Amb28203935 [0,0,0,1,0,0|1,0,0]=2 643 B10R1.39 CO[C@@H]1CCC[C@@H]1S(=O)Cl Amb32720851 [0,0,0,1,0,0|3,0,0]=4 644 B10R1.39 CO[C@@H]1CCC[C@@H]1S(=O)[O-] Amb32755561 [0,0,0,1,0,0|2,0,1]=4 645 B10R1.39 CO[C@@H]1CCC[C@@H]1S(N)=O Amb32720852 [0,0,0,1,0,0|3,0,0]=4 646 B10R1.39 CO[C@@H]1CCC[C@H]1S(=O)Cl Amb32720791 [0,0,0,1,0,0|3,0,0]=4 647 B10R1.39 CO[C@@H]1CCC[C@H]1S(=O)[O-] Amb32755238 [0,0,0,1,0,0|2,0,1]=4 648 B10R1.39 CO[C@@H]1CCC[C@H]1S(N)=O Amb32720792 [0,0,0,1,0,0|3,0,0]=4 649 B10R1.39 CO[C@H]1CCCC1C(=O)O Amb27947835 [0,0,0,1,0,0|1,0,0]=2 650 B10R1.39 CO[C@H]1CCC[C@@H]1C(=O)Cl Amb27803948 [0,0,0,1,0,0|2,0,0]=3 651 B10R1.39 CO[C@H]1CCC[C@@H]1C(=O)O Amb25956783 [0,0,0,1,0,0|1,0,0]=2 652 B10R1.39 CO[C@H]1CCC[C@H]1C(=O)O Amb26931198 [0,0,0,1,0,0|1,0,0]=2 653 B10R1.39 CO[C@H]1COC[C@H]1C(=O)Cl Amb24514854 [0,0,0,1,0,0|3,0,0]=4 654 B10R1.39 CSC1CCCC1C(=O)O Amb18288540 [0,0,0,1,0,0|1,0,0]=2 655 B10R1.39 CSC1CCCC1C(N)=O Amb28207455 [0,0,0,1,0,0|2,0,0]=3 656 B10R1.39 N#CC1OCCC1C(=O)O Amb25378743 [0,0,0,1,0,0|2,0,1]=4 657 B10R1.39 N#CN1CCCC1C(=O)O Amb35634513 [0,0,0,1,0,0|2,0,1]=4 658 B10R1.39 N#CN1CCC[C@@H]1C(=O)O Amb30031673 [0,0,0,1,0,0|2,0,1]=4 659 B10R1.39 N#CN1CCC[C@H]1C(=O)O Amb35634516 [0,0,0,1,0,0|2,0,1]=4 660 B10R1.39 N#C[C@H]1CCC[C@@H]1C(=O)O Amb27231107 [0,0,0,1,0,0|1,0,1]=3 661 B10R1.39 NC(=O)C1CCNC1CO Amb27253632 [0,0,0,1,0,0|3,0,0]=4 662 B10R1.39 NC(=O)N1CCCC1CO Amb19301607 [0,0,0,1,0,0|3,0,0]=4 663 B10R1.39 NC(=O)N1CCC[C@@H]1CO Amb26458771 [0,0,0,1,0,0|3,0,0]=4 664 B10R1.39 NC(=O)N1CCC[C@H]1CO Amb27629927 [0,0,0,1,0,0|3,0,0]=4 665 B10R1.39 NC(=O)[C@H]1CCC[C@H]1CO Amb27788752 [0,0,0,1,0,0|2,0,0]=3 666 B10R1.39 NC(=O)[C@H]1CCN[C@H]1CO Amb27788848 [0,0,0,1,0,0|3,0,0]=4 667 B10R1.39 NCC1CCCC1C(=O)O Amb25283657 [0,0,0,1,0,0|1,0,0]=2 668 B10R1.39 NCC1CCCC1C(=O)O Amb32661245 [0,0,0,1,0,0|1,0,0]=2 669 B10R1.39 NCC1CCCC1[N+](=O)[O-] Amb28051739 [0,0,0,1,0,0|2,0,1]=4 670 B10R1.39 NCC1CCCN1C(N)=O Amb18251258 [0,0,0,1,0,0|3,0,0]=4 671 B10R1.39 NCC1OCCC1C(=O)O Amb28145201 [0,0,0,1,0,0|2,0,0]=3 672 B10R1.39 NCC1OCCC1C(=O)O Amb28920815 [0,0,0,1,0,0|2,0,0]=3 673 B10R1.39 NCN1CCCC1C(=O)O Amb27838065 [0,0,0,1,0,0|2,0,0]=3 674 B10R1.39 NC[C@@H]1CCCN1C(N)=O Amb35687978 [0,0,0,1,0,0|3,0,0]=4 675 B10R1.39 NC[C@@H]1CCC[C@@H]1C(=O)O Amb26903999 [0,0,0,1,0,0|1,0,0]=2 676 B10R1.39 NC[C@@H]1CCC[C@@H]1C(=O)O Amb33249753 [0,0,0,1,0,0|1,0,0]=2 677 B10R1.39 NC[C@@H]1CCO[C@@H]1C(=O)O Amb32671492 [0,0,0,1,0,0|2,0,0]=3 678 B10R1.39 NC[C@@H]1CCO[C@@H]1C(=O)O Amb32992350 [0,0,0,1,0,0|2,0,0]=3 679 B10R1.39 NC[C@@H]1OCC[C@@H]1C(=O)O Amb27666152 [0,0,0,1,0,0|2,0,0]=3 680 B10R1.39 NC[C@@H]1OCC[C@@H]1C(=O)O Amb32663319 [0,0,0,1,0,0|2,0,0]=3 681 B10R1.39 NC[C@H]1CCCN1C(N)=O Amb35587848 [0,0,0,1,0,0|3,0,0]=4 682 B10R1.39 NC[C@H]1CCC[C@H]1C(=O)O Amb28293248 [0,0,0,1,0,0|1,0,0]=2 683 B10R1.39 NC[C@H]1CCC[C@H]1C(=O)O Amb28641946 [0,0,0,1,0,0|1,0,0]=2 684 B10R1.39 NC[C@H]1CCC[C@H]1C(N)=O Amb27788090 [0,0,0,1,0,0|2,0,0]=3 685 B10R1.39 O=C(Cl)N1CCC[C@H]1CBr Amb33296907 [0,0,0,1,0,0|3,0,0]=4 686 B10R1.39 O=C(O)C1=C(CO)CCC1 Amb18643827 [0,0,0,1,0,0|1,0,2]=4 687 B10R1.39 O=C(O)C1CCCC1CBr Amb18130990 [0,0,0,1,0,0|1,0,0]=2 688 B10R1.39 O=C(O)C1CCCC1CF Amb20668095 [0,0,0,1,0,0|1,0,0]=2 689 B10R1.39 O=C(O)C1CCNC1CO Amb28195171 [0,0,0,1,0,0|2,0,0]=3 690 B10R1.39 O=C(O)C1CCSC1CS Amb28422354 [0,0,0,1,0,0|2,0,0]=3 691 B10R1.39 O=C(O)C1CNCC1CO Amb2696581 [0,0,0,1,0,0|2,0,0]=3 692 B10R1.39 O=C(O)C1CSCC1CS Amb27872260 [0,0,0,1,0,0|2,0,0]=3 693 B10R1.39 O=C(O)C1OCOC1CO Amb28071005 [0,0,0,1,0,0|3,0,0]=4 694 B10R1.39 O=C(O)[C@@H]1CCC[C@H]1CF Amb32721623 [0,0,0,1,0,0|1,0,0]=2 695 B10R1.39 O=C(O)[C@@H]1CCN[C@H]1CO Amb18202111 [0,0,0,1,0,0|2,0,0]=3 696 B10R1.39 O=C(O)[C@@H]1OCO[C@H]1CO Amb27870706 [0,0,0,1,0,0|3,0,0]=4 697 B10R1.39 O=C(O)[C@H]1CCC[C@@H]1CBr Amb27435607 [0,0,0,1,0,0|1,0,0]=2 698 B10R1.39 O=CN1CCCC1C(=O)O Amb18944572 [0,0,0,1,0,0|2,0,1]=4 699 B10R1.39 O=CN1CCC[C@H]1C(=O)O Amb24053316 [0,0,0,1,0,0|2,0,1]=4 700 B10R1.39 O=C[C@@H]1CCC[C@@H]1C(=O)O Amb27643790 [0,0,0,1,0,0|1,0,1]=3 701 B10R1.39 O=NN1CCCC1C(=O)O Amb22732865 [0,0,0,1,0,0|3,0,0]=4 702 B10R1.39 O=NN1CCC[C@@H]1C(=O)O Amb17618617 [0,0,0,1,0,0|3,0,0]=4 703 B10R1.39 O=NN1CCC[C@H]1C(=O)O Amb17618616 [0,0,0,1,0,0|3,0,0]=4 704 B10R1.48 C=CC1C(CC)C1C(=O)O Amb27768682 [0,0,0,1,0,0|0,0,2]=3 705 B10R1.48 C=C[C@@H]1[C@@H](C(C)=O)[C@@H]1CC Amb27440451 [0,0,0,1,0,0|1,0,2]=4 706 B10R1.48 C=C[C@H]1[C@@H](C(C)=O)[C@@H]1CC Amb28052325 [0,0,0,1,0,0|1,0,2]=4 707 B10R1.48 CCC1=C(CC)C1C(=O)Cl Amb27175497 [0,0,0,1,0,0|1,0,2]=4 708 B10R1.48 CCC1=C(CC)C1C(=O)O Amb2612708 [0,0,0,1,0,0|0,0,2]=3 709 B10R1.48 CCC1C(OC)C1C(=O)O Amb27172438 [0,0,0,1,0,0|1,0,0]=2 710 B10R1.48 C\C=C1/[C@@H](CC)[C@@H]1C(C)=O Amb28202113 [0,0,0,1,0,0|1,0,2]=4 711 B10R1.48 C\C=C1\[C@H](CC)[C@H]1C(C)=O Amb27854962 [0,0,0,1,0,0|1,0,2]=4 712 B10R1.58 C=C(C)C1CC(C)C(O)C1 Amb27191936 [0,0,0,1,0,0|3,0,0]=4 713 B10R1.58 C=C(C)C1C[C@@H](C)[C@H](O)C1 Amb27790334 [0,0,0,1,0,0|3,0,0]=4 714 B10R1.58 C=C(C)C1C[C@H](O)[C@H](C)C1 Amb27199266 [0,0,0,1,0,0|3,0,0]=4 715 B10R1.58 C=C1CC(C(=O)O)CC1N Amb25996162 [0,0,0,1,0,0|1,0,2]=4 716 B10R1.58 C=C1C[C@H](C(=O)O)C[C@@H]1N Amb25229776 [0,0,0,1,0,0|1,0,2]=4 717 B10R1.58 CC(=O)C1CC(=O)C(C)C1 Amb26936800 [0,0,0,1,0,0|2,0,1]=4 718 B10R1.58 CC(=O)N1CC(C)C(Br)C1 Amb27428781 [0,0,0,1,0,0|3,0,0]=4 719 B10R1.58 CC(=O)N1CC(C)C(O)C1 Amb27651259 [0,0,0,1,0,0|3,0,0]=4 720 B10R1.58 CC1=NC(C(=O)O)CC1C Amb27397721 [0,0,0,1,0,0|1,0,1]=3 721 B10R1.58 CC1CC(C(=O)O)CC1=O Amb27413499 [0,0,0,1,0,0|1,0,1]=3 722 B10R1.58 CC1CC(C(=O)O)CC1C Amb28251040 [0,0,0,1,0,0|0,0,0]=1 723 B10R1.58 CC1CC(C(=O)O)CN1C Amb18831573 [0,0,0,1,0,0|1,0,0]=2 724 B10R1.58 CC1CC(C(=O)O)NC1C Amb18831587 [0,0,0,1,0,0|1,0,0]=2 725 B10R1.58 CC1CC(C(=O)O)OC1=O Amb27836333 [0,0,0,1,0,0|2,0,1]=4 726 B10R1.58 CC1CN(C(N)=O)CC1O Amb27877996 [0,0,0,1,0,0|3,0,0]=4 727 B10R1.58 CC1C[C@@H](C(=O)O)OC1=O Amb27615055 [0,0,0,1,0,0|2,0,1]=4 728 B10R1.58 CC1C[C@H](C(=O)O)CC1O Amb27882643 [0,0,0,1,0,0|1,0,0]=2 729 B10R1.58 CC1NC(C(=O)O)CC1N Amb27768615 [0,0,0,1,0,0|2,0,0]=3 730 B10R1.58 CC1NC(C(=O)O)CC1O Amb27876074 [0,0,0,1,0,0|2,0,0]=3 731 B10R1.58 CC1NC(C(=O)O)C[C@H]1O Amb27167587 [0,0,0,1,0,0|2,0,0]=3 732 B10R1.58 CC1O[C@@H](C(=O)O)C[C@H]1O Amb27216683 [0,0,0,1,0,0|2,0,0]=3 733 B10R1.58 CN1CC(C(=O)O)CC1=O Amb6315829 [0,0,0,1,0,0|2,0,1]=4 734 B10R1.58 CN1C[C@H](C(=O)O)CC1=O Amb28326218 [0,0,0,1,0,0|2,0,1]=4 735 B10R1.58 C[C@@H]1C[C@@H](C(=O)O)N[C@@H]1C Amb27640711 [0,0,0,1,0,0|1,0,0]=2 736 B10R1.58 C[C@@H]1C[C@H](C(=O)O)CN1C Amb35788874 [0,0,0,1,0,0|1,0,0]=2 737 B10R1.58 C[C@@H]1N[C@H](C(=O)O)C[C@H]1F Amb27781898 [0,0,0,1,0,0|2,0,0]=3 738 B10R1.58 C[C@@H]1SC(C(=O)Cl)S[C@H]1C Amb24631106 [0,0,0,1,0,0|3,0,0]=4 739 B10R1.58 C[C@H]1C[C@@H](C(=O)O)C[C@H]1C Amb27447222 [0,0,0,1,0,0|0,0,0]=1 740 B10R1.58 C[C@H]1O[C@H](C(=O)O)C[C@@H]1O Amb27194347 [0,0,0,1,0,0|2,0,0]=3 741 B10R1.58 C[C@H]1SC(C(=O)O)S[C@@H]1C Amb27845407 [0,0,0,1,0,0|2,0,0]=3 742 B10R1.58 NC(=O)C1CC(N)C(N)C1 Amb27837970 [0,0,0,1,0,0|3,0,0]=4 743 B10R1.58 NC1CC(C(=O)O)CC1F Amb27666691 [0,0,0,1,0,0|2,0,0]=3 744 B10R1.58 N[C@@H]1C[C@H](C(=O)O)C[C@H]1O Amb27630763 [0,0,0,1,0,0|2,0,0]=3 745 B10R1.58 N[C@@H]1C[C@H](C(=O)O)C[C@H]1O Amb33017585 [0,0,0,1,0,0|2,0,0]=3 746 B10R1.58 N[C@H]1CC(C(=O)O)C[C@@H]1O Amb27238051 [0,0,0,1,0,0|2,0,0]=3 747 B10R1.58 N[C@H]1C[C@@H](C(=O)O)C[C@@H]1F Amb24568879 [0,0,0,1,0,0|2,0,0]=3 748 B10R1.58 N[C@H]1C[C@@H](C(=O)O)C[C@@H]1O Amb27420224 [0,0,0,1,0,0|2,0,0]=3 749 B10R1.58 N[C@H]1C[C@H](C(=O)O)C[C@@H]1O Amb28437238 [0,0,0,1,0,0|2,0,0]=3 750 B10R1.58 O=C(Cl)C1CC(Cl)C(Cl)C1 Amb27185447 [0,0,0,1,0,0|3,0,0]=4 751 B10R1.58 O=C(O)C1CC(Cl)C(Cl)C1 Amb27484189 [0,0,0,1,0,0|2,0,0]=3 752 B10R1.58 O=C(O)C1CC(O)C(Br)C1 Amb28453598 [0,0,0,1,0,0|2,0,0]=3 753 B10R1.58 O=C(O)C1CC(O)C(O)C1 Amb26034622 [0,0,0,1,0,0|2,0,0]=3 754 B10R1.58 O=C(O)C1C[C@@H](Br)[C@H](Br)C1 Amb19297771 [0,0,0,1,0,0|2,0,0]=3 755 B10R1.58 O=C(O)C1C[C@H](F)[C@H](F)C1 Amb26410348 [0,0,0,1,0,0|2,0,0]=3 756 B10R1.58 O=C(O)C1C[C@H](O)[C@H](O)C1 Amb28126711 [0,0,0,1,0,0|2,0,0]=3 757 B10R1.58 O=C(O)[C@@H]1C[C@@H](O)[C@H](F)C1 Amb28046336 [0,0,0,1,0,0|2,0,0]=3 758 B10R1.113 C=C(C)C1CCCC(C)N1 Amb32721884 [0,0,0,1,0,0|3,0,0]=4 759 B10R1.113 CC(=O)C1=CCCC(C)C1 Amb27267162 [0,0,0,1,0,0|1,0,2]=4 760 B10R1.113 CC(=O)C1CC=CC(C)C1 Amb27462843 [0,0,0,1,0,0|1,0,2]=4 761 B10R1.113 CC(=O)C1CCCC(Br)C1 Amb27827804 [0,0,0,1,0,0|2,0,0]=3 762 B10R1.113 CC(=O)C1CCCC(Cl)C1 Amb26457716 [0,0,0,1,0,0|2,0,0]=3 763 B10R1.113 CC(=O)C1CCCC(N)C1 Amb25990513 [0,0,0,1,0,0|2,0,0]=3 764 B10R1.113 CC(=O)C1CCCC(N)C1 Amb33447093 [0,0,0,1,0,0|2,0,0]=3 765 B10R1.113 CC(=O)C1CCCN(C)C1 Amb33528226 [0,0,0,1,0,0|2,0,0]=3 766 B10R1.113 CC(=O)C1CCCS(=O)C1 Amb28400076 [0,0,0,1,0,0|3,0,0]=4 767 B10R1.113 CC(=O)C1CCNC(C)C1 Amb33307710 [0,0,0,1,0,0|2,0,0]=3 768 B10R1.113 CC(=O)C1CN(C)CCN1 Amb27618375 [0,0,0,1,0,0|3,0,0]=4 769 B10R1.113 CC(=O)C1CN(C)CCO1 Amb27465740 [0,0,0,1,0,0|3,0,0]=4 770 B10R1.113 CC(=O)C1CNCC(C)C1 Amb28058463 [0,0,0,1,0,0|2,0,0]=3 771 B10R1.113 CC(=O)N1CCCC(C)C1 Amb3358086 [0,0,0,1,0,0|2,0,0]=3 772 B10R1.113 CC(=O)N1CCCC(N)C1 Amb6760480 [0,0,0,1,0,0|3,0,0]=4 773 B10R1.113 CC(=O)N1CCCC(N)C1 Amb9173596 [0,0,0,1,0,0|3,0,0]=4 774 B10R1.113 CC(=O)N1CCCC(O)C1 Amb9272424 [0,0,0,1,0,0|3,0,0]=4 775 B10R1.113 CC(=O)N1CCC[C@@H](Br)C1 Amb22227488 [0,0,0,1,0,0|3,0,0]=4 776 B10R1.113 CC(=O)N1CCC[C@@H](Cl)C1 Amb22227480 [0,0,0,1,0,0|3,0,0]=4 777 B10R1.113 CC(=O)N1CCC[C@@H](I)C1 Amb22227494 [0,0,0,1,0,0|3,0,0]=4 778 B10R1.113 CC(=O)N1CCC[C@@H](N)C1 Amb22227486 [0,0,0,1,0,0|3,0,0]=4 779 B10R1.113 CC(=O)N1CCC[C@@H](N)C1 Amb35752473 [0,0,0,1,0,0|3,0,0]=4 780 B10R1.113 CC(=O)N1CCC[C@@H](O)C1 Amb22227493 [0,0,0,1,0,0|3,0,0]=4 781 B10R1.113 CC(=O)N1CCC[C@H](Br)C1 Amb22227521 [0,0,0,1,0,0|3,0,0]=4 782 B10R1.113 CC(=O)N1CCC[C@H](Cl)C1 Amb22227523 [0,0,0,1,0,0|3,0,0]=4 783 B10R1.113 CC(=O)N1CCC[C@H](N)C1 Amb22227519 [0,0,0,1,0,0|3,0,0]=4 784 B10R1.113 CC(=O)N1CCC[C@H](O)C1 Amb22227529 [0,0,0,1,0,0|3,0,0]=4 785 B10R1.113 CC(=O)N1CCNC(C)C1 Amb17578113 [0,0,0,1,0,0|3,0,0]=4 786 B10R1.113 CC(=O)N1CCN[C@H](C)C1 Amb25742470 [0,0,0,1,0,0|3,0,0]=4 787 B10R1.113 CC(=O)N1CCN[C@H](C)C1 Amb30594260 [0,0,0,1,0,0|3,0,0]=4 788 B10R1.113 CC(=O)N1CCN[C@H](C)C1 Amb35748882 [0,0,0,1,0,0|3,0,0]=4 789 B10R1.113 CC(=O)N1CCOC(C)C1 Amb26542665 [0,0,0,1,0,0|3,0,0]=4 790 B10R1.113 CC(=O)[C@@H]1CC=C[C@@H](C)C1 Amb26986966 [0,0,0,1,0,0|1,0,2]=4 791 B10R1.113 CC(=O)[C@@H]1CCCC(=O)C1 Amb27974638 [0,0,0,1,0,0|2,0,1]=4 792 B10R1.113 CC(=O)[C@@H]1CCC[C@@H](N)C1 Amb33307837 [0,0,0,1,0,0|2,0,0]=3 793 B10R1.113 CC(=O)[C@@H]1CCC[C@H](Cl)C1 Amb28051845 [0,0,0,1,0,0|2,0,0]=3 794 B10R1.113 CC(=O)[C@@H]1CCC[C@H](N)C1 Amb33132804 [0,0,0,1,0,0|2,0,0]=3 795 B10R1.113 CC(=O)[C@@H]1CCC[C@H](O)C1 Amb28457491 [0,0,0,1,0,0|2,0,0]=3 796 B10R1.113 CC(=O)[C@@H]1CCN[C@H](C)C1 Amb33307715 [0,0,0,1,0,0|2,0,0]=3 797 B10R1.113 CC(=O)[C@@H]1O[C@H](C)CCS1 Amb24512630 [0,0,0,1,0,0|3,0,0]=4 798 B10R1.113 CC(=O)[C@H]1CC=C[C@@H](C)C1 Amb28291493 [0,0,0,1,0,0|1,0,2]=4 799 B10R1.113 CC(O)C1CCCC(N)C1 Amb27866998 [0,0,0,1,0,0|2,0,1]=4 800 B10R1.113 CC(O)[C@@H]1CCC[C@@H](C)C1 Amb28350215 [0,0,0,1,0,0|1,0,1]=3 801 B10R1.113 CC(O)[C@@H]1CCC[C@H](C)O1 Amb28064069 [0,0,0,1,0,0|2,0,1]=4 802 B10R1.113 CC1=CC(C(=O)O)CCC1 Amb27252115 [0,0,0,1,0,0|0,0,2]=3 803 B10R1.113 CC1=NC(C(=O)O)CCN1 Amb16193456 [0,0,0,1,0,0|2,0,1]=4 804 B10R1.113 CC1=N[C@H](C(=O)O)CCN1 Amb22348409 [0,0,0,1,0,0|2,0,1]=4 805 B10R1.113 CC1C=C(C(=O)O)CCC1 Amb24446315 [0,0,0,1,0,0|0,0,2]=3 806 B10R1.113 CC1C=C(C(=O)O)OCC1 Amb27216275 [0,0,0,1,0,0|1,0,2]=4 807 B10R1.113 CC1C=CCC(C(=O)O)C1 Amb24350925 [0,0,0,1,0,0|0,0,2]=3 808 B10R1.113 CC1CC(C(=O)Cl)CCO1 Amb27267994 [0,0,0,1,0,0|2,0,0]=3 809 B10R1.113 CC1CC(C(=O)O)CCN1 Amb18831574 [0,0,0,1,0,0|1,0,0]=2 810 B10R1.113 CC1CC(C(=O)O)CCN1 Amb28555517 [0,0,0,1,0,0|1,0,0]=2 811 B10R1.113 CC1CC(C(=O)O)CCO1 Amb33545304 [0,0,0,1,0,0|1,0,0]=2 812 B10R1.113 CC1CC(C(=O)O)CCS1 Amb26442619 [0,0,0,1,0,0|1,0,0]=2 813 B10R1.113 CC1CC(C(C)O)CCO1 Amb26369738 [0,0,0,1,0,0|2,0,1]=4 814 B10R1.113 CC1CC(C(N)=O)CCN1 Amb27838161 [0,0,0,1,0,0|2,0,0]=3 815 B10R1.113 CC1CC(C(N)=O)CCO1 Amb28126892 [0,0,0,1,0,0|2,0,0]=3 816 B10R1.113 CC1CC(S(=O)Cl)CCO1 Amb32720515 [0,0,0,1,0,0|3,0,0]=4 817 B10R1.113 CC1CC(S(=O)[O-])CCO1 Amb32754919 [0,0,0,1,0,0|2,0,1]=4 818 B10R1.113 CC1CC(S(N)=O)CCO1 Amb32720516 [0,0,0,1,0,0|3,0,0]=4 819 B10R1.113 CC1CCC=C(C(=O)O)C1 Amb28050150 [0,0,0,1,0,0|0,0,2]=3 820 B10R1.113 CC1CCCC(C(=O)Cl)C1 Amb25715458 [0,0,0,1,0,0|1,0,0]=2 821 B10R1.113 CC1CCCC(C(=O)O)C1 Amb3939935 [0,0,0,1,0,0|0,0,0]=1 822 B10R1.113 CC1CCCC(C(=O)O)N1 Amb19959953 [0,0,0,1,0,0|1,0,0]=2 823 B10R1.113 CC1CCCC(C(=O)O)N1 Amb4314386 [0,0,0,1,0,0|1,0,0]=2 824 B10R1.113 CC1CCCC(C(=O)O)O1 Amb24529278 [0,0,0,1,0,0|1,0,0]=2 825 B10R1.113 CC1CCCC(C(C)N)C1 Amb19148753 [0,0,0,1,0,0|2,0,1]=4 826 B10R1.113 CC1CCCC(C(C)N)C1 Amb32666394 [0,0,0,1,0,0|2,0,1]=4 827 B10R1.113 CC1CCCC(N(C)N)C1 Amb27192938 [0,0,0,1,0,0|3,0,0]=4 828 B10R1.113 CC1CCCC(S(=O)Cl)C1 Amb35681054 [0,0,0,1,0,0|2,0,0]=3 829 B10R1.113 CC1CCCC(S(=O)O)C1 Amb35683278 [0,0,0,1,0,0|1,0,0]=2 830 B10R1.113 CC1CCCC(S(=O)[O-])C1 Amb35683279 [0,0,0,1,0,0|1,0,1]=3 831 B10R1.113 CC1CCCC([C@@H](C)N)C1 Amb28256332 [0,0,0,1,0,0|2,0,1]=4 832 B10R1.113 CC1CCCC([C@@H](C)O)C1 Amb28280624 [0,0,0,1,0,0|1,0,1]=3 833 B10R1.113 CC1CCCC([C@H](C)N)C1 Amb25699823 [0,0,0,1,0,0|2,0,1]=4 834 B10R1.113 CC1CCCC([C@H](C)N)C1 Amb32662912 [0,0,0,1,0,0|2,0,1]=4 835 B10R1.113 CC1CCCC([N+](=O)[O-])C1 Amb33299032 [0,0,0,1,0,0|1,0,1]=3 836 B10R1.113 CC1CCCN(C(=N)N)C1 Amb2079621 [0,0,0,1,0,0|3,0,0]=4 837 B10R1.113 CC1CCCN(C(=N)N)C1 Amb32742470 [0,0,0,1,0,0|3,0,0]=4 838 B10R1.113 CC1CCCN(C(=N)N)C1 Amb453142 [0,0,0,1,0,0|3,0,0]=4 839 B10R1.113 CC1CCCN(C(=O)Cl)C1 Amb17563075 [0,0,0,1,0,0|2,0,0]=3 840 B10R1.113 CC1CCCN(C(N)=O)C1 Amb9708869 [0,0,0,1,0,0|2,0,0]=3 841 B10R1.113 CC1CCCN(C(N)=S)C1 Amb9708653 [0,0,0,1,0,0|2,1,0]=4 842 B10R1.113 CC1CCC[C@H](C(=O)O)N1 Amb540211 [0,0,0,1,0,0|1,0,0]=2 843 B10R1.113 CC1CCNC(C(=O)O)C1 Amb13886199 [0,0,0,1,0,0|1,0,0]=2 844 B10R1.113 CC1CCNC(C(=O)O)C1 Amb19375550 [0,0,0,1,0,0|1,0,0]=2 845 B10R1.113 CC1CCNC(C(=O)O)O1 Amb25702339 [0,0,0,1,0,0|2,0,0]=3 846 B10R1.113 CC1CCNC(C(C)O)C1 Amb33545321 [0,0,0,1,0,0|2,0,1]=4 847 B10R1.113 CC1CCNC(C(N)=O)C1 Amb27590357 [0,0,0,1,0,0|2,0,0]=3 848 B10R1.113 CC1CCOC(C(=O)O)C1 Amb25266110 [0,0,0,1,0,0|1,0,0]=2 849 B10R1.113 CC1CCOC(C(=O)O)N1 Amb33194311 [0,0,0,1,0,0|2,0,0]=3 850 B10R1.113 CC1CN(C(=O)Cl)CCO1 Amb25059037 [0,0,0,1,0,0|3,0,0]=4 851 B10R1.113 CC1CN(C(N)=O)CCO1 Amb1130459 [0,0,0,1,0,0|3,0,0]=4 852 B10R1.113 CC1CNCC(C(=O)O)C1 Amb18643998 [0,0,0,1,0,0|1,0,0]=2 853 B10R1.113 CC1CNCC(C(=O)O)N1 Amb32716215 [0,0,0,1,0,0|2,0,0]=3 854 B10R1.113 CC1CNCC(C(=O)O)O1 Amb26021863 [0,0,0,1,0,0|2,0,0]=3 855 B10R1.113 CC1CNCC(C(=O)O)O1 Amb32752555 [0,0,0,1,0,0|2,0,0]=3 856 B10R1.113 CC1CNCC(C(C)O)C1 Amb35741697 [0,0,0,1,0,0|2,0,1]=4 857 B10R1.113 CC1CNCC(C(N)=O)C1 Amb27876385 [0,0,0,1,0,0|2,0,0]=3 858 B10R1.113 CC1CNCC(C(N)=O)C1 Amb33339041 [0,0,0,1,0,0|2,0,0]=3 859 B10R1.113 CC1CNCC(C(N)=O)O1 Amb25351035 [0,0,0,1,0,0|3,0,0]=4 860 B10R1.113 CC1COCC(C(=O)O)N1 Amb23585511 [0,0,0,1,0,0|2,0,0]=3 861 B10R1.113 CC1COCC(C(=O)O)N1 Amb28555605 [0,0,0,1,0,0|2,0,0]=3 862 B10R1.113 CC1CSCC(C(=O)O)N1 Amb18645533 [0,0,0,1,0,0|2,0,0]=3 863 B10R1.113 CC1CSCC(C(=O)O)N1 Amb33456372 [0,0,0,1,0,0|2,0,0]=3 864 B10R1.113 CC1CSC[C@@H](C(=O)O)N1 Amb27223064 [0,0,0,1,0,0|2,0,0]=3 865 B10R1.113 CC1NC(C(=O)O)CCS1 Amb18278331 [0,0,0,1,0,0|2,0,0]=3 866 B10R1.113 CN1C=CCC(C(=O)O)C1 Amb23554527 [0,0,0,1,0,0|1,0,2]=4 867 B10R1.113 CN1CC=CC(C(=O)O)C1 Amb28344213 [0,0,0,1,0,0|1,0,2]=4 868 B10R1.113 CN1CCCC(C(=N)N)C1 Amb19516944 [0,0,0,1,0,0|3,0,0]=4 869 B10R1.113 CN1CCCC(C(=N)N)C1 Amb8630639 [0,0,0,1,0,0|3,0,0]=4 870 B10R1.113 CN1CCCC(C(=O)Cl)C1 Amb22893500 [0,0,0,1,0,0|2,0,0]=3 871 B10R1.113 CN1CCCC(C(=O)O)C1 Amb2689660 [0,0,0,1,0,0|1,0,0]=2 872 B10R1.113 CN1CCCC(C(=O)O)C1 Amb9238836 [0,0,0,1,0,0|1,0,0]=2 873 B10R1.113 CN1CCCC(C(N)=O)C1 Amb16233757 [0,0,0,1,0,0|2,0,0]=3 874 B10R1.113 CN1CCCC(C(N)=O)C1 Amb24064859 [0,0,0,1,0,0|2,0,0]=3 875 B10R1.113 CN1CCCC(C(N)=S)C1 Amb27950592 [0,0,0,1,0,0|2,1,0]=4 876 B10R1.113 CN1CCCC(S(C)=O)C1 Amb27838095 [0,0,0,1,0,0|3,0,0]=4 877 B10R1.113 CN1CCC[C@@H](C(=O)O)C1 Amb22751960 [0,0,0,1,0,0|1,0,0]=2 878 B10R1.113 CN1CCC[C@H](C(=O)O)C1 Amb28428437 [0,0,0,1,0,0|1,0,0]=2 879 B10R1.113 CN1CCC[C@H](S(C)=O)C1 Amb27390397 [0,0,0,1,0,0|3,0,0]=4 880 B10R1.113 CN1CCNC(C(=O)O)C1 Amb10602764 [0,0,0,1,0,0|2,0,0]=3 881 B10R1.113 CN1CCNC(C(=O)O)C1 Amb22587697 [0,0,0,1,0,0|2,0,0]=3 882 B10R1.113 CN1CCNC(C(=O)O)C1 Amb22754371 [0,0,0,1,0,0|2,0,0]=3 883 B10R1.113 CN1CCOC(C(=O)O)C1 Amb18946166 [0,0,0,1,0,0|2,0,0]=3 884 B10R1.113 CN1CCOC(C(=O)O)C1 Amb19514725 [0,0,0,1,0,0|2,0,0]=3 885 B10R1.113 CN1CCSC(C(=O)O)C1 Amb35603313 [0,0,0,1,0,0|2,0,0]=3 886 B10R1.113 CS(=O)C1CCCC(N)C1 Amb25777618 [0,0,0,1,0,0|3,0,0]=4 887 B10R1.113 CS(=O)C1CCCC(O)C1 Amb32753656 [0,0,0,1,0,0|3,0,0]=4 888 B10R1.113 C[C@@H]1CCC[C@@H](C(N)=O)C1 Amb28054502 [0,0,0,1,0,0|1,0,0]=2 889 B10R1.113 C[C@@H]1CCC[C@H](C(=O)O)N1 Amb25168905 [0,0,0,1,0,0|1,0,0]=2 890 B10R1.113 C[C@@H]1CCC[C@H](C(=O)O)N1 Amb32666562 [0,0,0,1,0,0|1,0,0]=2 891 B10R1.113 C[C@@H]1CCN[C@@H](C(=O)O)C1 Amb8393477 [0,0,0,1,0,0|1,0,0]=2 892 B10R1.113 C[C@@H]1CNCC(C(N)=O)O1 Amb27977144 [0,0,0,1,0,0|3,0,0]=4 893 B10R1.113 C[C@@H]1CNC[C@@H](C(=O)O)C1 Amb28198256 [0,0,0,1,0,0|1,0,0]=2 894 B10R1.113 C[C@@H]1CNC[C@@H](C(=O)O)O1 Amb33804088 [0,0,0,1,0,0|2,0,0]=3 895 B10R1.113 C[C@@H]1CNC[C@H](C(=O)O)C1 Amb28186632 [0,0,0,1,0,0|1,0,0]=2 896 B10R1.113 C[C@@H]1CNC[C@H](C(=O)O)C1 Amb35746974 [0,0,0,1,0,0|1,0,0]=2 897 B10R1.113 C[C@@H]1CNC[C@H](C(=O)O)O1 Amb25378882 [0,0,0,1,0,0|2,0,0]=3 898 B10R1.113 C[C@@H]1CNC[C@H](C(=O)O)O1 Amb32664812 [0,0,0,1,0,0|2,0,0]=3 899 B10R1.113 C[C@@H]1COC[C@H](C(=O)O)N1 Amb25102766 [0,0,0,1,0,0|2,0,0]=3 900 B10R1.113 C[C@@H]1COC[C@H](C(=O)O)N1 Amb32796271 [0,0,0,1,0,0|2,0,0]=3 901 B10R1.113 C[C@@H]1C[C@H](C(=O)O)CCN1 Amb31147397 [0,0,0,1,0,0|1,0,0]=2 902 B10R1.113 C[C@@H]1C[C@H](C(=O)O)CCN1 Amb32670817 [0,0,0,1,0,0|1,0,0]=2 903 B10R1.113 C[C@@H]1C[C@H](C(=O)O)NCO1 Amb27618567 [0,0,0,1,0,0|2,0,0]=3 904 B10R1.113 C[C@@H]1C[C@H](C(=O)O)OCO1 Amb28428440 [0,0,0,1,0,0|2,0,0]=3 905 B10R1.113 C[C@H]1CCCN(C(N)=O)C1 Amb28316041 [0,0,0,1,0,0|2,0,0]=3 906 B10R1.113 C[C@H]1CCC[C@@H](C(=O)O)C1 Amb25919595 [0,0,0,1,0,0|0,0,0]=1 907 B10R1.113 C[C@H]1CCC[C@@H](C(=O)O)N1 Amb28145011 [0,0,0,1,0,0|1,0,0]=2 908 B10R1.113 C[C@H]1CCC[C@@H](C(=O)O)N1 Amb35746778 [0,0,0,1,0,0|1,0,0]=2 909 B10R1.113 C[C@H]1CCC[C@@H]([C@@H](C)O)O1 Amb27452303 [0,0,0,1,0,0|2,0,1]=4 910 B10R1.113 C[C@H]1CCN[C@H](C(=O)O)C1 Amb22744764 [0,0,0,1,0,0|1,0,0]=2 911 B10R1.113 C[C@H]1CCN[C@H](C(=O)O)C1 Amb33330844 [0,0,0,1,0,0|1,0,0]=2 912 B10R1.113 C[C@H]1CCOC(C(=O)O)C1 Amb26057818 [0,0,0,1,0,0|1,0,0]=2 913 B10R1.113 C[C@H]1CCO[C@@H](C(=O)O)O1 Amb27815067 [0,0,0,1,0,0|2,0,0]=3 914 B10R1.113 C[C@H]1CCO[C@H](C(=O)O)C1 Amb26565299 [0,0,0,1,0,0|1,0,0]=2 915 B10R1.113 C[C@H]1CN(C(N)=O)CCN1 Amb28126849 [0,0,0,1,0,0|3,0,0]=4 916 B10R1.113 C[C@H]1CNC[C@@H](C(=O)O)C1 Amb26968513 [0,0,0,1,0,0|1,0,0]=2 917 B10R1.113 C[C@H]1COC[C@@H](C(=O)O)N1 Amb26528283 [0,0,0,1,0,0|2,0,0]=3 918 B10R1.113 C[C@H]1COC[C@@H](C(=O)O)N1 Amb35746779 [0,0,0,1,0,0|2,0,0]=3 919 B10R1.113 C[C@H]1COC[C@@H](C(N)=O)N1 Amb27867896 [0,0,0,1,0,0|3,0,0]=4 920 B10R1.113 C[C@H]1C[C@@H](C(=O)O)CCN1 Amb26405288 [0,0,0,1,0,0|1,0,0]=2 921 B10R1.113 C[C@H]1C[C@@H](C(=O)O)CCN1 Amb33362296 [0,0,0,1,0,0|1,0,0]=2 922 B10R1.113 C[C@H]1OCC[C@@H](C(=O)O)O1 Amb26918498 [0,0,0,1,0,0|2,0,0]=3 923 B10R1.113 C[NH+]1CCC=C(C(=O)O)C1 Amb24113846 [0,0,0,1,0,0|1,0,2]=4 924 B10R1.113 NC(=O)C1CCCC(=O)C1 Amb24470598 [0,0,0,1,0,0|2,0,1]=4 925 B10R1.113 NC(=O)C1CCCC(F)C1 Amb32943801 [0,0,0,1,0,0|2,0,0]=3 926 B10R1.113 NC(=O)C1CCCC(N)C1 Amb20669500 [0,0,0,1,0,0|2,0,0]=3 927 B10R1.113 NC(=O)C1CCCC(N)C1 Amb9709433 [0,0,0,1,0,0|2,0,0]=3 928 B10R1.113 NC(=O)C1CCCC(O)C1 Amb25067304 [0,0,0,1,0,0|2,0,0]=3 929 B10R1.113 NC(=O)C1CCCN(N)C1 Amb19663672 [0,0,0,1,0,0|3,0,0]=4 930 B10R1.113 NC(=O)C1CNCC(O)C1 Amb27634008 [0,0,0,1,0,0|3,0,0]=4 931 B10R1.113 NC(=O)N1CCCC(F)C1 Amb35711857 [0,0,0,1,0,0|3,0,0]=4 932 B10R1.113 NC(=O)N1CCCC(N)C1 Amb18278018 [0,0,0,1,0,0|3,0,0]=4 933 B10R1.113 NC(=O)N1CCCC(N)C1 Amb19149223 [0,0,0,1,0,0|3,0,0]=4 934 B10R1.113 NC(=O)N1CCC[C@@H](N)C1 Amb27424872 [0,0,0,1,0,0|3,0,0]=4 935 B10R1.113 NC(=O)N1CCC[C@H](N)C1 Amb32413880 [0,0,0,1,0,0|3,0,0]=4 936 B10R1.113 NC(=O)[C@@H]1CCC[C@@H](N)C1 Amb10873178 [0,0,0,1,0,0|2,0,0]=3 937 B10R1.113 NC(=O)[C@@H]1CCC[C@H](O)C1 Amb27433641 [0,0,0,1,0,0|2,0,0]=3 938 B10R1.113 NC(=O)[C@H]1CCC[C@@H](N)C1 Amb33457595 [0,0,0,1,0,0|2,0,0]=3 939 B10R1.113 NC(=O)[C@H]1CCC[C@@H](N)C1 Amb33457596 [0,0,0,1,0,0|2,0,0]=3 940 B10R1.113 NC(=S)C1CCCC(O)C1 Amb33328384 [0,0,0,1,0,0|2,1,0]=4 941 B10R1.113 NC1=NCCC(C(=O)O)C1 Amb28042963 [0,0,0,1,0,0|2,0,1]=4 942 B10R1.113 NC1C=CCC(C(=O)O)C1 Amb27180527 [0,0,0,1,0,0|1,0,2]=4 943 B10R1.113 NC1C=CCC(C(=O)O)C1 Amb32675210 [0,0,0,1,0,0|1,0,2]=4 944 B10R1.113 NC1CCCC(C(=O)Cl)C1 Amb27861962 [0,0,0,1,0,0|2,0,0]=3 945 B10R1.113 NC1CCCC(C(=O)O)C1 Amb32664151 [0,0,0,1,0,0|1,0,0]=2 946 B10R1.113 NC1CCCC(C(=O)O)C1 Amb33545486 [0,0,0,1,0,0|1,0,0]=2 947 B10R1.113 NC1CCOC(C(=O)O)C1 Amb26917330 [0,0,0,1,0,0|2,0,0]=3 948 B10R1.113 NC1CCOC(C(=O)O)C1 Amb33338762 [0,0,0,1,0,0|2,0,0]=3 949 B10R1.113 NC1COCC(C(=O)O)C1 Amb25088866 [0,0,0,1,0,0|2,0,0]=3 950 B10R1.113 N[C@@H]1CCC[C@@H](C(=O)O)C1 Amb10873166 [0,0,0,1,0,0|1,0,0]=2 951 B10R1.113 N[C@@H]1CCC[C@@H](C(=O)O)C1 Amb25989341 [0,0,0,1,0,0|1,0,0]=2 952 B10R1.113 N[C@@H]1CCC[C@H](C(=O)O)C1 Amb20241308 [0,0,0,1,0,0|1,0,0]=2 953 B10R1.113 N[C@@H]1CCC[C@H](C(=O)O)C1 Amb32643943 [0,0,0,1,0,0|1,0,0]=2 954 B10R1.113 N[C@@H]1CNC[C@@H](C(=O)O)C1 Amb27186917 [0,0,0,1,0,0|2,0,0]=3 955 B10R1.113 N[C@H]1C=CC[C@@H](C(=O)O)C1 Amb26568665 [0,0,0,1,0,0|1,0,2]=4 956 B10R1.113 N[C@H]1C=CC[C@@H](C(=O)O)C1 Amb32675220 [0,0,0,1,0,0|1,0,2]=4 957 B10R1.113 N[C@H]1C=CC[C@H](C(=O)O)C1 Amb26589126 [0,0,0,1,0,0|1,0,2]=4 958 B10R1.113 N[C@H]1C=CC[C@H](C(=O)O)C1 Amb32679286 [0,0,0,1,0,0|1,0,2]=4 959 B10R1.113 N[C@H]1CCC[C@@H](C(=O)O)C1 Amb20241307 [0,0,0,1,0,0|1,0,0]=2 960 B10R1.113 N[C@H]1CCC[C@@H](C(=O)O)C1 Amb23439976 [0,0,0,1,0,0|1,0,0]=2 961 B10R1.113 N[C@H]1CCC[C@H](C(=O)O)C1 Amb22746829 [0,0,0,1,0,0|1,0,0]=2 962 B10R1.113 N[C@H]1CCC[C@H](C(=O)O)C1 Amb23439848 [0,0,0,1,0,0|1,0,0]=2 963 B10R1.113 N[C@H]1CCO[C@H](C(=O)O)C1 Amb32992741 [0,0,0,1,0,0|2,0,0]=3 964 B10R1.113 O=C(Cl)C1CCCC(Cl)C1 Amb28322791 [0,0,0,1,0,0|2,0,0]=3 965 B10R1.113 O=C(Cl)N1CCCC(F)C1 Amb35625971 [0,0,0,1,0,0|3,0,0]=4 966 B10R1.113 O=C(Cl)N1CCCC(O)C1 Amb28326001 [0,0,0,1,0,0|3,0,0]=4 967 B10R1.113 O=C(O)C1=CC(O)CCC1 Amb25889028 [0,0,0,1,0,0|1,0,2]=4 968 B10R1.113 O=C(O)C1=C[C@H](O)CCC1 Amb27203167 [0,0,0,1,0,0|1,0,2]=4 969 B10R1.113 O=C(O)C1CC(Cl)CNN1 Amb27837992 [0,0,0,1,0,0|3,0,0]=4 970 B10R1.113 O=C(O)C1CC(F)CCN1 Amb24423965 [0,0,0,1,0,0|2,0,0]=3 971 B10R1.113 O=C(O)C1CC(O)CCN1 Amb24117443 [0,0,0,1,0,0|2,0,0]=3 972 B10R1.113 O=C(O)C1CC(O)CCO1 Amb28246597 [0,0,0,1,0,0|2,0,0]=3 973 B10R1.113 O=C(O)C1CCCC(F)C1 Amb26004039 [0,0,0,1,0,0|1,0,0]=2 974 B10R1.113 O=C(O)C1CCCC(O)C1 Amb33544783 [0,0,0,1,0,0|1,0,0]=2 975 B10R1.113 O=C(O)C1CCCC(S)C1 Amb32788453 [0,0,0,1,0,0|1,0,0]=2 976 B10R1.113 O=C(O)C1CNCC(O)C1 Amb2695137 [0,0,0,1,0,0|2,0,0]=3 977 B10R1.113 O=C(O)C1CNCC(O)C1 Amb8630089 [0,0,0,1,0,0|2,0,0]=3 978 B10R1.113 O=C(O)C1COCC(O)C1 Amb27810785 [0,0,0,1,0,0|2,0,0]=3 979 B10R1.113 O=C(O)C1CS(=O)CCN1 Amb26024462 [0,0,0,1,0,0|3,0,0]=4 980 B10R1.113 O=C(O)C1CS(=O)CCN1 Amb33038317 [0,0,0,1,0,0|3,0,0]=4 981 B10R1.113 O=C(O)[C@@H]1CC=C[C@H](O)C1 Amb25960767 [0,0,0,1,0,0|1,0,2]=4 982 B10R1.113 O=C(O)[C@@H]1CCC[C@@H](O)C1 Amb22899464 [0,0,0,1,0,0|1,0,0]=2 983 B10R1.113 O=C(O)[C@@H]1CCC[C@H](Br)C1 Amb28053594 [0,0,0,1,0,0|1,0,0]=2 984 B10R1.113 O=C(O)[C@@H]1CCC[C@H](O)C1 Amb28059041 [0,0,0,1,0,0|1,0,0]=2 985 B10R1.113 O=C(O)[C@@H]1CNC[C@@H](O)C1 Amb27186916 [0,0,0,1,0,0|2,0,0]=3 986 B10R1.113 O=C(O)[C@@H]1CNC[C@H](F)C1 Amb27447199 [0,0,0,1,0,0|2,0,0]=3 987 B10R1.113 O=C(O)[C@@H]1CNC[C@H](O)C1 Amb27188671 [0,0,0,1,0,0|2,0,0]=3 988 B10R1.113 O=C(O)[C@@H]1CS(=O)CCN1 Amb27444621 [0,0,0,1,0,0|3,0,0]=4 989 B10R1.113 O=C(O)[C@@H]1C[C@@H](O)CCN1 Amb22388540 [0,0,0,1,0,0|2,0,0]=3 990 B10R1.113 O=C(O)[C@@H]1C[C@H](F)CCN1 Amb27786906 [0,0,0,1,0,0|2,0,0]=3 991 B10R1.113 O=C(O)[C@@H]1C[C@H](O)CCN1 Amb22386828 [0,0,0,1,0,0|2,0,0]=3 992 B10R1.113 O=C(O)[C@@H]1C[C@H](O)CNN1 Amb25949203 [0,0,0,1,0,0|3,0,0]=4 993 B10R1.113 O=C(O)[C@H]1CCC[C@@H](Cl)C1 Amb28436868 [0,0,0,1,0,0|1,0,0]=2 994 B10R1.113 O=C(O)[C@H]1CCC[C@@H](O)C1 Amb22899465 [0,0,0,1,0,0|1,0,0]=2 995 B10R1.113 O=C(O)[C@H]1CCC[C@H](Cl)C1 Amb28385610 [0,0,0,1,0,0|1,0,0]=2 996 B10R1.113 O=C(O)[C@H]1C[C@@H](O)CCN1 Amb20241913 [0,0,0,1,0,0|2,0,0]=3 997 B10R1.113 O=C(O)[C@H]1C[C@H](O)CCN1 Amb22748263 [0,0,0,1,0,0|2,0,0]=3 998 B10R1.113 O=C(O)[C@H]1C[C@H](O)CCN1 Amb30982057 [0,0,0,1,0,0|2,0,0]=3 999 B10R1.113 O=C(O)[C@H]1C[C@H](O)CNN1 Amb27450594 [0,0,0,1,0,0|3,0,0]=4 1000 B10R1.113 O=C1CC(C(=O)O)CCN1 Amb33531218 [0,0,0,1,0,0|2,0,1]=4 1001 B10R1.113 O=C1CCCC(C(=O)O)C1 Amb6305244 [0,0,0,1,0,0|1,0,1]=3 1002 B10R1.113 O=C1CCCC(C(=O)O)N1 Amb2697230 [0,0,0,1,0,0|2,0,1]=4 1003 B10R1.113 O=C1CCCC(C(=O)O)O1 Amb27969173 [0,0,0,1,0,0|2,0,1]=4 1004 B10R1.113 O=C1CCC[C@@H](C(=O)O)C1 Amb28050152 [0,0,0,1,0,0|1,0,1]=3 1005 B10R1.113 O=C1CCC[C@@H](C(=O)O)N1 Amb10576327 [0,0,0,1,0,0|2,0,1]=4 1006 B10R1.113 O=C1CCC[C@H](C(=O)O)N1 Amb8631220 [0,0,0,1,0,0|2,0,1]=4 1007 B10R1.113 O=C1CCNC(C(=O)O)C1 Amb13889088 [0,0,0,1,0,0|2,0,1]=4 1008 B10R1.113 O=C1CCNC(C(=O)O)C1 Amb13889089 [0,0,0,1,0,0|2,0,1]=4 1009 B10R1.113 O=C1CCN[C@@H](C(=O)O)C1 Amb27977165 [0,0,0,1,0,0|2,0,1]=4 1010 B10R1.113 O=C1CCN[C@H](C(=O)O)C1 Amb13889084 [0,0,0,1,0,0|2,0,1]=4 1011 B10R1.113 O=C1CCN[C@H](C(=O)O)C1 Amb2699956 [0,0,0,1,0,0|2,0,1]=4 1012 B10R1.113 O=C1CCOC(C(=O)O)C1 Amb22496784 [0,0,0,1,0,0|2,0,1]=4 1013 B10R1.113 O=C1CNCC(C(=O)O)C1 Amb27244770 [0,0,0,1,0,0|2,0,1]=4 1014 B10R1.113 O=[PH](O)C1CCCC(Cl)C1 Amb27760848 [0,0,0,1,0,0|2,0,0]=3 1015 B10R1.130 C=CCC1CC(C)CC1=O Amb28202393 [0,0,0,1,0,0|1,0,2]=4 1016 B10R1.130 C=CC[C@@H]1C[C@H](C)NC1=O Amb27619172 [0,0,0,1,0,0|1,0,2]=4 1017 B10R1.130 CC1CC(=O)N(CCCl)C1 Amb27768716 [0,0,0,1,0,0|3,0,0]=4 1018 B10R1.130 CC1CC(=O)N(CCN)C1 Amb24551899 [0,0,0,1,0,0|3,0,0]=4 1019 B10R1.130 CC1CC(CCN)C(C)O1 Amb27617539 [0,0,0,1,0,0|2,0,1]=4 1020 B10R1.130 CC1CC(O)C(CCO)C1 Amb27663277 [0,0,0,1,0,0|2,0,1]=4 1021 B10R1.130 CC1CN(CCCl)C(=O)O1 Amb28291401 [0,0,0,1,0,0|2,0,0]=3 1022 B10R1.130 CC1CN(CCN)C(=O)O1 Amb25083261 [0,0,0,1,0,0|2,0,0]=3 1023 B10R1.130 CC1C\C(=C/CBr)C(=O)O1 Amb28132415 [0,0,0,1,0,0|1,0,2]=4 1024 B10R1.130 CC1C\C(=C/CO)C(=O)O1 Amb27399744 [0,0,0,1,0,0|1,0,2]=4 1025 B10R1.130 CCCC1=CC(O)OC1=O Amb32655007 [0,0,0,1,0,0|1,0,2]=4 1026 B10R1.130 CCCC1CC(=O)OC1=O Amb24460269 [0,0,0,1,0,0|1,0,1]=3 1027 B10R1.130 CCCC1CC(C)OC1=O Amb4136406 [0,0,0,1,0,0|0,0,0]=1 1028 B10R1.130 CCCC1N=C(C)NC1=O Amb27839591 [0,0,0,1,0,0|2,0,1]=4 1029 B10R1.130 CCCC1NC(=O)OC1=O Amb28289807 [0,0,0,1,0,0|2,0,1]=4 1030 B10R1.130 CCCN1CC(N)CC1=O Amb22586939 [0,0,0,1,0,0|3,0,0]=4 1031 B10R1.130 CCCN1CC(N)CC1=O Amb8010273 [0,0,0,1,0,0|3,0,0]=4 1032 B10R1.130 CCC[C@H]1CC(=O)NC1=O Amb27792581 [0,0,0,1,0,0|2,0,1]=4 1033 B10R1.130 CC\C=C1\CC(C)OC1=O Amb27448139 [0,0,0,1,0,0|0,0,2]=3 1034 B10R1.130 CN1CC(=O)C(CCN)C1 Amb18202573 [0,0,0,1,0,0|3,0,0]=4 1035 B10R1.130 COCC1CC(=O)OC1=O Amb33429415 [0,0,0,1,0,0|2,0,1]=4 1036 B10R1.130 CONC1CC(C)OC1=O Amb27588606 [0,0,0,1,0,0|2,0,0]=3 1037 B10R1.130 CSCC1CC(=O)OC1=O Amb33269668 [0,0,0,1,0,0|2,0,1]=4 1038 B10R1.130 C[C@@H]1C=C(CCO)C(=O)O1 Amb28350087 [0,0,0,1,0,0|1,0,2]=4 1039 B10R1.130 C[C@@H]1C[C@@H](N=[N+]=[N-])C(=O)O1 Amb27863871 [0,0,0,1,0,0|3,0,0]=4 1040 B10R1.130 C[C@H]1C[C@@H](N=[N+]=[N-])C(=O)O1 Amb27849808 [0,0,0,1,0,0|3,0,0]=4 1041 B10R1.130 C[C@H]1C[C@H](O)[C@H](CCO)C1 Amb27849012 [0,0,0,1,0,0|2,0,1]=4 1042 B10R1.130 O=C1CC(CCF)C(=O)O1 Amb33196047 [0,0,0,1,0,0|2,0,1]=4 1043 B10R1.133 CCCC1CCNS1(=O)=O Amb33298958 [0,0,0,1,0,0|2,0,1]=4 1044 B10R1.133 CCCC1COCC1(C)O Amb30028927 [0,0,0,1,0,0|2,0,1]=4 1045 B10R1.133 CCNC1CCCC1(C)O Amb27759775 [0,0,0,1,0,0|2,0,1]=4 1046 B10R1.133 CCSC1CCCC1(C)O Amb27252604 [0,0,0,1,0,0|2,0,1]=4 1047 B10R1.133 CNCC1CCCS1(=O)=O Amb27228668 [0,0,0,1,0,0|2,0,1]=4 1048 B10R1.133 C[C@@]1(O)CCC[C@@H]1CCO Amb27632026 [0,0,0,1,0,0|2,0,1]=4 1049 B10R1.133 C[C@]1(O)CCC[C@H]1CCO Amb27452335 [0,0,0,1,0,0|2,0,1]=4 1050 B10R1.133 NCCC1CCCS1(=O)=O Amb17063303 [0,0,0,1,0,0|2,0,1]=4 1051 B10R1.133 NCCC1CCCS1(=O)=O Amb32679560 [0,0,0,1,0,0|2,0,1]=4 1052 B10R1.188 CC[C@@H]1[C@H](CCO)[C@]1(C)O Amb28069683 [0,0,0,1,0,0|2,0,1]=4 1053 B10R1.188 CC[C@H]1[C@H](CCO)[C@]1(C)O Amb27422276 [0,0,0,1,0,0|2,0,1]=4 1054 B10R1.290 C#CCC(C(=O)O)C1CC1 Amb27461500 [0,0,0,1,0,0|0,0,2]=3 1055 B10R1.290 CC(=O)N(CCN)C1CC1 Amb18293862 [0,0,0,1,0,0|3,0,0]=4 1056 B10R1.290 CCCC(C(=O)O)C1CC1 Amb23590272 [0,0,0,1,0,0|0,0,0]=1 1057 B10R1.290 CCCN(C(=O)Cl)C1CC1 Amb32864045 [0,0,0,1,0,0|2,0,0]=3 1058 B10R1.290 CCOC(C(=O)O)C1CC1 Amb25274241 [0,0,0,1,0,0|1,0,0]=2 1059 B10R1.290 COCC(C(C)=O)C1CC1 Amb27644437 [0,0,0,1,0,0|2,0,0]=3 1060 B10R1.290 COCC(C(C)O)C1CC1 Amb27837864 [0,0,0,1,0,0|2,0,1]=4 1061 B10R1.290 CSCC(C(=O)O)C1CC1 Amb27195252 [0,0,0,1,0,0|1,0,0]=2 1062 B10R1.290 N#CNC(C(=O)O)C1CC1 Amb35634514 [0,0,0,1,0,0|2,0,1]=4 1063 B10R1.290 NC(=O)N(CCO)C1CC1 Amb9440433 [0,0,0,1,0,0|3,0,0]=4 1064 B10R1.290 NCCN(C(N)=O)C1CC1 Amb18967817 [0,0,0,1,0,0|3,0,0]=4 1065 B10R1.290 O=C(Cl)N(CCCl)C1CC1 Amb33296740 [0,0,0,1,0,0|3,0,0]=4 1066 B10R1.290 O=CNC(C(=O)O)C1CC1 Amb18995530 [0,0,0,1,0,0|2,0,1]=4 1067 B10R1.316 CCCC1C(=O)OC1C=O Amb27954085 [0,0,0,1,0,0|1,0,1]=3 1068 B10R1.316 CCCC1C(=O)OC1CO Amb27413997 [0,0,0,1,0,0|1,0,0]=2 1069 B10R1.316 CCC[C@H]1C(=O)O[C@H]1CO Amb27863867 [0,0,0,1,0,0|1,0,0]=2 1070 B10R1.316 C\C=C1/OC(=O)C1CCCl Amb28040901 [0,0,0,1,0,0|1,0,2]=4 1071 B10R1.348 CC(=O)C1CCCCCC1 Amb24407172 [0,0,0,1,0,0|1,0,0]=2 1072 B10R1.348 CC(=O)C1CCCCCN1 Amb25169359 [0,0,0,1,0,0|2,0,0]=3 1073 B10R1.348 CC(=O)C1CCCOCC1 Amb27772516 [0,0,0,1,0,0|2,0,0]=3 1074 B10R1.348 CC(=O)C1CCCSCC1 Amb30031083 [0,0,0,1,0,0|2,0,0]=3 1075 B10R1.348 CC(=O)C1CNCCOC1 Amb33132256 [0,0,0,1,0,0|3,0,0]=4 1076 B10R1.348 CC(=O)C1COCCOC1 Amb27949270 [0,0,0,1,0,0|3,0,0]=4 1077 B10R1.348 CC(=O)N1CCCCCC1 Amb6340881 [0,0,0,1,0,0|2,0,0]=3 1078 B10R1.348 CC(=O)N1CCCNCC1 Amb1157142 [0,0,0,1,0,0|3,0,0]=4 1079 B10R1.348 CC(=O)N1CCCNCC1 Amb19959942 [0,0,0,1,0,0|3,0,0]=4 1080 B10R1.348 CC(=O)N1CCCNCC1 Amb22587131 [0,0,0,1,0,0|3,0,0]=4 1081 B10R1.348 CC(=O)N1CCCOCC1 Amb28126728 [0,0,0,1,0,0|3,0,0]=4 1082 B10R1.348 CC(C)=C1CCCCCC1 Amb25048552 [0,0,0,1,0,0|2,0,1]=4 1083 B10R1.348 CC(N)C1CCCCCC1 Amb18202669 [0,0,0,1,0,0|2,0,1]=4 1084 B10R1.348 CC(N)C1CCCCCC1 Amb32666063 [0,0,0,1,0,0|2,0,1]=4 1085 B10R1.348 CC(O)C1CCCCCC1 Amb24712689 [0,0,0,1,0,0|1,0,1]=3 1086 B10R1.348 CC(O)C1CCCOCC1 Amb27755851 [0,0,0,1,0,0|2,0,1]=4 1087 B10R1.348 CC(O)C1CCCSCC1 Amb35615609 [0,0,0,1,0,0|2,0,1]=4 1088 B10R1.348 CC(O)N1CCCCCC1 Amb27270904 [0,0,0,1,0,0|2,0,1]=4 1089 B10R1.348 CN(C)C1CCCCCC1 Amb27460632 [0,0,0,1,0,0|3,0,0]=4 1090 B10R1.348 CS(=O)C1CCCNCC1 Amb35630144 [0,0,0,1,0,0|3,0,0]=4 1091 B10R1.348 C[C@@H](N)C1CCCCCC1 Amb27948161 [0,0,0,1,0,0|2,0,1]=4 1092 B10R1.348 C[C@@H](N)C1CCCCCC1 Amb32932451 [0,0,0,1,0,0|2,0,1]=4 1093 B10R1.348 C[C@@H](O)C1CCCCCC1 Amb27801050 [0,0,0,1,0,0|1,0,1]=3 1094 B10R1.348 C[C@H](N)C1CCCCCC1 Amb26068799 [0,0,0,1,0,0|2,0,1]=4 1095 B10R1.348 C[C@H](N)C1CCCCCC1 Amb32932450 [0,0,0,1,0,0|2,0,1]=4 1096 B10R1.348 C[C@H](O)C1CCCCCC1 Amb27248256 [0,0,0,1,0,0|1,0,1]=3 1097 B10R1.348 N=C(N)C1CCCCCC1 Amb2696076 [0,0,0,1,0,0|2,0,0]=3 1098 B10R1.348 N=C(N)C1CCCCCC1 Amb33803881 [0,0,0,1,0,0|2,0,0]=3 1099 B10R1.348 N=C(N)C1CCCSCC1 Amb30029710 [0,0,0,1,0,0|3,0,0]=4 1100 B10R1.348 N=C(N)N1CCCCCC1 Amb32411316 [0,0,0,1,0,0|3,0,0]=4 1101 B10R1.348 N=C(N)N1CCCCCC1 Amb6682748 [0,0,0,1,0,0|3,0,0]=4 1102 B10R1.348 NC(=O)C1CCCCCC1 Amb24182051 [0,0,0,1,0,0|1,0,0]=2 1103 B10R1.348 NC(=O)C1CCCCCN1 Amb23596651 [0,0,0,1,0,0|2,0,0]=3 1104 B10R1.348 NC(=O)C1CCCCNC1 Amb27483476 [0,0,0,1,0,0|2,0,0]=3 1105 B10R1.348 NC(=O)C1CCCSCC1 Amb30030983 [0,0,0,1,0,0|2,0,0]=3 1106 B10R1.348 NC(=O)C1CNCCNC1 Amb27475768 [0,0,0,1,0,0|3,0,0]=4 1107 B10R1.348 NC(=O)C1CNCCOC1 Amb20062256 [0,0,0,1,0,0|3,0,0]=4 1108 B10R1.348 NC(=O)N1CCCCCC1 Amb1107239 [0,0,0,1,0,0|2,0,0]=3 1109 B10R1.348 NC(=O)N1CCCNCC1 Amb1113721 [0,0,0,1,0,0|3,0,0]=4 1110 B10R1.348 NC(=S)C1CCCCCC1 Amb27787519 [0,0,0,1,0,0|1,1,0]=3 1111 B10R1.348 NC(=S)C1CCCSCC1 Amb35627560 [0,0,0,1,0,0|2,1,0]=4 1112 B10R1.348 NC(=S)N1CCCCCC1 Amb1132149 [0,0,0,1,0,0|2,1,0]=4 1113 B10R1.348 NS(=O)C1CCCCCC1 Amb32720551 [0,0,0,1,0,0|2,0,0]=3 1114 B10R1.348 O=C(Cl)C1CCCCCC1 Amb18797932 [0,0,0,1,0,0|1,0,0]=2 1115 B10R1.348 O=C(Cl)C1CCCSCC1 Amb35649671 [0,0,0,1,0,0|2,0,0]=3 1116 B10R1.348 O=C(Cl)N1CCCCCC1 Amb17563067 [0,0,0,1,0,0|2,0,0]=3 1117 B10R1.348 O=C(Cl)N1CCCOCC1 Amb27617144 [0,0,0,1,0,0|3,0,0]=4 1118 B10R1.348 O=C(Cl)N1CCCSCC1 Amb24404551 [0,0,0,1,0,0|3,0,0]=4 1119 B10R1.348 O=C(O)C1=CCCCCC1 Amb26605756 [0,0,0,1,0,0|0,0,2]=3 1120 B10R1.348 O=C(O)C1=CCCNCC1 Amb28119954 [0,0,0,1,0,0|1,0,2]=4 1121 B10R1.348 O=C(O)C1=CCCOCC1 Amb27197038 [0,0,0,1,0,0|1,0,2]=4 1122 B10R1.348 O=C(O)C1=CCNCCC1 Amb27254135 [0,0,0,1,0,0|1,0,2]=4 1123 B10R1.348 O=C(O)C1=NCCCCN1 Amb27975697 [0,0,0,1,0,0|2,0,1]=4 1124 B10R1.348 O=C(O)C1CCC=CCC1 Amb22364688 [0,0,0,1,0,0|0,0,2]=3 1125 B10R1.348 O=C(O)C1CCCCCC1 Amb2721236 [0,0,0,1,0,0|0,0,0]=1 1126 B10R1.348 O=C(O)C1CCCCCN1 Amb542684 [0,0,0,1,0,0|1,0,0]=2 1127 B10R1.348 O=C(O)C1CCCCCN1 Amb8504180 [0,0,0,1,0,0|1,0,0]=2 1128 B10R1.348 O=C(O)C1CCCCCO1 Amb28294213 [0,0,0,1,0,0|1,0,0]=2 1129 B10R1.348 O=C(O)C1CCCCNC1 Amb30586509 [0,0,0,1,0,0|1,0,0]=2 1130 B10R1.348 O=C(O)C1CCCCNC1 Amb8630383 [0,0,0,1,0,0|1,0,0]=2 1131 B10R1.348 O=C(O)C1CCCCNN1 Amb28287718 [0,0,0,1,0,0|2,0,0]=3 1132 B10R1.348 O=C(O)C1CCCNCC1 Amb18831588 [0,0,0,1,0,0|1,0,0]=2 1133 B10R1.348 O=C(O)C1CCCNCC1 Amb33189342 [0,0,0,1,0,0|1,0,0]=2 1134 B10R1.348 O=C(O)C1CCCOCC1 Amb18831505 [0,0,0,1,0,0|1,0,0]=2 1135 B10R1.348 O=C(O)C1CCCSCC1 Amb18199262 [0,0,0,1,0,0|1,0,0]=2 1136 B10R1.348 O=C(O)C1CCNCCO1 Amb27632727 [0,0,0,1,0,0|2,0,0]=3 1137 B10R1.348 O=C(O)C1CNCCCN1 Amb25890339 [0,0,0,1,0,0|2,0,0]=3 1138 B10R1.348 O=C(O)C1CNCCCN1 Amb28896027 [0,0,0,1,0,0|2,0,0]=3 1139 B10R1.348 O=C(O)C1CNCCCO1 Amb17739810 [0,0,0,1,0,0|2,0,0]=3 1140 B10R1.348 O=C(O)C1CNCCOC1 Amb27600407 [0,0,0,1,0,0|2,0,0]=3 1141 B10R1.348 O=C(O)C1CNCCOC1 Amb32664315 [0,0,0,1,0,0|2,0,0]=3 1142 B10R1.348 O=C(O)C1CNCCSC1 Amb27813931 [0,0,0,1,0,0|2,0,0]=3 1143 B10R1.348 O=C(O)C1COCCOC1 Amb26443379 [0,0,0,1,0,0|2,0,0]=3 1144 B10R1.348 O=C(O)[C@@H]1CC=CCCN1 Amb27440042 [0,0,0,1,0,0|1,0,2]=4 1145 B10R1.348 O=C(O)[C@@H]1CCCCCN1 Amb2699229 [0,0,0,1,0,0|1,0,0]=2 1146 B10R1.348 O=C(O)[C@@H]1CCCCCN1 Amb8630384 [0,0,0,1,0,0|1,0,0]=2 1147 B10R1.348 O=C(O)[C@@H]1CCCNCC1 Amb27411309 [0,0,0,1,0,0|1,0,0]=2 1148 B10R1.348 O=C(O)[C@@H]1CCCOCC1 Amb27839414 [0,0,0,1,0,0|1,0,0]=2 1149 B10R1.348 O=C(O)[C@@H]1CSCCCN1 Amb28121128 [0,0,0,1,0,0|2,0,0]=3 1150 B10R1.348 O=C(O)[C@H]1CCCCCN1 Amb27770395 [0,0,0,1,0,0|1,0,0]=2 1151 B10R1.348 O=C(O)[C@H]1CCCCCN1 Amb33299452 [0,0,0,1,0,0|1,0,0]=2 1152 B10R1.348 O=C(O)[C@H]1CCCNCC1 Amb24479341 [0,0,0,1,0,0|1,0,0]=2 1153 B10R1.348 O=C(O)[C@H]1CCCOCC1 Amb27604305 [0,0,0,1,0,0|1,0,0]=2 1154 B10R1.348 O=S(Cl)C1CCCCCC1 Amb32720550 [0,0,0,1,0,0|2,0,0]=3 1155 B10R1.348 O=S([O-])C1CCCCCC1 Amb32754517 [0,0,0,1,0,0|1,0,1]=3 1156 B10R1.348 O=[N+]([O-])C1CCCCCC1 Amb4036167 [0,0,0,1,0,0|1,0,1]=3 1157 B10R1.348 O=[N+]([O-])C1CCCNCC1 Amb27209406 [0,0,0,1,0,0|2,0,1]=4 1158 B10R1.348 O=[N+]([O-])C1CCCOCC1 Amb33299036 [0,0,0,1,0,0|2,0,1]=4 1159 B10R1.348 OB(O)C1CCCCOC1 Amb24314282 [0,0,0,1,0,0|2,0,1]=4 1160 B10R1.348 S=C(S)N1CCCCCC1 Amb2781940 [0,0,0,1,0,0|1,2,0]=4 1161 B10R1.348 S=C([S-])N1CCCCCC1 Amb33164004 [0,0,0,1,0,0|1,2,0]=4 1162 B10R1.379 CCCC1(CCC)CC1N Amb19022073 [0,0,0,1,0,0|2,0,1]=4 1163 B10R1.381 C#CCC1(C(=O)O)CCC1 Amb22157197 [0,0,0,1,0,0|0,0,2]=3 1164 B10R1.381 C=C(C)C1(CCN)CCC1 Amb33226205 [0,0,0,1,0,0|3,0,0]=4 1165 B10R1.381 C=C(F)C1(CCO)CCC1 Amb33068931 [0,0,0,1,0,0|3,0,0]=4 1166 B10R1.381 C=CCC1(C(=O)O)CCC1 Amb33544669 [0,0,0,1,0,0|0,0,2]=3 1167 B10R1.381 C=CCC1(C(=O)O)CNC1 Amb27815252 [0,0,0,1,0,0|1,0,2]=4 1168 B10R1.381 C=CCC1(C(=O)O)CNC1 Amb32684569 [0,0,0,1,0,0|1,0,2]=4 1169 B10R1.381 C=CCC1(C(=O)O)COC1 Amb32684775 [0,0,0,1,0,0|1,0,2]=4 1170 B10R1.381 CCCC1(C(=O)O)CCC1 Amb20668929 [0,0,0,1,0,0|0,0,0]=1 1171 B10R1.381 CCCC1(C(=O)O)CNC1 Amb27468966 [0,0,0,1,0,0|1,0,0]=2 1172 B10R1.381 CCNC1(C(=O)O)COC1 Amb27837887 [0,0,0,1,0,0|2,0,0]=3 1173 B10R1.381 CCNC1(C(N)=O)CCC1 Amb18970931 [0,0,0,1,0,0|2,0,0]=3 1174 B10R1.381 CCNC1(C(N)=O)COC1 Amb27614890 [0,0,0,1,0,0|3,0,0]=4 1175 B10R1.381 CCOC1(C(=O)O)CCC1 Amb26958863 [0,0,0,1,0,0|1,0,0]=2 1176 B10R1.381 CCOC1(C(=O)O)CNC1 Amb23439880 [0,0,0,1,0,0|2,0,0]=3 1177 B10R1.381 CCOC1(C(=O)O)CNC1 Amb26035741 [0,0,0,1,0,0|2,0,0]=3 1178 B10R1.381 CCOC1(C(=O)O)COC1 Amb35585379 [0,0,0,1,0,0|2,0,0]=3 1179 B10R1.381 CCSC1(C(=O)O)CCC1 Amb26443238 [0,0,0,1,0,0|1,0,0]=2 1180 B10R1.381 COCC1(C(=O)O)CCC1 Amb10608205 [0,0,0,1,0,0|1,0,0]=2 1181 B10R1.381 COCC1(C(=O)O)CNC1 Amb28195558 [0,0,0,1,0,0|2,0,0]=3 1182 B10R1.381 COCC1(C(=O)O)CNC1 Amb33483866 [0,0,0,1,0,0|2,0,0]=3 1183 B10R1.381 COCC1(C(N)=O)CCC1 Amb26355503 [0,0,0,1,0,0|2,0,0]=3 1184 B10R1.381 COCC1(C(N)=S)CCC1 Amb23556124 [0,0,0,1,0,0|2,1,0]=4 1185 B10R1.381 COCC1(S(=O)Cl)CCC1 Amb32721012 [0,0,0,1,0,0|3,0,0]=4 1186 B10R1.381 COCC1(S(N)=O)CCC1 Amb32721013 [0,0,0,1,0,0|3,0,0]=4 1187 B10R1.381 CSCC1(C(=O)O)CCC1 Amb26973227 [0,0,0,1,0,0|1,0,0]=2 1188 B10R1.381 N#CCC1(C(=O)O)CCC1 Amb26865115 [0,0,0,1,0,0|1,0,1]=3 1189 B10R1.381 N#CCC1(C(=O)O)CNC1 Amb35719225 [0,0,0,1,0,0|2,0,1]=4 1190 B10R1.381 N#CNC1(C(=O)O)CCC1 Amb30030650 [0,0,0,1,0,0|2,0,1]=4 1191 B10R1.381 NCCC1(C(=O)O)CCC1 Amb24335142 [0,0,0,1,0,0|1,0,0]=2 1192 B10R1.381 NCCC1(C(=O)O)CCC1 Amb30526932 [0,0,0,1,0,0|1,0,0]=2 1193 B10R1.381 O=C(O)C1(CCCl)CCC1 Amb27617232 [0,0,0,1,0,0|1,0,0]=2 1194 B10R1.381 O=C(O)C1(CCF)CCC1 Amb25720467 [0,0,0,1,0,0|1,0,0]=2 1195 B10R1.381 O=C(O)C1(CCF)CNC1 Amb28072145 [0,0,0,1,0,0|2,0,0]=3 1196 B10R1.381 O=C(O)C1(CCO)CCC1 Amb24524590 [0,0,0,1,0,0|1,0,0]=2 1197 B10R1.381 O=C(O)C1(CCO)CNC1 Amb25200374 [0,0,0,1,0,0|2,0,0]=3 1198 B10R1.381 O=C(O)C1(CCO)COC1 Amb32946256 [0,0,0,1,0,0|2,0,0]=3 1199 B10R1.381 O=CCC1(C(=O)O)CCC1 Amb27813211 [0,0,0,1,0,0|1,0,1]=3 1200 B10R1.381 O=CNC1(C(=O)O)CCC1 Amb24749006 [0,0,0,1,0,0|2,0,1]=4 1201 B10R1.396 CC1CC1(CCO)C(=O)O Amb32946225 [0,0,0,1,0,0|1,0,0]=2 1202 B10R1.396 CC1CC1(NC=O)C(=O)O Amb24714889 [0,0,0,1,0,0|2,0,1]=4 1203 B10R1.396 CCCC1(C(C)=O)CC1S Amb27968396 [0,0,0,1,0,0|2,0,0]=3 1204 B10R1.396 CCC[C@@]1(C(N)=O)O[C@H]1C Amb27214633 [0,0,0,1,0,0|2,0,0]=3 1205 B10R1.396 CCOC1(C(=O)O)CC1N Amb8389492 [0,0,0,1,0,0|2,0,0]=3 1206 B10R1.396 CCSC1(C(=O)O)CC1C Amb27827499 [0,0,0,1,0,0|1,0,0]=2 1207 B10R1.396 COCC1(C(=O)O)CC1Br Amb27850880 [0,0,0,1,0,0|2,0,0]=3 1208 B10R1.396 C[C@H]1C[C@@]1(NC=O)C(=O)O Amb27490833 [0,0,0,1,0,0|2,0,1]=4 1209 B10R1.397 CCCC(CCC)C1CO1 Amb27785275 [0,0,0,1,0,0|1,0,1]=3 1210 B10R1.397 CCCC(CCC)[C@@H]1CO1 Amb33423871 [0,0,0,1,0,0|1,0,1]=3 1211 B10R1.397 CCCC(CCC)[C@H]1CO1 Amb33423878 [0,0,0,1,0,0|1,0,1]=3 1212 B10R0.79 CCCC(=CC(=O)O)CCC Amb6749185 [0,0,0,0,0,1|0,0,1]=2 1213 B10R0.79 CCCC(=C[N+](=O)[O-])CCC Amb32755994 [0,0,0,0,0,1|1,0,2]=4 1214 B10R0.79 CCCC(CC(=O)O)NC=O Amb33254018 [0,0,0,0,0,1|2,0,1]=4 1215 B10R0.79 CCCC(CCC)CC(=N)N Amb33226299 [0,0,0,0,0,1|2,0,0]=3 1216 B10R0.79 CCCC(CCC)CC(=O)O Amb6749228 [0,0,0,0,0,1|0,0,0]=1 1217 B10R0.79 CCCC(CCC)CC(C)=O Amb33171732 [0,0,0,0,0,1|1,0,0]=2 1218 B10R0.79 CCCC(CCC)CC(C)O Amb32731043 [0,0,0,0,0,1|1,0,1]=3 1219 B10R0.79 CCCC(CCC)CC(N)=S Amb33423893 [0,0,0,0,0,1|1,1,0]=3 1220 B10R0.79 CCCC(CCC)CN(C)O Amb33224992 [0,0,0,0,0,1|2,0,0]=3 1221 B10R0.79 CCCC(CCC)C[C@@H](C)N Amb32730984 [0,0,0,0,0,1|2,0,1]=4 1222 B10R0.79 CCCC(CCC)C[C@@H](C)O Amb32730981 [0,0,0,0,0,1|1,0,1]=3 1223 B10R0.79 CCCC(CCC)C[C@H](C)N Amb32730983 [0,0,0,0,0,1|2,0,1]=4 1224 B10R0.79 CCCC(CCC)C[C@H](C)O Amb32730982 [0,0,0,0,0,1|1,0,1]=3 1225 B10R0.79 CCCC(CCC)C[N+](=O)[O-] Amb33359158 [0,0,0,0,0,1|1,0,1]=3 1226 B10R0.79 CCCN(CCC)CC(=O)O Amb5775259 [0,0,0,0,0,1|1,0,0]=2 1227 B10R0.79 CCCN(CCC)CC(C)=O Amb3940736 [0,0,0,0,0,1|2,0,0]=3 1228 B10R0.79 CCCN(CCC)CC(C)O Amb4019971 [0,0,0,0,0,1|2,0,1]=4 1229 B10R0.79 CCCN(CCC)CC(N)=O Amb17142887 [0,0,0,0,0,1|2,0,0]=3 1230 B10R0.79 CCCN(CCC)CC(N)=S Amb6265437 [0,0,0,0,0,1|2,1,0]=4 1231 B10R0.79 CCC\C(=C/C(C)=O)NCC Amb28080338 [0,0,0,0,0,1|2,0,1]=4 1232 B10R0.79 CCOC(CC(=O)O)OCC Amb8388147 [0,0,0,0,0,1|2,0,0]=3 1233 B10R0.79 CCOC(CC(C)=O)OCC Amb2693775 [0,0,0,0,0,1|3,0,0]=4 1234 B10R0.79 CCOC(CC(N)=O)OCC Amb20623352 [0,0,0,0,0,1|3,0,0]=4 1235 B10R0.79 CCOC(OCC)OC(C)=O Amb16186743 [0,0,0,0,0,1|3,0,0]=4 1236 B10R0.79 O=C(O)CN(CCO)CCO Amb534844 [0,0,0,0,0,1|3,0,0]=4 1237 B7R0.5 C#CCC(C)C(=O)O Amb18633959 [2,0,0,0,0,0|0,0,2]=4 1238 B7R0.5 C#CC[C@H](C)C(=O)O Amb10844036 [2,0,0,0,0,0|0,0,2]=4 1239 B7R0.5 C=C(CCC)C(=O)O Amb18641779 [2,0,0,0,0,0|0,0,2]=4 1240 B7R0.5 C=CCC(C)C(=O)O Amb33545044 [2,0,0,0,0,0|0,0,2]=4 1241 B7R0.5 CC#CC(C)C(=O)O Amb22748425 [2,0,0,0,0,0|0,0,2]=4 1242 B7R0.5 CC(=O)C(C)CCBr Amb26849777 [2,0,0,0,0,0|2,0,0]=4 1243 B7R0.5 CC(=O)C(C)CCCl Amb26326637 [2,0,0,0,0,0|2,0,0]=4 1244 B7R0.5 CC(=O)C(C)CCO Amb13881368 [2,0,0,0,0,0|2,0,0]=4 1245 B7R0.5 CC(CC#N)C(=O)O Amb17334056 [2,0,0,0,0,0|1,0,1]=4 1246 B7R0.5 CC(CC=O)C(=O)O Amb27952476 [2,0,0,0,0,0|1,0,1]=4 1247 B7R0.5 CC(CCBr)C(=O)Br Amb27948455 [2,0,0,0,0,0|2,0,0]=4 1248 B7R0.5 CC(CCBr)C(=O)O Amb27409152 [2,0,0,0,0,0|1,0,0]=3 1249 B7R0.5 CC(CCCl)C(=O)Cl Amb25744436 [2,0,0,0,0,0|2,0,0]=4 1250 B7R0.5 CC(CCF)C(=O)O Amb24678386 [2,0,0,0,0,0|1,0,0]=3 1251 B7R0.5 CC(CCN)C(=O)O Amb20667970 [2,0,0,0,0,0|1,0,0]=3 1252 B7R0.5 CC(CCN)C(=O)O Amb538221 [2,0,0,0,0,0|1,0,0]=3 1253 B7R0.5 CC(CCO)C(=O)O Amb18641949 [2,0,0,0,0,0|1,0,0]=3 1254 B7R0.5 CC(CCO)C(=O)[O-] Amb33330478 [2,0,0,0,0,0|1,0,1]=4 1255 B7R0.5 CC(CCO)C(N)=O Amb28280962 [2,0,0,0,0,0|2,0,0]=4 1256 B7R0.5 CC(CNO)C(=O)O Amb28315956 [2,0,0,0,0,0|2,0,0]=4 1257 B7R0.5 CC(CSS)C(=O)O Amb27437183 [2,0,0,0,0,0|2,0,0]=4 1258 B7R0.5 CC(NCO)C(=O)O Amb27468253 [2,0,0,0,0,0|2,0,0]=4 1259 B7R0.5 CCCC(=O)C(=O)O Amb22347924 [2,0,0,0,0,0|1,0,1]=4 1260 B7R0.5 CCCC(Br)C(=O)Cl Amb17569837 [2,0,0,0,0,0|2,0,0]=4 1261 B7R0.5 CCCC(Br)C(=O)O Amb2795765 [2,0,0,0,0,0|1,0,0]=3 1262 B7R0.5 CCCC(Br)C(C)=O Amb26870127 [2,0,0,0,0,0|2,0,0]=4 1263 B7R0.5 CCCC(C)C(=N)N Amb27810844 [2,0,0,0,0,0|2,0,0]=4 1264 B7R0.5 CCCC(C)C(=N)N Amb33212650 [2,0,0,0,0,0|2,0,0]=4 1265 B7R0.5 CCCC(C)C(=O)Cl Amb2689582 [2,0,0,0,0,0|1,0,0]=3 1266 B7R0.5 CCCC(C)C(=O)O Amb3938958 [2,0,0,0,0,0|0,0,0]=2 1267 B7R0.5 CCCC(C)C(C)=O Amb4034597 [2,0,0,0,0,0|1,0,0]=3 1268 B7R0.5 CCCC(C)C(C)O Amb4036337 [2,0,0,0,0,0|1,0,1]=4 1269 B7R0.5 CCCC(C)C(N)=O Amb3886535 [2,0,0,0,0,0|1,0,0]=3 1270 B7R0.5 CCCC(C)C(N)=S Amb25138492 [2,0,0,0,0,0|1,1,0]=4 1271 B7R0.5 CCCC(C)S(=O)Cl Amb32720536 [2,0,0,0,0,0|2,0,0]=4 1272 B7R0.5 CCCC(C)S(=O)[O-] Amb32754802 [2,0,0,0,0,0|1,0,1]=4 1273 B7R0.5 CCCC(C)S(N)=O Amb32720511 [2,0,0,0,0,0|2,0,0]=4 1274 B7R0.5 CCCC(C)[C@@H](C)O Amb33322347 [2,0,0,0,0,0|1,0,1]=4 1275 B7R0.5 CCCC(C)[C@H](C)O Amb33322346 [2,0,0,0,0,0|1,0,1]=4 1276 B7R0.5 CCCC(Cl)C(=O)O Amb17593470 [2,0,0,0,0,0|1,0,0]=3 1277 B7R0.5 CCCC(F)C(=O)O Amb25842008 [2,0,0,0,0,0|1,0,0]=3 1278 B7R0.5 CCCC(F)C(C)=O Amb28316211 [2,0,0,0,0,0|2,0,0]=4 1279 B7R0.5 CCCC(F)C(N)=O Amb28127390 [2,0,0,0,0,0|2,0,0]=4 1280 B7R0.5 CCCC(N)C(=O)O Amb6262055 [2,0,0,0,0,0|1,0,0]=3 1281 B7R0.5 CCCC(N)C(C)=O Amb27838289 [2,0,0,0,0,0|2,0,0]=4 1282 B7R0.5 CCCC(N)C(N)=O Amb22284825 [2,0,0,0,0,0|2,0,0]=4 1283 B7R0.5 CCCC(N)C(N)=O Amb9514970 [2,0,0,0,0,0|2,0,0]=4 1284 B7R0.5 CCCC(O)C(=O)O Amb2818222 [2,0,0,0,0,0|1,0,0]=3 1285 B7R0.5 CCCC(O)C(C)=O Amb22495823 [2,0,0,0,0,0|2,0,0]=4 1286 B7R0.5 CCCC(O)C(N)=O Amb24116553 [2,0,0,0,0,0|2,0,0]=4 1287 B7R0.5 CCCC(S)C(=O)O Amb18124440 [2,0,0,0,0,0|1,0,0]=3 1288 B7R0.5 CCCN(C)C(=O)Cl Amb26478280 [2,0,0,0,0,0|2,0,0]=4 1289 B7R0.5 CCCN(C)C(N)=O Amb8898960 [2,0,0,0,0,0|2,0,0]=4 1290 B7R0.5 CCC[C@@H](C)C(=O)O Amb10844028 [2,0,0,0,0,0|0,0,0]=2 1291 B7R0.5 CCC[C@@H](C)C(C)O Amb28187641 [2,0,0,0,0,0|1,0,1]=4 1292 B7R0.5 CCC[C@@H](C)[C@@H](C)O Amb27181050 [2,0,0,0,0,0|1,0,1]=4 1293 B7R0.5 CCC[C@@H](Cl)C(=O)O Amb27266071 [2,0,0,0,0,0|1,0,0]=3 1294 B7R0.5 CCC[C@@H](N)C(=O)O Amb8514700 [2,0,0,0,0,0|1,0,0]=3 1295 B7R0.5 CCC[C@@H](N)C(C)=O Amb35659946 [2,0,0,0,0,0|2,0,0]=4 1296 B7R0.5 CCC[C@@H](N)C(N)=O Amb22745048 [2,0,0,0,0,0|2,0,0]=4 1297 B7R0.5 CCC[C@@H](N)C(N)=O Amb24505187 [2,0,0,0,0,0|2,0,0]=4 1298 B7R0.5 CCC[C@@H](O)C(=O)O Amb22746731 [2,0,0,0,0,0|1,0,0]=3 1299 B7R0.5 CCC[C@H](Br)C(=O)O Amb26515784 [2,0,0,0,0,0|1,0,0]=3 1300 B7R0.5 CCC[C@H](C)C(=O)O Amb10844037 [2,0,0,0,0,0|0,0,0]=2 1301 B7R0.5 CCC[C@H](C)C(C)=O Amb27463637 [2,0,0,0,0,0|1,0,0]=3 1302 B7R0.5 CCC[C@H](C)[C@H](C)O Amb28065150 [2,0,0,0,0,0|1,0,1]=4 1303 B7R0.5 CCC[C@H](Cl)C(=O)O Amb27801931 [2,0,0,0,0,0|1,0,0]=3 1304 B7R0.5 CCC[C@H](N)C(=O)O Amb30647420 [2,0,0,0,0,0|1,0,0]=3 1305 B7R0.5 CCC[C@H](N)C(=O)O Amb8514701 [2,0,0,0,0,0|1,0,0]=3 1306 B7R0.5 CCC[C@H](N)C(C)=O Amb35662324 [2,0,0,0,0,0|2,0,0]=4 1307 B7R0.5 CCC[C@H](N)C(N)=O Amb26916392 [2,0,0,0,0,0|2,0,0]=4 1308 B7R0.5 CCC[C@H](N)C(N)=O Amb33813498 [2,0,0,0,0,0|2,0,0]=4 1309 B7R0.5 CCC[C@H](O)C(=O)O Amb22226514 [2,0,0,0,0,0|1,0,0]=3 1310 B7R0.5 CCC[C@H](O)C(C)=O Amb25097084 [2,0,0,0,0,0|2,0,0]=4 1311 B7R0.5 CCC[C@H](S)C(=O)O Amb28045752 [2,0,0,0,0,0|1,0,0]=3 1312 B7R0.5 CCNC(C)C(=O)O Amb33527634 [2,0,0,0,0,0|1,0,0]=3 1313 B7R0.5 CCNC(C)C(=O)O Amb9326962 [2,0,0,0,0,0|1,0,0]=3 1314 B7R0.5 CCNC(C)C(N)=O Amb21959648 [2,0,0,0,0,0|2,0,0]=4 1315 B7R0.5 CCNC(C)C(N)=O Amb7758139 [2,0,0,0,0,0|2,0,0]=4 1316 B7R0.5 CCNC(O)C(=O)O Amb27259098 [2,0,0,0,0,0|2,0,0]=4 1317 B7R0.5 CCN[C@@H](C)C(=O)O Amb26579594 [2,0,0,0,0,0|1,0,0]=3 1318 B7R0.5 CCN[C@H](C)C(=O)O Amb24351099 [2,0,0,0,0,0|1,0,0]=3 1319 B7R0.5 CCOC(C)C(=O)O Amb9725271 [2,0,0,0,0,0|1,0,0]=3 1320 B7R0.5 CCOC(C)C(C)=O Amb9666103 [2,0,0,0,0,0|2,0,0]=4 1321 B7R0.5 CCOC(C)C(N)=O Amb19960053 [2,0,0,0,0,0|2,0,0]=4 1322 B7R0.5 CCOC(F)C(=O)O Amb27210743 [2,0,0,0,0,0|2,0,0]=4 1323 B7R0.5 CCSC(C)C(=O)O Amb9721554 [2,0,0,0,0,0|1,0,0]=3 1324 B7R0.5 CCSC(C)C(N)=O Amb27830179 [2,0,0,0,0,0|2,0,0]=4 1325 B7R0.5 CC\C=C(/C)C(=O)O Amb2689584 [2,0,0,0,0,0|0,0,2]=4 1326 B7R0.5 CC\C=C(\C)C(=O)O Amb27233430 [2,0,0,0,0,0|0,0,2]=4 1327 B7R0.5 CNCC(C)C(=O)O Amb13952364 [2,0,0,0,0,0|1,0,0]=3 1328 B7R0.5 CNCC(C)C(=O)O Amb9400281 [2,0,0,0,0,0|1,0,0]=3 1329 B7R0.5 CNCC(C)C(N)=O Amb8943991 [2,0,0,0,0,0|2,0,0]=4 1330 B7R0.5 CNCC(N)C(=O)O Amb10845350 [2,0,0,0,0,0|2,0,0]=4 1331 B7R0.5 CNCC(O)C(=O)O Amb26894610 [2,0,0,0,0,0|2,0,0]=4 1332 B7R0.5 CNC[C@H](N)C(=O)O Amb17617148 [2,0,0,0,0,0|2,0,0]=4 1333 B7R0.5 CNC[C@H](N)C(=O)O Amb19892230 [2,0,0,0,0,0|2,0,0]=4 1334 B7R0.5 COCC(Br)C(=O)O Amb17594709 [2,0,0,0,0,0|2,0,0]=4 1335 B7R0.5 COCC(C)C(=O)O Amb33545090 [2,0,0,0,0,0|1,0,0]=3 1336 B7R0.5 COCC(C)C(C)=O Amb24683449 [2,0,0,0,0,0|2,0,0]=4 1337 B7R0.5 COCC(C)C(N)=O Amb27401584 [2,0,0,0,0,0|2,0,0]=4 1338 B7R0.5 COCC(Cl)C(=O)O Amb10068384 [2,0,0,0,0,0|2,0,0]=4 1339 B7R0.5 COCC(N)C(=O)O Amb33551350 [2,0,0,0,0,0|2,0,0]=4 1340 B7R0.5 COCC(N)C(=O)O Amb6752055 [2,0,0,0,0,0|2,0,0]=4 1341 B7R0.5 COCC(O)C(=O)O Amb18124273 [2,0,0,0,0,0|2,0,0]=4 1342 B7R0.5 COCC(S)C(=O)O Amb27763656 [2,0,0,0,0,0|2,0,0]=4 1343 B7R0.5 COC[C@@H](C)C(=O)O Amb26599229 [2,0,0,0,0,0|1,0,0]=3 1344 B7R0.5 COC[C@@H](N)C(=O)O Amb10604051 [2,0,0,0,0,0|2,0,0]=4 1345 B7R0.5 COC[C@@H](N)C(=O)O Amb22744762 [2,0,0,0,0,0|2,0,0]=4 1346 B7R0.5 COC[C@H](C)C(=O)O Amb10844266 [2,0,0,0,0,0|1,0,0]=3 1347 B7R0.5 COC[C@H](N)C(=O)O Amb33801358 [2,0,0,0,0,0|2,0,0]=4 1348 B7R0.5 COC[C@H](N)C(=O)O Amb8515080 [2,0,0,0,0,0|2,0,0]=4 1349 B7R0.5 COC[C@H](O)C(=O)O Amb27778843 [2,0,0,0,0,0|2,0,0]=4 1350 B7R0.5 CON[C@@H](C)C(=O)O Amb27862116 [2,0,0,0,0,0|2,0,0]=4 1351 B7R0.5 CSCC(C)C(=O)O Amb18967825 [2,0,0,0,0,0|1,0,0]=3 1352 B7R0.5 CSCC(Cl)C(=O)O Amb26878419 [2,0,0,0,0,0|2,0,0]=4 1353 B7R0.5 CSCC(N)C(=O)O Amb33804791 [2,0,0,0,0,0|2,0,0]=4 1354 B7R0.5 CSCC(N)C(=O)O Amb6280829 [2,0,0,0,0,0|2,0,0]=4 1355 B7R0.5 CSCC(O)C(=O)O Amb25131873 [2,0,0,0,0,0|2,0,0]=4 1356 B7R0.5 CSC[C@@H](C)C(=O)O Amb26047434 [2,0,0,0,0,0|1,0,0]=3 1357 B7R0.5 CSC[C@@H](N)C(=O)O Amb9813743 [2,0,0,0,0,0|2,0,0]=4 1358 B7R0.5 CSC[C@H](N)C(=O)O Amb6364886 [2,0,0,0,0,0|2,0,0]=4 1359 B7R0.5 C[C@@H](CCF)C(=O)O Amb33744644 [2,0,0,0,0,0|1,0,0]=3 1360 B7R0.5 C[C@@H](CCN)C(=O)O Amb10844043 [2,0,0,0,0,0|1,0,0]=3 1361 B7R0.5 C[C@H](CCF)C(=O)O Amb33738115 [2,0,0,0,0,0|1,0,0]=3 1362 B7R0.5 C[C@H](NCO)C(=O)O Amb24401217 [2,0,0,0,0,0|2,0,0]=4 1363 B7R0.5 C[Se]C[C@@H](N)C(=O)O Amb22745692 [2,0,0,0,0,0|2,0,0]=4 1364 B7R0.5 C[Se]C[C@H](N)C(=O)O Amb10601626 [2,0,0,0,0,0|2,0,0]=4 1365 B7R0.5 NC(CCBr)C(=O)O Amb21858417 [2,0,0,0,0,0|2,0,0]=4 1366 B7R0.5 NC(CCCl)C(=O)O Amb28241385 [2,0,0,0,0,0|2,0,0]=4 1367 B7R0.5 NC(CCF)C(=O)O Amb25889337 [2,0,0,0,0,0|2,0,0]=4 1368 B7R0.5 NC(CCF)C(=O)O Amb28934889 [2,0,0,0,0,0|2,0,0]=4 1369 B7R0.5 NC(CCO)C(=O)O Amb8514287 [2,0,0,0,0,0|2,0,0]=4 1370 B7R0.5 NC(CCS)C(=O)O Amb19267093 [2,0,0,0,0,0|2,0,0]=4 1371 B7R0.5 NC(CCS)C(=O)O Amb3499433 [2,0,0,0,0,0|2,0,0]=4 1372 B7R0.5 NCCC(Br)C(=O)O Amb28128317 [2,0,0,0,0,0|2,0,0]=4 1373 B7R0.5 NCCC(F)C(=O)O Amb10838221 [2,0,0,0,0,0|2,0,0]=4 1374 B7R0.5 NCCC(F)C(=O)O Amb22229524 [2,0,0,0,0,0|2,0,0]=4 1375 B7R0.5 NCCC(N)C(=O)O Amb2697841 [2,0,0,0,0,0|2,0,0]=4 1376 B7R0.5 NCCC(N)C(=O)O Amb8514694 [2,0,0,0,0,0|2,0,0]=4 1377 B7R0.5 NCCC(O)C(=O)O Amb16232090 [2,0,0,0,0,0|2,0,0]=4 1378 B7R0.5 NCC[C@@H](F)C(=O)O Amb24055858 [2,0,0,0,0,0|2,0,0]=4 1379 B7R0.5 NCC[C@@H](N)C(=O)O Amb16183852 [2,0,0,0,0,0|2,0,0]=4 1380 B7R0.5 NCC[C@@H](N)C(=O)O Amb23438994 [2,0,0,0,0,0|2,0,0]=4 1381 B7R0.5 NCC[C@@H](N)C(=O)O Amb8390364 [2,0,0,0,0,0|2,0,0]=4 1382 B7R0.5 NCC[C@@H](O)C(=O)O Amb22748225 [2,0,0,0,0,0|2,0,0]=4 1383 B7R0.5 NCC[C@H](F)C(=O)O Amb24055857 [2,0,0,0,0,0|2,0,0]=4 1384 B7R0.5 NCC[C@H](N)C(=O)O Amb16183862 [2,0,0,0,0,0|2,0,0]=4 1385 B7R0.5 NCC[C@H](N)C(=O)O Amb2720151 [2,0,0,0,0,0|2,0,0]=4 1386 B7R0.5 NCC[C@H](N)C(=O)O Amb33812683 [2,0,0,0,0,0|2,0,0]=4 1387 B7R0.5 NCC[C@H](N)C(=O)O Amb9825390 [2,0,0,0,0,0|2,0,0]=4 1388 B7R0.5 NCC[C@H](O)C(=O)O Amb8386099 [2,0,0,0,0,0|2,0,0]=4 1389 B7R0.5 N[C@@H](CCBr)C(=O)O Amb8515827 [2,0,0,0,0,0|2,0,0]=4 1390 B7R0.5 N[C@@H](CCF)C(=O)O Amb26458628 [2,0,0,0,0,0|2,0,0]=4 1391 B7R0.5 N[C@@H](CCO)C(=O)O Amb20242705 [2,0,0,0,0,0|2,0,0]=4 1392 B7R0.5 N[C@@H](CCO)C(=O)O Amb6600040 [2,0,0,0,0,0|2,0,0]=4 1393 B7R0.5 N[C@@H](CCS)C(=O)O Amb6600039 [2,0,0,0,0,0|2,0,0]=4 1394 B7R0.5 N[C@H](CCF)C(=O)O Amb27206623 [2,0,0,0,0,0|2,0,0]=4 1395 B7R0.5 N[C@H](CCI)C(=O)O Amb27600675 [2,0,0,0,0,0|2,0,0]=4 1396 B7R0.5 N[C@H](CCO)C(=O)O Amb4166299 [2,0,0,0,0,0|2,0,0]=4 1397 B7R0.5 O=C(O)C(Br)CCBr Amb19889695 [2,0,0,0,0,0|2,0,0]=4 1398 B7R0.5 O=C(O)C(Br)CCO Amb28325416 [2,0,0,0,0,0|2,0,0]=4 1399 B7R0.5 O=C(O)C(Cl)CCCl Amb18126030 [2,0,0,0,0,0|2,0,0]=4 1400 B7R0.5 O=C(O)C(O)CCCl Amb27644540 [2,0,0,0,0,0|2,0,0]=4 1401 B7R0.5 O=C(O)C(O)CCF Amb28071189 [2,0,0,0,0,0|2,0,0]=4 1402 B7R0.5 O=C(O)C(O)CCO Amb24689942 [2,0,0,0,0,0|2,0,0]=4 1403 B7R0.5 O=C(O)C(S)CCS Amb27634893 [2,0,0,0,0,0|2,0,0]=4 1404 B7R0.5 O=C(O)[C@@H](O)CCBr Amb27238673 [2,0,0,0,0,0|2,0,0]=4 1405 B7R0.12 C=CC(CC)CCC Amb26515787 [2,0,0,0,0,0|1,0,0]=3 1406 B7R0.12 C=CC(CO)CCC Amb27857843 [2,0,0,0,0,0|2,0,0]=4 1407 B7R0.12 C=C[C@H](CC)CCO Amb27812473 [2,0,0,0,0,0|2,0,0]=4 1408 B7R0.12 CCC(CO)CCN Amb27838851 [2,0,0,0,0,0|1,0,1]=4 1409 B7R0.12 CCC(CO)COC Amb27474297 [2,0,0,0,0,0|1,0,1]=4 1410 B7R0.12 CCC(COC)NO Amb27223367 [2,0,0,0,0,0|2,0,0]=4 1411 B7R0.12 CCCC(C#N)C=O Amb27408303 [2,0,0,0,0,0|1,0,1]=4 1412 B7R0.12 CCCC(C=O)C=O Amb26644051 [2,0,0,0,0,0|1,0,1]=4 1413 B7R0.12 CCCC(C=O)OC Amb25290248 [2,0,0,0,0,0|1,0,0]=3 1414 B7R0.12 CCCC(CC)CBr Amb24710188 [2,0,0,0,0,0|1,0,1]=4 1415 B7R0.12 CCCC(CC)CC Amb4019540 [2,0,0,0,0,0|1,0,1]=4 1416 B7R0.12 CCCC(CC)CCl Amb27256711 [2,0,0,0,0,0|1,0,1]=4 1417 B7R0.12 CCCC(CC)CO Amb26486953 [2,0,0,0,0,0|0,0,1]=3 1418 B7R0.12 CCCC(CC)NN Amb28340878 [2,0,0,0,0,0|2,0,0]=4 1419 B7R0.12 CCCC(CC)NO Amb27776666 [2,0,0,0,0,0|1,0,0]=3 1420 B7R0.12 CCCC(CC)SC Amb27457518 [2,0,0,0,0,0|2,0,0]=4 1421 B7R0.12 CCCC(CC)[Zn]Br Amb22000402 [2,0,0,0,0,0|2,0,0]=4 1422 B7R0.12 CCCC(CN)CO Amb26907962 [2,0,0,0,0,0|1,0,1]=4 1423 B7R0.12 CCCC(CO)CF Amb28052943 [2,0,0,0,0,0|1,0,1]=4 1424 B7R0.12 CCCC(CO)CO Amb6298036 [2,0,0,0,0,0|1,0,1]=4 1425 B7R0.12 CCCC(CO)OC Amb27207376 [2,0,0,0,0,0|1,0,1]=4 1426 B7R0.12 CCCN(CC)N=O Amb22730890 [2,0,0,0,0,0|2,0,0]=4 1427 B7R0.12 CCC[C@@H](CC)CO Amb27405222 [2,0,0,0,0,0|0,0,1]=3 1428 B7R0.12 CCC[C@@H](CN)CO Amb27949320 [2,0,0,0,0,0|1,0,1]=4 1429 B7R0.12 CCC[C@H](C=O)SC Amb28287171 [2,0,0,0,0,0|1,0,0]=3 1430 B7R0.12 CCC[C@H](CC)CBr Amb27595055 [2,0,0,0,0,0|1,0,1]=4 1431 B7R0.12 CCC[C@H](CN)CO Amb28316219 [2,0,0,0,0,0|1,0,1]=4 1432 B7R0.12 CCC\C(=C\Cl)CC Amb27788138 [2,0,0,0,0,0|1,0,1]=4 1433 B7R0.12 CCNC(CC)CO Amb6735191 [2,0,0,0,0,0|1,0,1]=4 1434 B7R0.12 CCN[C@@H](CC)CO Amb22745950 [2,0,0,0,0,0|1,0,1]=4 1435 B7R0.12 CCN[C@H](CC)CO Amb24624036 [2,0,0,0,0,0|1,0,1]=4 1436 B7R0.12 CCOC(C=O)CO Amb27164613 [2,0,0,0,0,0|2,0,0]=4 1437 B7R0.12 CCOC(CC)CO Amb27755431 [2,0,0,0,0,0|1,0,1]=4 1438 B7R0.12 CC\C=C(/C=O)CC Amb18641709 [2,0,0,0,0,0|0,0,2]=4 1439 B7R0.12 C\C=C(\C=O)CCC Amb27435435 [2,0,0,0,0,0|0,0,2]=4 1440 B7R0.15 C=C(C)C(CC)CC Amb4019532 [2,0,0,0,0,0|2,0,0]=4 1441 B7R0.15 C=CC(CC)C(=O)O Amb28119400 [2,0,0,0,0,0|0,0,2]=4 1442 B7R0.15 CCC(C#N)C(=O)O Amb17210513 [2,0,0,0,0,0|1,0,1]=4 1443 B7R0.15 CCC(C=O)C(=O)O Amb28410235 [2,0,0,0,0,0|1,0,1]=4 1444 B7R0.15 CCC(CC)C(=N)N Amb25794850 [2,0,0,0,0,0|2,0,0]=4 1445 B7R0.15 CCC(CC)C(=N)N Amb33295167 [2,0,0,0,0,0|2,0,0]=4 1446 B7R0.15 CCC(CC)C(=O)Cl Amb3939475 [2,0,0,0,0,0|1,0,0]=3 1447 B7R0.15 CCC(CC)C(=O)O Amb4605826 [2,0,0,0,0,0|0,0,0]=2 1448 B7R0.15 CCC(CC)C(=O)[O-] Amb22585838 [2,0,0,0,0,0|0,0,1]=3 1449 B7R0.15 CCC(CC)C(C)=O Amb33536259 [2,0,0,0,0,0|1,0,0]=3 1450 B7R0.15 CCC(CC)C(C)O Amb4020007 [2,0,0,0,0,0|1,0,1]=4 1451 B7R0.15 CCC(CC)C(N)=O Amb33550498 [2,0,0,0,0,0|1,0,0]=3 1452 B7R0.15 CCC(CC)C(N)=S Amb1118595 [2,0,0,0,0,0|1,1,0]=4 1453 B7R0.15 CCC(CC)S(=O)Cl Amb32720374 [2,0,0,0,0,0|2,0,0]=4 1454 B7R0.15 CCC(CC)S(=O)[O-] Amb24722702 [2,0,0,0,0,0|1,0,1]=4 1455 B7R0.15 CCC(CC)S(N)=O Amb32720375 [2,0,0,0,0,0|2,0,0]=4 1456 B7R0.15 CCC(CC)[C@@H](C)O Amb27478745 [2,0,0,0,0,0|1,0,1]=4 1457 B7R0.15 CCC(CC)[C@H](C)O Amb24355152 [2,0,0,0,0,0|1,0,1]=4 1458 B7R0.15 CCC(CC)[N+](=O)[O-] Amb25843309 [2,0,0,0,0,0|1,0,1]=4 1459 B7R0.15 CCC(CCl)C(=O)Cl Amb28421936 [2,0,0,0,0,0|2,0,0]=4 1460 B7R0.15 CCC(CCl)C(=O)O Amb27424156 [2,0,0,0,0,0|1,0,0]=3 1461 B7R0.15 CCC(CF)C(=O)O Amb27625346 [2,0,0,0,0,0|1,0,0]=3 1462 B7R0.15 CCC(CN)C(=O)O Amb18987934 [2,0,0,0,0,0|1,0,0]=3 1463 B7R0.15 CCC(CN)C(=O)O Amb19514932 [2,0,0,0,0,0|1,0,0]=3 1464 B7R0.15 CCC(CN)C(N)=O Amb18294192 [2,0,0,0,0,0|2,0,0]=4 1465 B7R0.15 CCC(CO)C(=O)O Amb18641947 [2,0,0,0,0,0|1,0,0]=3 1466 B7R0.15 CCC(CO)C(=O)[O-] Amb28934895 [2,0,0,0,0,0|1,0,1]=4 1467 B7R0.15 CCC(CO)C(N)=O Amb28314312 [2,0,0,0,0,0|2,0,0]=4 1468 B7R0.15 CCC(NC)C(=O)O Amb10610245 [2,0,0,0,0,0|1,0,0]=3 1469 B7R0.15 CCC(NC)C(=O)O Amb9619833 [2,0,0,0,0,0|1,0,0]=3 1470 B7R0.15 CCC(NC)C(C)=O Amb28049011 [2,0,0,0,0,0|2,0,0]=4 1471 B7R0.15 CCC(NC)C(N)=O Amb15701261 [2,0,0,0,0,0|2,0,0]=4 1472 B7R0.15 CCC(NCl)C(=O)O Amb28387574 [2,0,0,0,0,0|2,0,0]=4 1473 B7R0.15 CCC(NN)C(=O)O Amb18641955 [2,0,0,0,0,0|2,0,0]=4 1474 B7R0.15 CCC(NO)C(=O)O Amb4019788 [2,0,0,0,0,0|2,0,0]=4 1475 B7R0.15 CCC(OC)C(=O)O Amb8472685 [2,0,0,0,0,0|1,0,0]=3 1476 B7R0.15 CCC(OC)C(C)=O Amb26004835 [2,0,0,0,0,0|2,0,0]=4 1477 B7R0.15 CCC(OC)C(N)=O Amb2027289 [2,0,0,0,0,0|2,0,0]=4 1478 B7R0.15 CCC(SC)C(=O)O Amb17501348 [2,0,0,0,0,0|1,0,0]=3 1479 B7R0.15 CCC(SC)C(C)=O Amb28460748 [2,0,0,0,0,0|2,0,0]=4 1480 B7R0.15 CCN(CC)C(=O)Cl Amb6608946 [2,0,0,0,0,0|2,0,0]=4 1481 B7R0.15 CCN(CC)C(C)=O Amb3358092 [2,0,0,0,0,0|2,0,0]=4 1482 B7R0.15 CCN(CC)C(N)=O Amb1128168 [2,0,0,0,0,0|2,0,0]=4 1483 B7R0.15 CCN(CC)C(O)=S Amb24698748 [2,0,0,0,0,0|1,1,0]=4 1484 B7R0.15 CC[C@@H](CN)C(=O)O Amb27838297 [2,0,0,0,0,0|1,0,0]=3 1485 B7R0.15 CC[C@@H](CO)C(=O)O Amb22745321 [2,0,0,0,0,0|1,0,0]=3 1486 B7R0.15 CC[C@@H](NC)C(=O)O Amb28315876 [2,0,0,0,0,0|1,0,0]=3 1487 B7R0.15 CC[C@H](CN)C(=O)O Amb25790771 [2,0,0,0,0,0|1,0,0]=3 1488 B7R0.15 CC[C@H](CO)C(=O)O Amb16232065 [2,0,0,0,0,0|1,0,0]=3 1489 B7R0.15 CC[C@H](NC)C(=O)O Amb24505225 [2,0,0,0,0,0|1,0,0]=3 1490 B7R0.15 CC[C@H](NCl)C(=O)O Amb28193501 [2,0,0,0,0,0|2,0,0]=4 1491 B7R0.15 CC[C@H](NN)C(=O)O Amb28289412 [2,0,0,0,0,0|2,0,0]=4 1492 B7R0.15 CC[C@H](OC)C(C)=O Amb27243431 [2,0,0,0,0,0|2,0,0]=4 1493 B7R0.15 CNC(CN)C(=O)O Amb23515020 [2,0,0,0,0,0|2,0,0]=4 1494 B7R0.15 CNC(CN)C(=O)O Amb28934876 [2,0,0,0,0,0|2,0,0]=4 1495 B7R0.15 CNC(CO)C(=O)O Amb26068513 [2,0,0,0,0,0|2,0,0]=4 1496 B7R0.15 CNC(CS)C(=O)O Amb2781760 [2,0,0,0,0,0|2,0,0]=4 1497 B7R0.15 CN[C@@H](CO)C(=O)O Amb16183860 [2,0,0,0,0,0|2,0,0]=4 1498 B7R0.15 CN[C@@H](CS)C(=O)O Amb27630049 [2,0,0,0,0,0|2,0,0]=4 1499 B7R0.15 CN[C@@H](CS)C(=O)O Amb33875997 [2,0,0,0,0,0|2,0,0]=4 1500 B7R0.15 CN[C@H](CO)C(=O)O Amb26948665 [2,0,0,0,0,0|2,0,0]=4 1501 B7R0.15 COC(CN)C(=O)O Amb22059584 [2,0,0,0,0,0|2,0,0]=4 1502 B7R0.15 COC(CN)C(=O)O Amb24271092 [2,0,0,0,0,0|2,0,0]=4 1503 B7R0.15 COC(OC)C(=O)O Amb26446254 [2,0,0,0,0,0|2,0,0]=4 1504 B7R0.15 CO[C@@H](CN)C(=O)O Amb32679591 [2,0,0,0,0,0|2,0,0]=4 1505 B7R0.15 CO[C@@H](CN)C(=O)O Amb32679853 [2,0,0,0,0,0|2,0,0]=4 1506 B7R0.15 CO[C@@H](CO)C(=O)O Amb27409917 [2,0,0,0,0,0|2,0,0]=4 1507 B7R0.15 CSC(CCl)C(=O)O Amb24526774 [2,0,0,0,0,0|2,0,0]=4 1508 B7R0.15 CSC(CN)C(=O)O Amb28346880 [2,0,0,0,0,0|2,0,0]=4 1509 B7R0.15 CSC(SC)C(=O)O Amb28245282 [2,0,0,0,0,0|2,0,0]=4 1510 B7R0.15 C\C=C(/CC)C(=O)O Amb18641780 [2,0,0,0,0,0|0,0,2]=4 1511 B7R0.15 NCC(CF)C(=O)O Amb26995116 [2,0,0,0,0,0|2,0,0]=4 1512 B7R0.15 NC[C@H](CO)C(=O)O Amb26873333 [2,0,0,0,0,0|2,0,0]=4 1513 B7R0.15 O=C(O)C(CBr)CBr Amb2778682 [2,0,0,0,0,0|2,0,0]=4 1514 B7R0.15 O=C(O)C(CI)CI Amb17779784 [2,0,0,0,0,0|2,0,0]=4 1515 B7R0.15 O=C(O)C(CS)CS Amb26600542 [2,0,0,0,0,0|2,0,0]=4 1516 B7R0.7 C#CC[C@H](O)CCC Amb27950875 [2,0,0,0,0,0|0,0,2]=4 1517 B7R0.7 C=C(CCC)CCC Amb25088297 [2,0,0,0,0,0|0,0,1]=3 1518 B7R0.7 C=C(CCC)CCN Amb33374808 [2,0,0,0,0,0|1,0,1]=4 1519 B7R0.7 C=C(CCC)CCO Amb27642086 [2,0,0,0,0,0|1,0,1]=4 1520 B7R0.7 C=CCC(O)CCC Amb4019981 [2,0,0,0,0,0|0,0,2]=4 1521 B7R0.7 C=CC[C@@H](O)CCC Amb28315693 [2,0,0,0,0,0|0,0,2]=4 1522 B7R0.7 C=CC[C@H](O)CCC Amb27221895 [2,0,0,0,0,0|0,0,2]=4 1523 B7R0.7 CCCC(=O)CCBr Amb27845324 [2,0,0,0,0,0|1,0,1]=4 1524 B7R0.7 CCCC(=O)CCC Amb6608653 [2,0,0,0,0,0|0,0,1]=3 1525 B7R0.7 CCCC(=O)CCCl Amb17593421 [2,0,0,0,0,0|1,0,1]=4 1526 B7R0.7 CCCC(=O)CCN Amb25104618 [2,0,0,0,0,0|1,0,1]=4 1527 B7R0.7 CCCC(=O)CNC Amb27251893 [2,0,0,0,0,0|1,0,1]=4 1528 B7R0.7 CCCC(=O)OCC Amb3940136 [2,0,0,0,0,0|1,0,1]=4 1529 B7R0.7 CCCC(Br)CCC Amb8968455 [2,0,0,0,0,0|1,0,0]=3 1530 B7R0.7 CCCC(Br)CCCl Amb27472207 [2,0,0,0,0,0|2,0,0]=4 1531 B7R0.7 CCCC(C)CCBr Amb24526467 [2,0,0,0,0,0|1,0,1]=4 1532 B7R0.7 CCCC(C)CCC Amb22229829 [2,0,0,0,0,0|0,0,1]=3 1533 B7R0.7 CCCC(C)CCCl Amb24333870 [2,0,0,0,0,0|1,0,1]=4 1534 B7R0.7 CCCC(C)CCN Amb31145475 [2,0,0,0,0,0|1,0,1]=4 1535 B7R0.7 CCCC(C)CCN Amb839082 [2,0,0,0,0,0|1,0,1]=4 1536 B7R0.7 CCCC(C)CCO Amb22733616 [2,0,0,0,0,0|1,0,1]=4 1537 B7R0.7 CCCC(C)CCS Amb33320804 [2,0,0,0,0,0|1,0,1]=4 1538 B7R0.7 CCCC(C)CNC Amb33330634 [2,0,0,0,0,0|1,0,1]=4 1539 B7R0.7 CCCC(C)CNC Amb6719001 [2,0,0,0,0,0|1,0,1]=4 1540 B7R0.7 CCCC(C)NCC Amb22586730 [2,0,0,0,0,0|1,0,1]=4 1541 B7R0.7 CCCC(C)NCC Amb9726218 [2,0,0,0,0,0|1,0,1]=4 1542 B7R0.7 CCCC(C)OCC Amb22733741 [2,0,0,0,0,0|1,0,1]=4 1543 B7R0.7 CCCC(Cl)CSC Amb27966841 [2,0,0,0,0,0|2,0,0]=4 1544 B7R0.7 CCCC(F)CCN Amb25869704 [2,0,0,0,0,0|2,0,0]=4 1545 B7R0.7 CCCC(F)CCO Amb27662632 [2,0,0,0,0,0|2,0,0]=4 1546 B7R0.7 CCCC(N)CCC Amb1102706 [2,0,0,0,0,0|1,0,0]=3 1547 B7R0.7 CCCC(N)CCN Amb27838332 [2,0,0,0,0,0|2,0,0]=4 1548 B7R0.7 CCCC(N)CCO Amb22050841 [2,0,0,0,0,0|2,0,0]=4 1549 B7R0.7 CCCC(N)CSC Amb18313615 [2,0,0,0,0,0|2,0,0]=4 1550 B7R0.7 CCCC(O)CCC Amb4035747 [2,0,0,0,0,0|0,0,0]=2 1551 B7R0.7 CCCC(O)CCN Amb22642684 [2,0,0,0,0,0|1,0,0]=3 1552 B7R0.7 CCCC(O)CCO Amb24181777 [2,0,0,0,0,0|1,0,0]=3 1553 B7R0.7 CCCC(O)CNC Amb18314672 [2,0,0,0,0,0|1,0,0]=3 1554 B7R0.7 CCCC(O)CNN Amb28316120 [2,0,0,0,0,0|2,0,0]=4 1555 B7R0.7 CCCC(O)COC Amb28347497 [2,0,0,0,0,0|1,0,0]=3 1556 B7R0.7 CCCC(S)CCC Amb7784733 [2,0,0,0,0,0|0,1,0]=3 1557 B7R0.7 CCCN(C)CCC Amb9787750 [2,0,0,0,0,0|1,0,1]=4 1558 B7R0.7 CCCN(N)CCC Amb17593208 [2,0,0,0,0,0|2,0,0]=4 1559 B7R0.7 CCCP(Cl)CCC Amb24120641 [2,0,0,0,0,0|2,0,0]=4 1560 B7R0.7 CCCS(=O)CCC Amb6366329 [2,0,0,0,0,0|1,0,0]=3 1561 B7R0.7 CCCS(=O)NCC Amb28062922 [2,0,0,0,0,0|2,0,0]=4 1562 B7R0.7 CCC[C@@H](C)CCBr Amb28363763 [2,0,0,0,0,0|1,0,1]=4 1563 B7R0.7 CCC[C@@H](N)CCO Amb22746035 [2,0,0,0,0,0|2,0,0]=4 1564 B7R0.7 CCC[C@@H](N)CNC Amb27452197 [2,0,0,0,0,0|2,0,0]=4 1565 B7R0.7 CCC[C@@H](O)CCN Amb33204237 [2,0,0,0,0,0|1,0,0]=3 1566 B7R0.7 CCC[C@@H](O)CCO Amb24422125 [2,0,0,0,0,0|1,0,0]=3 1567 B7R0.7 CCC[C@H](N)CCO Amb25889377 [2,0,0,0,0,0|2,0,0]=4 1568 B7R0.7 CCC[C@H](N)CCO Amb32409602 [2,0,0,0,0,0|2,0,0]=4 1569 B7R0.7 CCC[C@H](N)COC Amb28316177 [2,0,0,0,0,0|2,0,0]=4 1570 B7R0.7 CCC[C@H](N)CSC Amb28206579 [2,0,0,0,0,0|2,0,0]=4 1571 B7R0.7 CCC[C@H](O)CCN Amb33204238 [2,0,0,0,0,0|1,0,0]=3 1572 B7R0.7 CCC[PH](=O)CCC Amb26366296 [2,0,0,0,0,0|1,0,0]=3 1573 B7R0.7 CCOC(O)SCC Amb27653105 [2,0,0,0,0,0|2,0,0]=4 1574 B7R0.7 CNCC(O)CCF Amb33196461 [2,0,0,0,0,0|2,0,0]=4 1575 B7R0.7 CNCC(O)CCN Amb18559793 [2,0,0,0,0,0|2,0,0]=4 1576 B7R0.7 CNCC(O)CCO Amb27593318 [2,0,0,0,0,0|2,0,0]=4 1577 B7R0.7 CNCC(O)CNC Amb27838335 [2,0,0,0,0,0|2,0,0]=4 1578 B7R0.7 CNCC(O)COC Amb7969838 [2,0,0,0,0,0|2,0,0]=4 1579 B7R0.7 CNCC(O)COC Amb9741140 [2,0,0,0,0,0|2,0,0]=4 1580 B7R0.7 CNCC(O)CSC Amb19008591 [2,0,0,0,0,0|2,0,0]=4 1581 B7R0.7 CNC[C@H](O)COC Amb28133685 [2,0,0,0,0,0|2,0,0]=4 1582 B7R0.7 COCC(O)CCN Amb18203347 [2,0,0,0,0,0|2,0,0]=4 1583 B7R0.7 COCC(O)COC Amb2694755 [2,0,0,0,0,0|2,0,0]=4 1584 B7R0.7 COCC(O)CSC Amb27399113 [2,0,0,0,0,0|2,0,0]=4 1585 B7R0.7 COC[C@@H](O)CCN Amb24474146 [2,0,0,0,0,0|2,0,0]=4 1586 B7R0.7 COC[C@H](O)CCN Amb27650451 [2,0,0,0,0,0|2,0,0]=4 1587 B7R0.7 CSCC(O)CCN Amb25078322 [2,0,0,0,0,0|2,0,0]=4 1588 B7R0.7 CSCC(O)CSC Amb2779300 [2,0,0,0,0,0|2,0,0]=4 1589 B7R0.7 CSC[C@@H](O)CCN Amb33271743 [2,0,0,0,0,0|2,0,0]=4 1590 B7R0.7 CSC[C@H](O)CCN Amb33271745 [2,0,0,0,0,0|2,0,0]=4 1591 B7R0.7 NCCC(O)CCF Amb33196467 [2,0,0,0,0,0|2,0,0]=4 1592 B7R0.7 NCCC(O)CCN Amb25890416 [2,0,0,0,0,0|2,0,0]=4 1593 B7R0.7 NCCC(O)CCO Amb27876317 [2,0,0,0,0,0|2,0,0]=4 1594 B7R0.7 NCC[C@@H](O)CCF Amb33196425 [2,0,0,0,0,0|2,0,0]=4 1595 B7R0.7 NCC[C@@H](O)CCO Amb28187429 [2,0,0,0,0,0|2,0,0]=4 1596 B7R0.7 NCC[C@H](O)CCF Amb33196424 [2,0,0,0,0,0|2,0,0]=4 1597 B7R0.7 OCCC(O)CCO Amb17593226 [2,0,0,0,0,0|2,0,0]=4 1598 B9R0.9 CCC(CCN)P(C)(=O)O Amb27813282 [1,1,0,0,0,0|2,0,0]=4 1599 B9R0.9 CCCC(CC)S(=O)(=O)Cl Amb24763588 [1,1,0,0,0,0|1,0,1]=4 1600 B9R0.9 CCCC(CC)S(=O)(=O)F Amb32717725 [1,1,0,0,0,0|1,0,1]=4 1601 B9R0.9 CCCC(CC)S(N)(=O)=O Amb25244192 [1,1,0,0,0,0|1,0,1]=4 1602 B9R0.12 C#CC(=O)N(CC)CCC Amb28063760 [1,1,0,0,0,0|2,0,0]=4 1603 B9R0.12 C#CCC(CC)C(=O)OC Amb18633921 [1,1,0,0,0,0|0,0,2]=4 1604 B9R0.12 C=CC(=O)C(CC)OCC Amb27880247 [1,1,0,0,0,0|2,0,0]=4 1605 B9R0.12 C=CC(=O)C(CCC)OC Amb27167425 [1,1,0,0,0,0|2,0,0]=4 1606 B9R0.12 C=CCC(CC)C(=O)OC Amb28049824 [1,1,0,0,0,0|0,0,2]=4 1607 B9R0.12 CCC(CCN)C(=O)OC Amb18831468 [1,1,0,0,0,0|1,0,0]=3 1608 B9R0.12 CCC(CCO)C(=O)OC Amb17593656 [1,1,0,0,0,0|1,0,0]=3 1609 B9R0.12 CCCC(CC)C(=O)OC Amb26855569 [1,1,0,0,0,0|0,0,0]=2 1610 B9R0.12 CCCC(CC)C(C)CO Amb25169350 [1,1,0,0,0,0|1,0,1]=4 1611 B9R0.12 CCCC(CC)[C@@H](C)CO Amb33746889 [1,1,0,0,0,0|1,0,1]=4 1612 B9R0.12 CCCC(CC)[C@H](C)CO Amb33738441 [1,1,0,0,0,0|1,0,1]=4 1613 B9R0.12 CCCC(CN)C(=O)NO Amb27185504 [1,1,0,0,0,0|1,0,0]=3 1614 B9R0.12 CCCC(CN)C(=O)OC Amb26516612 [1,1,0,0,0,0|1,0,0]=3 1615 B9R0.12 CCCC(CN)C(O)C=O Amb25100106 [1,1,0,0,0,0|1,0,1]=4 1616 B9R0.12 CCCC(NC)C(=O)OC Amb24116637 [1,1,0,0,0,0|1,0,0]=3 1617 B9R0.12 CCCC(NC)C(=O)OC Amb33735073 [1,1,0,0,0,0|1,0,0]=3 1618 B9R0.12 CCCC(OC)C(=N)OC Amb27589638 [1,1,0,0,0,0|2,0,0]=4 1619 B9R0.12 CCCC(OC)\C(Cl)=N\O Amb27841358 [1,1,0,0,0,0|2,0,0]=4 1620 B9R0.12 CCCC(OC)\C(N)=N\O Amb27814513 [1,1,0,0,0,0|2,0,0]=4 1621 B9R0.12 CCCN(CC)C(=O)CBr Amb28293236 [1,1,0,0,0,0|2,0,0]=4 1622 B9R0.12 CCCN(CC)C(=O)CC Amb27985699 [1,1,0,0,0,0|2,0,0]=4 1623 B9R0.12 CCCN(CC)C(=O)NC Amb27949128 [1,1,0,0,0,0|2,0,0]=4 1624 B9R0.12 CCCN(CC)\C(N)=N\O Amb25337386 [1,1,0,0,0,0|2,0,0]=4 1625 B9R0.12 CCC[C@H](CC)[C@H](N)CO Amb27166364 [1,1,0,0,0,0|1,0,1]=4 1626 B9R0.12 CCC[C@H](CN)C(=O)OC Amb27655535 [1,1,0,0,0,0|1,0,0]=3 1627 B9R0.12 CCC[C@H](NC)C(=O)OC Amb25980086 [1,1,0,0,0,0|1,0,0]=3 1628 B9R0.12 CCN(CCCl)C(=O)OC Amb27810869 [1,1,0,0,0,0|2,0,0]=4 1629 B9R0.12 CCN(CCO)C(=O)CO Amb5798176 [1,1,0,0,0,0|2,0,0]=4 1630 B9R0.12 CCNC(CC)C(=O)OC Amb25324244 [1,1,0,0,0,0|1,0,0]=3 1631 B9R0.12 CCNC(CC)C(=O)OC Amb32753847 [1,1,0,0,0,0|1,0,0]=3 1632 B9R0.12 CCNC(CN)C(=O)OC Amb27830264 [1,1,0,0,0,0|2,0,0]=4 1633 B9R0.12 CCNC(CO)C(=O)OC Amb27407880 [1,1,0,0,0,0|2,0,0]=4 1634 B9R0.12 CCNN(CC)C(=O)CO Amb27756202 [1,1,0,0,0,0|2,0,0]=4 1635 B9R0.12 CCN[C@@H](CO)C(=O)OC Amb27468731 [1,1,0,0,0,0|2,0,0]=4 1636 B9R0.12 CCOC(CC)C(=O)NN Amb2098768 [1,1,0,0,0,0|2,0,0]=4 1637 B9R0.12 CCOC(CC)C(=O)NN Amb9172214 [1,1,0,0,0,0|2,0,0]=4 1638 B9R0.12 CCOC(CC)\C(N)=N\O Amb25887539 [1,1,0,0,0,0|2,0,0]=4 1639 B9R0.12 CCSC(CCl)C(=O)OC Amb27407080 [1,1,0,0,0,0|2,0,0]=4 1640 B9R0.12 CNC(COC)C(=O)OC Amb20630218 [1,1,0,0,0,0|2,0,0]=4 1641 B9R0.12 CNC(CSC)C(=O)OC Amb18788231 [1,1,0,0,0,0|2,0,0]=4 1642 B9R0.12 CNCC(NC)C(=O)OC Amb27858921 [1,1,0,0,0,0|2,0,0]=4 1643 B9R0.12 COC(=O)C(CCN)OC Amb27866819 [1,1,0,0,0,0|2,0,0]=4 1644 B9R0.12 COC(=O)C(CN)CCF Amb33196108 [1,1,0,0,0,0|2,0,0]=4 1645 B9R0.12 COC(=O)C(CN)CSC Amb33271729 [1,1,0,0,0,0|2,0,0]=4 1646 B9R0.12 COC(=O)C(CO)CCF Amb27481856 [1,1,0,0,0,0|2,0,0]=4 1647 B9R0.12 COC(=O)[C@H](CCN)OC Amb27253593 [1,1,0,0,0,0|2,0,0]=4 1648 B9R0.12 COCC(CN)C(=O)OC Amb33428674 [1,1,0,0,0,0|2,0,0]=4 1649 B9R0.12 [C-]#[N+]C(CCC)C(=O)OC Amb2688986 [1,1,0,0,0,0|1,0,1]=4 1650 B9R0.12 [C-]#[N+][C@@H](CCC)C(=O)OC Amb33747505 [1,1,0,0,0,0|1,0,1]=4 1651 B9R0.12 [C-]#[N+][C@H](CCC)C(=O)OC Amb33747252 [1,1,0,0,0,0|1,0,1]=4 1652 B9R0.13 C#CCOC(CC)C(=O)O Amb9675445 [1,1,0,0,0,0|0,0,2]=4 1653 B9R0.13 C#CCSC(CC)C(=O)O Amb17501369 [1,1,0,0,0,0|0,0,2]=4 1654 B9R0.13 C=C(C)C(CC)NCCC Amb27864838 [1,1,0,0,0,0|2,0,0]=4 1655 B9R0.13 C=CC(CCCC)C(=O)O Amb27759693 [1,1,0,0,0,0|0,0,2]=4 1656 B9R0.13 C=CC(CCCCl)C(=O)O Amb28072929 [1,1,0,0,0,0|0,0,2]=4 1657 B9R0.13 C=CC(NCCC)C(=O)O Amb28454234 [1,1,0,0,0,0|0,0,2]=4 1658 B9R0.13 C=CC(SCCC)C(=O)O Amb27207894 [1,1,0,0,0,0|0,0,2]=4 1659 B9R0.13 C=CCCC(CC)C(=O)O Amb28050061 [1,1,0,0,0,0|0,0,1]=3 1660 B9R0.13 C=CCCC(OC)C(=O)O Amb28388453 [1,1,0,0,0,0|1,0,1]=4 1661 B9R0.13 C=CCC[C@@H](CC)C(=O)O Amb27595843 [1,1,0,0,0,0|0,0,1]=3 1662 B9R0.13 C=CCSC(CC)C(=O)O Amb17501342 [1,1,0,0,0,0|0,0,2]=4 1663 B9R0.13 C=C[C@@H](CCCC)C(=O)O Amb28050245 [1,1,0,0,0,0|0,0,2]=4 1664 B9R0.13 C=C[C@H](CCCC)C(=O)O Amb27838910 [1,1,0,0,0,0|0,0,2]=4 1665 B9R0.13 CC(=O)C(CO)CCCCl Amb27249647 [1,1,0,0,0,0|2,0,0]=4 1666 B9R0.13 CCC(CCC=O)C(=O)O Amb27216961 [1,1,0,0,0,0|0,0,1]=3 1667 B9R0.13 CCC(CCCF)C(C)O Amb28049532 [1,1,0,0,0,0|1,0,1]=4 1668 B9R0.13 CCC(CCCO)C(C)O Amb27972744 [1,1,0,0,0,0|1,0,1]=4 1669 B9R0.13 CCC(CCOC)C(=O)O Amb25289946 [1,1,0,0,0,0|0,0,0]=2 1670 B9R0.13 CCC(CCOC)C(C)=O Amb27601590 [1,1,0,0,0,0|1,0,0]=3 1671 B9R0.13 CCC(CCSC)C(=O)O Amb24373794 [1,1,0,0,0,0|0,0,0]=2 1672 B9R0.13 CCC(CN=C=O)C(=O)O Amb33471373 [1,1,0,0,0,0|1,0,1]=4 1673 B9R0.13 CCC(CN=C=S)C(=O)O Amb33471592 [1,1,0,0,0,0|1,0,1]=4 1674 B9R0.13 CCC(C\C=N\O)C(=O)O Amb28429826 [1,1,0,0,0,0|1,0,1]=4 1675 B9R0.13 CCC(NCCF)C(=O)O Amb27427562 [1,1,0,0,0,0|1,0,0]=3 1676 B9R0.13 CCC(NCCN)C(=O)O Amb28061779 [1,1,0,0,0,0|1,0,0]=3 1677 B9R0.13 CCC(NCCO)C(=O)O Amb18115226 [1,1,0,0,0,0|1,0,0]=3 1678 B9R0.13 CCC(OCCN)C(=O)O Amb18111197 [1,1,0,0,0,0|1,0,0]=3 1679 B9R0.13 CCC(OCCN)C(N)=O Amb27783814 [1,1,0,0,0,0|2,0,0]=4 1680 B9R0.13 CCC(OCOC)C(=O)O Amb28072710 [1,1,0,0,0,0|1,0,0]=3 1681 B9R0.13 CCC(SCC#N)C(=O)O Amb17501346 [1,1,0,0,0,0|1,0,1]=4 1682 B9R0.13 CCC(SCCN)C(=O)O Amb18788222 [1,1,0,0,0,0|1,0,0]=3 1683 B9R0.13 CCC(SCCO)C(N)=O Amb18788232 [1,1,0,0,0,0|2,0,0]=4 1684 B9R0.13 CCCCC(C#N)C(=O)O Amb27202774 [1,1,0,0,0,0|1,0,1]=4 1685 B9R0.13 CCCCC(CBr)C(=O)O Amb27799965 [1,1,0,0,0,0|1,0,0]=3 1686 B9R0.13 CCCCC(CC)C(=N)N Amb27622913 [1,1,0,0,0,0|2,0,0]=4 1687 B9R0.13 CCCCC(CC)C(=O)Cl Amb3939067 [1,1,0,0,0,0|1,0,0]=3 1688 B9R0.13 CCCCC(CC)C(=O)O Amb3939821 [1,1,0,0,0,0|0,0,0]=2 1689 B9R0.13 CCCCC(CC)C(=O)[O-] Amb22043361 [1,1,0,0,0,0|0,0,1]=3 1690 B9R0.13 CCCCC(CC)C(=O)[O-] Amb22053863 [1,1,0,0,0,0|0,0,1]=3 1691 B9R0.13 CCCCC(CC)C(=O)[O-] Amb8387188 [1,1,0,0,0,0|0,0,1]=3 1692 B9R0.13 CCCCC(CC)C(=O)[O-] Amb8387190 [1,1,0,0,0,0|0,0,1]=3 1693 B9R0.13 CCCCC(CC)C(=O)[O-] Amb8515519 [1,1,0,0,0,0|0,0,1]=3 1694 B9R0.13 CCCCC(CC)C(=O)[O-] Amb8516528 [1,1,0,0,0,0|0,0,1]=3 1695 B9R0.13 CCCCC(CC)C(C)O Amb10807396 [1,1,0,0,0,0|1,0,1]=4 1696 B9R0.13 CCCCC(CC)C(N)=O Amb3886579 [1,1,0,0,0,0|1,0,0]=3 1697 B9R0.13 CCCCC(CC)C(O)O Amb28454128 [1,1,0,0,0,0|0,0,2]=4 1698 B9R0.13 CCCCC(CN)C(=O)O Amb26978768 [1,1,0,0,0,0|1,0,0]=3 1699 B9R0.13 CCCCC(CO)C(=O)O Amb27834958 [1,1,0,0,0,0|1,0,0]=3 1700 B9R0.13 CCCCC(NC)C(=O)O Amb24116642 [1,1,0,0,0,0|1,0,0]=3 1701 B9R0.13 CCCCC(NC)C(N)=O Amb24116641 [1,1,0,0,0,0|2,0,0]=4 1702 B9R0.13 CCCCC(NCl)C(=O)O Amb27863591 [1,1,0,0,0,0|2,0,0]=4 1703 B9R0.13 CCCCC(NN)C(=O)O Amb18644274 [1,1,0,0,0,0|2,0,0]=4 1704 B9R0.13 CCCCC(NO)C(=O)O Amb27619251 [1,1,0,0,0,0|2,0,0]=4 1705 B9R0.13 CCCCC(OC)C(=O)O Amb25889001 [1,1,0,0,0,0|1,0,0]=3 1706 B9R0.13 CCCCC(OC)C(C)=O Amb27465061 [1,1,0,0,0,0|2,0,0]=4 1707 B9R0.13 CCCCN(CC)C(=O)Cl Amb17563080 [1,1,0,0,0,0|2,0,0]=4 1708 B9R0.13 CCCCN(CC)C(N)=O Amb6246594 [1,1,0,0,0,0|2,0,0]=4 1709 B9R0.13 CCCC[C@@H](CC)C(=O)O Amb28398235 [1,1,0,0,0,0|0,0,0]=2 1710 B9R0.13 CCCC[C@@H](CC)C(C)=O Amb27973070 [1,1,0,0,0,0|1,0,0]=3 1711 B9R0.13 CCCC[C@@H](CC)[C@@H](C)O Amb27839212 [1,1,0,0,0,0|1,0,1]=4 1712 B9R0.13 CCCC[C@@H](CN)C(=O)O Amb27812140 [1,1,0,0,0,0|1,0,0]=3 1713 B9R0.13 CCCC[C@@H](NC)C(=O)O Amb22799980 [1,1,0,0,0,0|1,0,0]=3 1714 B9R0.13 CCCC[C@@H](NO)C(=O)O Amb27162541 [1,1,0,0,0,0|2,0,0]=4 1715 B9R0.13 CCCC[C@H](CC)C(=O)O Amb24671282 [1,1,0,0,0,0|0,0,0]=2 1716 B9R0.13 CCCC[C@H](CO)C(=O)O Amb16232529 [1,1,0,0,0,0|1,0,0]=3 1717 B9R0.13 CCCC[C@H](NC)C(=O)O Amb25887554 [1,1,0,0,0,0|1,0,0]=3 1718 B9R0.13 CCCC[C@H](NC)C(N)=O Amb27264530 [1,1,0,0,0,0|2,0,0]=4 1719 B9R0.13 CCCNC(CC)C(N)=O Amb27873895 [1,1,0,0,0,0|1,0,0]=3 1720 B9R0.13 CCCN[C@@H](CS)C(=O)O Amb27645159 [1,1,0,0,0,0|1,0,0]=3 1721 B9R0.13 CCCN[C@H](CO)C(=O)O Amb28125350 [1,1,0,0,0,0|1,0,0]=3 1722 B9R0.13 CCCOC(CC)C(=O)O Amb9675479 [1,1,0,0,0,0|0,0,0]=2 1723 B9R0.13 CCCSC(CC)C(=O)O Amb9675504 [1,1,0,0,0,0|0,0,0]=2 1724 B9R0.13 CCCSC(CN)C(=O)O Amb27233967 [1,1,0,0,0,0|1,0,0]=3 1725 B9R0.13 CCCSC(CO)C(=O)O Amb27629095 [1,1,0,0,0,0|1,0,0]=3 1726 B9R0.13 CCC\C=C(/CC)C(=O)O Amb25228438 [1,1,0,0,0,0|0,0,1]=3 1727 B9R0.13 CCC\C=C(/CC)C(C)=O Amb4017066 [1,1,0,0,0,0|1,0,1]=4 1728 B9R0.13 CCC\C=C(\CC)C(C)=O Amb25926099 [1,1,0,0,0,0|1,0,1]=4 1729 B9R0.13 CCN(CCCN)C(C)=O Amb8829408 [1,1,0,0,0,0|2,0,0]=4 1730 B9R0.13 CCOCC(SC)C(N)=O Amb28146021 [1,1,0,0,0,0|2,0,0]=4 1731 B9R0.13 CCOC[C@H](NC)C(=O)O Amb33347475 [1,1,0,0,0,0|1,0,0]=3 1732 B9R0.13 CCO\N=C(/CC)C(=O)O Amb28340916 [1,1,0,0,0,0|1,0,1]=4 1733 B9R0.13 CCSCC(CC)C(=O)O Amb24482439 [1,1,0,0,0,0|0,0,0]=2 1734 B9R0.13 CCSCC(CN)C(=O)O Amb33324076 [1,1,0,0,0,0|1,0,0]=3 1735 B9R0.13 CC[C@@H](OCOC)C(C)=O Amb27203395 [1,1,0,0,0,0|2,0,0]=4 1736 B9R0.13 CC\C=C\C(CC)C(=O)O Amb33080288 [1,1,0,0,0,0|0,0,1]=3 1737 B9R0.13 CC\C=C\C(CN)C(=O)O Amb33268709 [1,1,0,0,0,0|1,0,1]=4 1738 B9R0.13 CNC(CCCN)C(=O)O Amb18644280 [1,1,0,0,0,0|1,0,0]=3 1739 B9R0.13 CNC(CCSC)C(=O)O Amb18792506 [1,1,0,0,0,0|1,0,0]=3 1740 B9R0.13 CNC(CCSC)C(N)=O Amb18792442 [1,1,0,0,0,0|2,0,0]=4 1741 B9R0.13 CN[C@@H](CCOC)C(N)=O Amb27175032 [1,1,0,0,0,0|2,0,0]=4 1742 B9R0.13 CN[C@@H](CCSC)C(=O)O Amb26844419 [1,1,0,0,0,0|1,0,0]=3 1743 B9R0.13 CN[C@H](CCCN)C(=O)O Amb28060751 [1,1,0,0,0,0|1,0,0]=3 1744 B9R0.13 CN[C@H](CCSC)C(=O)O Amb27974159 [1,1,0,0,0,0|1,0,0]=3 1745 B9R0.13 COC(CCCF)C(=O)O Amb33196102 [1,1,0,0,0,0|1,0,0]=3 1746 B9R0.13 COC(CCSC)C(=O)O Amb28288804 [1,1,0,0,0,0|1,0,0]=3 1747 B9R0.13 COCCC(CN)C(=O)O Amb24697893 [1,1,0,0,0,0|1,0,0]=3 1748 B9R0.13 COCCC(OC)C(=O)O Amb33428673 [1,1,0,0,0,0|1,0,0]=3 1749 B9R0.13 CSCCC(CN)C(=O)O Amb24618199 [1,1,0,0,0,0|1,0,0]=3 1750 B9R0.13 CSCCC(NCl)C(=O)O Amb27635192 [1,1,0,0,0,0|2,0,0]=4 1751 B9R0.13 CSCCC(NF)C(=O)O Amb27233599 [1,1,0,0,0,0|2,0,0]=4 1752 B9R0.13 CSCC[C@@H](CN)C(=O)O Amb28458297 [1,1,0,0,0,0|1,0,0]=3 1753 B9R0.13 C\C=C\CC(CC)C(=O)O Amb18643880 [1,1,0,0,0,0|0,0,1]=3 1754 B9R0.13 C\C=C\CC(CC)C(C)=O Amb27465073 [1,1,0,0,0,0|1,0,1]=4 1755 B9R0.13 C\C=C\CC(OC)C(=O)O Amb18644117 [1,1,0,0,0,0|1,0,1]=4 1756 B9R0.13 C\C=C\C[C@H](OC)C(=O)O Amb27230104 [1,1,0,0,0,0|1,0,1]=4 1757 B9R0.13 NCC(NCCF)C(=O)O Amb27246937 [1,1,0,0,0,0|2,0,0]=4 1758 B9R0.13 NCC(SCCO)C(=O)O Amb27233935 [1,1,0,0,0,0|2,0,0]=4 1759 B9R0.13 NCCCC(CS)C(=O)O Amb28458435 [1,1,0,0,0,0|1,0,0]=3 1760 B9R0.13 NCCC[C@@H](NN)C(=O)O Amb27768758 [1,1,0,0,0,0|2,0,0]=4 1761 B9R0.13 NCCNC(CN)C(=O)O Amb28454232 [1,1,0,0,0,0|2,0,0]=4 1762 B9R0.13 NCCN[C@@H](CS)C(=O)O Amb27407766 [1,1,0,0,0,0|2,0,0]=4 1763 B9R0.13 O=C(O)C(CO)SCCO Amb28196797 [1,1,0,0,0,0|2,0,0]=4 1764 B9R0.13 O=C(O)C(CS)NCCO Amb27454918 [1,1,0,0,0,0|2,0,0]=4 1765 B9R0.13 O=C(O)[C@H](CS)NCCCl Amb27592190 [1,1,0,0,0,0|2,0,0]=4 1766 B9R0.13 O=C(O)[C@H](CS)NCCO Amb27617120 [1,1,0,0,0,0|2,0,0]=4 1767 B9R0.29 C#CC(C)C(CC)C(=O)O Amb28119988 [1,1,0,0,0,0|0,0,2]=4 1768 B9R0.29 C=C[C@@H](C)[C@H](CC)C(=O)O Amb28251365 [1,1,0,0,0,0|0,0,2]=4 1769 B9R0.29 CC(CN)C(CN)C(=O)O Amb27953003 [1,1,0,0,0,0|2,0,0]=4 1770 B9R0.29 CCC(=O)C(CC)C(C)=O Amb17593598 [1,1,0,0,0,0|1,0,1]=4 1771 B9R0.29 CCC(C(=O)O)C(=O)OC Amb25709569 [1,1,0,0,0,0|1,0,1]=4 1772 B9R0.29 CCC(C(=O)O)C(C)C#N Amb35719051 [1,1,0,0,0,0|1,0,1]=4 1773 B9R0.29 CCC(C(=O)O)C(C)CCl Amb27969167 [1,1,0,0,0,0|1,0,0]=3 1774 B9R0.29 CCC(C(=O)O)N(C)CC Amb9675598 [1,1,0,0,0,0|1,0,0]=3 1775 B9R0.29 CCC(C(=O)O)[C@@H](C)CC Amb28050112 [1,1,0,0,0,0|0,0,0]=2 1776 B9R0.29 CCC(C(N)=O)N(C)CC Amb27604824 [1,1,0,0,0,0|2,0,0]=4 1777 B9R0.29 CCC(C)C(C#N)C(=O)O Amb28072843 [1,1,0,0,0,0|1,0,1]=4 1778 B9R0.29 CCC(C)C(CC)C(C)=O Amb25775510 [1,1,0,0,0,0|1,0,0]=3 1779 B9R0.29 CCC(C)C(CC)C(N)=O Amb17621194 [1,1,0,0,0,0|1,0,0]=3 1780 B9R0.29 CCC(C)C(CN)C(=O)O Amb25978406 [1,1,0,0,0,0|1,0,0]=3 1781 B9R0.29 CCC(C)C(CN)C(N)=O Amb32418136 [1,1,0,0,0,0|2,0,0]=4 1782 B9R0.29 CCC(C)C(N=O)C(=O)O Amb28119173 [1,1,0,0,0,0|2,0,0]=4 1783 B9R0.29 CCC(C)C(NC)C(=O)O Amb33551329 [1,1,0,0,0,0|1,0,0]=3 1784 B9R0.29 CCC(C)C(NC)C(=O)O Amb4018745 [1,1,0,0,0,0|1,0,0]=3 1785 B9R0.29 CCC(C)C(NS)C(=O)O Amb27876164 [1,1,0,0,0,0|2,0,0]=4 1786 B9R0.29 CCC(C)C(OC)C(=O)O Amb24563898 [1,1,0,0,0,0|1,0,0]=3 1787 B9R0.29 CCC(C)C(ON)C(=O)O Amb27494007 [1,1,0,0,0,0|2,0,0]=4 1788 B9R0.29 CCC(C)N(CC)C(=O)Cl Amb24352847 [1,1,0,0,0,0|2,0,0]=4 1789 B9R0.29 CCC(C)[C@H](NC)C(=O)O Amb27390153 [1,1,0,0,0,0|1,0,0]=3 1790 B9R0.29 CCC(N)C(CC)C(=O)O Amb28041915 [1,1,0,0,0,0|0,0,0]=2 1791 B9R0.29 CCC(O)C(CC)C(=O)O Amb18310733 [1,1,0,0,0,0|0,0,0]=2 1792 B9R0.29 CCC(O)C(CC)[N+](=O)[O-] Amb4036538 [1,1,0,0,0,0|1,0,1]=4 1793 B9R0.29 CCC(O)C(OC)C(=O)O Amb18644355 [1,1,0,0,0,0|1,0,0]=3 1794 B9R0.29 CCN(N)[C@@H](CS)C(=O)O Amb27657394 [1,1,0,0,0,0|2,0,0]=4 1795 B9R0.29 CC[C@H](C(=O)O)[C@H](N)CC Amb27461449 [1,1,0,0,0,0|0,0,0]=2 1796 B9R0.29 CC[C@H](C)[C@@H](CC)C(N)=O Amb26024210 [1,1,0,0,0,0|1,0,0]=3 1797 B9R0.29 CC[C@H](C)[C@@H](OC)C(=O)O Amb28239702 [1,1,0,0,0,0|1,0,0]=3 1798 B9R0.29 CC[C@H](C)[C@H](CC)C(=O)O Amb28340911 [1,1,0,0,0,0|0,0,0]=2 1799 B9R0.29 CC[C@H](C)[C@H](NC)C(=O)O Amb16183967 [1,1,0,0,0,0|1,0,0]=3 1800 B9R0.29 CC[C@H](C)[C@H](NC)C(=O)O Amb22747123 [1,1,0,0,0,0|1,0,0]=3 1801 B9R0.29 CNC(C(=O)O)C(C)OC Amb24117895 [1,1,0,0,0,0|2,0,0]=4 1802 B9R0.29 CN[C@@H](C(=O)O)[C@@H](C)OC Amb33347469 [1,1,0,0,0,0|2,0,0]=4 1803 B9R0.29 C\C=C(/C)C(CC)C(=O)O Amb27440494 [1,1,0,0,0,0|0,0,2]=4 1804 B9R0.29 NCC(C(=O)O)C(O)CF Amb27955957 [1,1,0,0,0,0|2,0,0]=4 1805 B9R0.33 C#CCC(C(=O)O)C(C)O Amb27237558 [1,1,0,0,0,0|0,0,2]=4 1806 B9R0.33 C=C(C)C(NCC)C(=O)O Amb28050492 [1,1,0,0,0,0|1,0,1]=4 1807 B9R0.33 C=CCC(C(=O)O)C(C)C Amb18643926 [1,1,0,0,0,0|0,0,2]=4 1808 B9R0.33 CC(=O)C(CCF)C(C)C Amb27239507 [1,1,0,0,0,0|2,0,0]=4 1809 B9R0.33 CC(C)C(CC#N)C(=O)O Amb35711779 [1,1,0,0,0,0|1,0,1]=4 1810 B9R0.33 CC(C)C(CCF)C(=O)O Amb27837856 [1,1,0,0,0,0|1,0,0]=3 1811 B9R0.33 CC(C)C(CCN)C(=O)O Amb22371125 [1,1,0,0,0,0|1,0,0]=3 1812 B9R0.33 CC(C)C(CCN)C(=O)O Amb24426418 [1,1,0,0,0,0|1,0,0]=3 1813 B9R0.33 CC(O)C(CCO)C(N)=O Amb27467700 [1,1,0,0,0,0|2,0,0]=4 1814 B9R0.33 CCCC(C(=O)O)C(=O)O Amb8384909 [1,1,0,0,0,0|1,0,1]=4 1815 B9R0.33 CCCC(C(=O)O)C(C)C Amb17616275 [1,1,0,0,0,0|0,0,0]=2 1816 B9R0.33 CCCC(C(=O)O)C(C)N Amb33036414 [1,1,0,0,0,0|0,0,0]=2 1817 B9R0.33 CCCC(C(=O)O)C(C)O Amb26422276 [1,1,0,0,0,0|0,0,0]=2 1818 B9R0.33 CCCC(C(=O)O)N(C)C Amb33534626 [1,1,0,0,0,0|1,0,0]=3 1819 B9R0.33 CCCC(C(=O)O)S(C)=O Amb27255158 [1,1,0,0,0,0|1,0,0]=3 1820 B9R0.33 CCCC(C(C)=O)C(N)=O Amb24744722 [1,1,0,0,0,0|1,0,1]=4 1821 B9R0.33 CCCC(C(C)=O)N(C)C Amb27823561 [1,1,0,0,0,0|2,0,0]=4 1822 B9R0.33 CCCC(C(C)C)C(C)O Amb27602892 [1,1,0,0,0,0|1,0,1]=4 1823 B9R0.33 CCCC(C(C)O)C(C)O Amb28139893 [1,1,0,0,0,0|1,0,1]=4 1824 B9R0.33 CCCC(C(N)=O)C(C)C Amb27770607 [1,1,0,0,0,0|1,0,0]=3 1825 B9R0.33 CCCC(C(N)=O)N(C)C Amb24116638 [1,1,0,0,0,0|2,0,0]=4 1826 B9R0.33 CCCN(C(=O)Cl)C(C)C Amb27837816 [1,1,0,0,0,0|2,0,0]=4 1827 B9R0.33 CCCN(C(C)=O)C(C)C Amb27647782 [1,1,0,0,0,0|2,0,0]=4 1828 B9R0.33 CCC[C@H](C(=O)O)N(C)C Amb32660270 [1,1,0,0,0,0|1,0,0]=3 1829 B9R0.33 CCC[C@H](C(=O)O)[C@H](C)O Amb27221692 [1,1,0,0,0,0|0,0,0]=2 1830 B9R0.33 CCNC(C(=O)O)C(C)C Amb19514760 [1,1,0,0,0,0|1,0,0]=3 1831 B9R0.33 CCNC(C(=O)O)C(C)C Amb9327924 [1,1,0,0,0,0|1,0,0]=3 1832 B9R0.33 CCN[C@@H](C(=O)O)C(C)C Amb33347482 [1,1,0,0,0,0|1,0,0]=3 1833 B9R0.33 CCN[C@H](C(=O)O)C(C)C Amb25230589 [1,1,0,0,0,0|1,0,0]=3 1834 B9R0.33 CCN[C@H](C(=O)O)C(C)O Amb27629796 [1,1,0,0,0,0|1,0,0]=3 1835 B9R0.33 CCOC(C(=O)O)C(C)C Amb6267583 [1,1,0,0,0,0|1,0,0]=3 1836 B9R0.33 CCOC(C(N)=O)C(C)C Amb32659146 [1,1,0,0,0,0|2,0,0]=4 1837 B9R0.33 CCSC(C(=O)O)C(C)C Amb6680206 [1,1,0,0,0,0|1,0,0]=3 1838 B9R0.33 CCSC(C(N)=O)C(C)C Amb24739737 [1,1,0,0,0,0|2,0,0]=4 1839 B9R0.33 CN(C)C(CCO)C(=O)O Amb24116966 [1,1,0,0,0,0|2,0,0]=4 1840 B9R0.33 COCC(C(=O)O)C(C)C Amb26443509 [1,1,0,0,0,0|1,0,0]=3 1841 B9R0.33 COCC(C(=O)O)N(C)O Amb27976733 [1,1,0,0,0,0|2,0,0]=4 1842 B9R0.33 CS(=O)C(CCN)C(=O)O Amb27425024 [1,1,0,0,0,0|2,0,0]=4 1843 B9R0.33 CSCC(C(=O)O)C(C)C Amb27639484 [1,1,0,0,0,0|1,0,0]=3 1844 B9R0.33 CSC[C@@H](C(=O)O)N(C)C Amb27974193 [1,1,0,0,0,0|2,0,0]=4 1845 B9R0.33 C\C=C\C(C(=O)O)C(C)C Amb18643944 [1,1,0,0,0,0|0,0,2]=4 1846 B9R0.33 C\C=N\[C@H](C(=O)O)C(C)C Amb27831817 [1,1,0,0,0,0|1,0,1]=4 1847 B9R0.39 C=C(C)CC(CC)C(C)=O Amb28060802 [1,1,0,0,0,0|1,0,1]=4 1848 B9R0.39 C=C(C)CC(OC)C(=O)O Amb26386702 [1,1,0,0,0,0|1,0,1]=4 1849 B9R0.39 C=C(C)C[C@@H](CC)C(=O)O Amb27785162 [1,1,0,0,0,0|0,0,1]=3 1850 B9R0.39 CC(C)CC(C#N)C(=O)O Amb23558965 [1,1,0,0,0,0|1,0,1]=4 1851 B9R0.39 CC(C)CC(CN)C(=O)O Amb19021764 [1,1,0,0,0,0|1,0,0]=3 1852 B9R0.39 CC(C)CC(CN)C(=O)O Amb28555451 [1,1,0,0,0,0|1,0,0]=3 1853 B9R0.39 CC(C)CC(CO)C(=O)O Amb18124780 [1,1,0,0,0,0|1,0,0]=3 1854 B9R0.39 CC(C)CC(N=O)C(=O)O Amb27461396 [1,1,0,0,0,0|2,0,0]=4 1855 B9R0.39 CC(C)CC(NCl)C(=O)O Amb27401848 [1,1,0,0,0,0|2,0,0]=4 1856 B9R0.39 CC(C)CC(ON)C(=O)O Amb18644321 [1,1,0,0,0,0|2,0,0]=4 1857 B9R0.39 CC(C)CC(ON)C(=O)O Amb33484371 [1,1,0,0,0,0|2,0,0]=4 1858 B9R0.39 CC(C)C[C@@H](CN)C(=O)O Amb22756732 [1,1,0,0,0,0|1,0,0]=3 1859 B9R0.39 CC(C)C[C@@H](CN)C(=O)O Amb22756740 [1,1,0,0,0,0|1,0,0]=3 1860 B9R0.39 CC(C)C[C@@H](NN)C(=O)O Amb27424998 [1,1,0,0,0,0|2,0,0]=4 1861 B9R0.39 CC(C)C[C@@H](ON)C(=O)O Amb27975779 [1,1,0,0,0,0|2,0,0]=4 1862 B9R0.39 CC(C)C[C@H](CN)C(=O)O Amb26390781 [1,1,0,0,0,0|1,0,0]=3 1863 B9R0.39 CC(C)C[C@H](CN)C(=O)O Amb32620226 [1,1,0,0,0,0|1,0,0]=3 1864 B9R0.39 CC(C)C[C@H](NN)C(=O)O Amb27488207 [1,1,0,0,0,0|2,0,0]=4 1865 B9R0.39 CC(C)NC(CN)C(=O)O Amb28291039 [1,1,0,0,0,0|2,0,0]=4 1866 B9R0.39 CC(C)NC(CO)C(=O)O Amb26046487 [1,1,0,0,0,0|2,0,0]=4 1867 B9R0.39 CC(C)NC(CS)C(=O)O Amb27233014 [1,1,0,0,0,0|2,0,0]=4 1868 B9R0.39 CC(C)N[C@@H](CS)C(=O)O Amb25299344 [1,1,0,0,0,0|2,0,0]=4 1869 B9R0.39 CC(C)S[C@@H](CN)C(=O)O Amb27444140 [1,1,0,0,0,0|2,0,0]=4 1870 B9R0.39 CC(Cl)CC(CN)C(=O)O Amb28396430 [1,1,0,0,0,0|1,0,0]=3 1871 B9R0.39 CC(N)NC(CS)C(=O)O Amb27792112 [1,1,0,0,0,0|2,0,0]=4 1872 B9R0.39 CC(O)CC(C#N)C(=O)O Amb35741473 [1,1,0,0,0,0|1,0,1]=4 1873 B9R0.39 CCC(CC(=O)O)C(=O)O Amb10071696 [1,1,0,0,0,0|1,0,1]=4 1874 B9R0.39 CCC(CC(C)=O)C(=O)O Amb18644109 [1,1,0,0,0,0|0,0,1]=3 1875 B9R0.39 CCC(CC(C)=O)C(C)=O Amb27403023 [1,1,0,0,0,0|1,0,1]=4 1876 B9R0.39 CCC(CC(C)C)C(=O)O Amb19014184 [1,1,0,0,0,0|0,0,0]=2 1877 B9R0.39 CCC(CC(C)O)C(=O)O Amb27254121 [1,1,0,0,0,0|0,0,0]=2 1878 B9R0.39 CCC(CC(F)F)C(=O)O Amb25709926 [1,1,0,0,0,0|1,0,0]=3 1879 B9R0.39 CCC(NC(C)=O)C(=O)O Amb2099651 [1,1,0,0,0,0|1,0,1]=4 1880 B9R0.39 CCC(NC(C)C)C(=O)O Amb28555426 [1,1,0,0,0,0|1,0,0]=3 1881 B9R0.39 CCC(NC(C)C)C(=O)O Amb9620437 [1,1,0,0,0,0|1,0,0]=3 1882 B9R0.39 CCC(SC(C)C)C(=O)O Amb17501347 [1,1,0,0,0,0|1,0,0]=3 1883 B9R0.39 CCC(SC(C)C)C(N)=O Amb18788099 [1,1,0,0,0,0|2,0,0]=4 1884 B9R0.39 CCN(CC(C)C)C(C)=O Amb27458275 [1,1,0,0,0,0|2,0,0]=4 1885 B9R0.39 CCN(CC(C)C)C(N)=O Amb8901538 [1,1,0,0,0,0|2,0,0]=4 1886 B9R0.39 CCN(CC(C)O)C(C)=O Amb27219905 [1,1,0,0,0,0|2,0,0]=4 1887 B9R0.39 CCN(C[C@@H](C)O)C(C)=O Amb28063653 [1,1,0,0,0,0|2,0,0]=4 1888 B9R0.39 CCN(C[C@H](C)O)C(C)=O Amb28281456 [1,1,0,0,0,0|2,0,0]=4 1889 B9R0.39 CC[C@@H](CC(=O)O)C(=O)O Amb27830576 [1,1,0,0,0,0|1,0,1]=4 1890 B9R0.39 CC[C@@H](CC(C)C)C(=O)O Amb28397993 [1,1,0,0,0,0|0,0,0]=2 1891 B9R0.39 CC[C@@H](NC(C)=O)C(=O)O Amb3941467 [1,1,0,0,0,0|1,0,1]=4 1892 B9R0.39 CC[C@H](CC(=O)O)C(=O)O Amb24643194 [1,1,0,0,0,0|1,0,1]=4 1893 B9R0.39 CC[C@H](NC(C)=O)C(=O)O Amb3990111 [1,1,0,0,0,0|1,0,1]=4 1894 B9R0.39 CC[C@H](OC(C)=O)C(=O)O Amb27948340 [1,1,0,0,0,0|1,0,1]=4 1895 B9R0.39 CC\C(=C/C(C)C)C(=O)O Amb18643946 [1,1,0,0,0,0|0,0,2]=4 1896 B9R0.39 CNC(CC(C)C)C(=O)O Amb22274694 [1,1,0,0,0,0|1,0,0]=3 1897 B9R0.39 CNC(CC(C)C)C(=O)O Amb9283589 [1,1,0,0,0,0|1,0,0]=3 1898 B9R0.39 CNC(CC(C)C)C(N)=O Amb19006600 [1,1,0,0,0,0|2,0,0]=4 1899 B9R0.39 CNC(CC(C)C)C(N)=O Amb32753443 [1,1,0,0,0,0|2,0,0]=4 1900 B9R0.39 CNC(CN(C)C)C(=O)O Amb28388875 [1,1,0,0,0,0|2,0,0]=4 1901 B9R0.39 CN[C@@H](CC(C)C)C(=O)O Amb16183858 [1,1,0,0,0,0|1,0,0]=3 1902 B9R0.39 CN[C@@H](CC(C)C)C(=O)O Amb2779901 [1,1,0,0,0,0|1,0,0]=3 1903 B9R0.39 CN[C@@H](CC(C)C)C(N)=O Amb24550819 [1,1,0,0,0,0|2,0,0]=4 1904 B9R0.39 CN[C@@H](CC(C)C)C(N)=O Amb32679561 [1,1,0,0,0,0|2,0,0]=4 1905 B9R0.39 CN[C@H](CC(C)C)C(=O)O Amb10842218 [1,1,0,0,0,0|1,0,0]=3 1906 B9R0.39 CN[C@H](CC(C)C)C(=O)O Amb22745995 [1,1,0,0,0,0|1,0,0]=3 1907 B9R0.39 COC(CC(C)C)C(=O)O Amb26656466 [1,1,0,0,0,0|1,0,0]=3 1908 B9R0.39 COC(CC(C)C)C(N)=O Amb27769639 [1,1,0,0,0,0|2,0,0]=4 1909 B9R0.39 COC(CC(F)F)C(=O)O Amb32811478 [1,1,0,0,0,0|2,0,0]=4 1910 B9R0.39 COC(CN(C)C)C(=O)O Amb27196900 [1,1,0,0,0,0|2,0,0]=4 1911 B9R0.39 CO[C@@H](CC(C)C)C(=O)O Amb28126876 [1,1,0,0,0,0|1,0,0]=3 1912 B9R0.39 CSC(CC(C)C)C(=O)O Amb27658945 [1,1,0,0,0,0|1,0,0]=3 1913 B9R0.74 C#CCC(C)(CC)C(=O)O Amb28073834 [1,1,0,0,0,0|0,0,2]=4 1914 B9R0.74 C=CCC(O)(CC)C(=O)O Amb27433187 [1,1,0,0,0,0|0,0,2]=4 1915 B9R0.74 C=CC[C@@](C)(CC)C(=O)O Amb27494023 [1,1,0,0,0,0|0,0,2]=4 1916 B9R0.74 C=CC[C@](N)(CC)C(=O)O Amb28364724 [1,1,0,0,0,0|0,0,2]=4 1917 B9R0.74 CC(CN)(CCO)C(=O)O Amb28136078 [1,1,0,0,0,0|2,0,0]=4 1918 B9R0.74 CCC(C)(CC#N)C(=O)O Amb35711780 [1,1,0,0,0,0|1,0,1]=4 1919 B9R0.74 CCC(C)(CCN)C(=O)O Amb24562793 [1,1,0,0,0,0|1,0,0]=3 1920 B9R0.74 CCC(C)(CCO)C(=O)O Amb25698302 [1,1,0,0,0,0|1,0,0]=3 1921 B9R0.74 CCC(N)(COC)C(=O)O Amb27644263 [1,1,0,0,0,0|1,0,0]=3 1922 B9R0.74 CCC(N)(COC)C(=O)O Amb28555556 [1,1,0,0,0,0|1,0,0]=3 1923 B9R0.74 CCC(N)(COC)C(C)=O Amb27636316 [1,1,0,0,0,0|2,0,0]=4 1924 B9R0.74 CCC(N)(COC)C(N)=O Amb27837564 [1,1,0,0,0,0|2,0,0]=4 1925 B9R0.74 CCCC(Br)(CC)C(=O)O Amb27614914 [1,1,0,0,0,0|0,0,0]=2 1926 B9R0.74 CCCC(C)(CC)C(=O)O Amb18311361 [1,1,0,0,0,0|0,0,0]=2 1927 B9R0.74 CCCC(N)(CO)C(=O)O Amb27668101 [1,1,0,0,0,0|1,0,0]=3 1928 B9R0.74 CCCC(O)(CC)C(N)=O Amb27473850 [1,1,0,0,0,0|1,0,0]=3 1929 B9R0.74 CCC[C@@](C)(CC)C(=O)O Amb28119970 [1,1,0,0,0,0|0,0,0]=2 1930 B9R0.74 CCC[C@@](C)(OC)C(=O)O Amb27770608 [1,1,0,0,0,0|1,0,0]=3 1931 B9R0.74 CCC[C@@](N)(CN)C(=O)O Amb27253064 [1,1,0,0,0,0|1,0,0]=3 1932 B9R0.74 CCC[C@](C)(CC)C(=O)O Amb28398097 [1,1,0,0,0,0|0,0,0]=2 1933 B9R0.74 CCC[C@](O)(CC)C(=O)O Amb27977076 [1,1,0,0,0,0|0,0,0]=2 1934 B9R0.74 CCNC(C)(CC)C(N)=O Amb18304446 [1,1,0,0,0,0|2,0,0]=4 1935 B9R0.74 CCNC(C)(CO)C(=O)O Amb28067321 [1,1,0,0,0,0|2,0,0]=4 1936 B9R0.74 CCSC(C)(CS)C(=O)O Amb28119791 [1,1,0,0,0,0|2,0,0]=4 1937 B9R0.74 CC[C@@](N)(CNC)C(=O)O Amb27468012 [1,1,0,0,0,0|1,0,0]=3 1938 B9R0.74 CNC(C)(COC)C(=O)O Amb19025782 [1,1,0,0,0,0|2,0,0]=4 1939 B9R0.74 CNC(C)(COC)C(=O)O Amb28555445 [1,1,0,0,0,0|2,0,0]=4 1940 B9R0.74 COCC(C)(CN)C(=O)O Amb27488982 [1,1,0,0,0,0|2,0,0]=4 1941 B9R0.74 COCC(C)(OC)C(=O)O Amb19024322 [1,1,0,0,0,0|2,0,0]=4 1942 B9R0.74 COCC(O)(CO)C(=O)O Amb27465024 [1,1,0,0,0,0|2,0,0]=4 1943 B9R0.74 C\C=C\[C@](N)(CC)C(=O)O Amb27799654 [1,1,0,0,0,0|0,0,2]=4 1944 B9R0.74 NC(CO)(CCF)C(=O)O Amb32670159 [1,1,0,0,0,0|2,0,0]=4 1945 B9R0.74 NCC(O)(CCO)C(=O)O Amb27975659 [1,1,0,0,0,0|2,0,0]=4 1946 B9R0.14 C=CCC(C=O)CC(C)C Amb28049874 [1,1,0,0,0,0|0,0,2]=4 1947 B9R0.14 CC(O)CN(C=O)CCO Amb28067858 [1,1,0,0,0,0|2,0,0]=4 1948 B9R0.14 CCCC(C#N)CC(C)C Amb27414657 [1,1,0,0,0,0|1,0,1]=4 1949 B9R0.14 CCCC(C=O)CN(C)C Amb18644037 [1,1,0,0,0,0|1,0,0]=3 1950 B9R0.14 CCCC(C=O)OC(C)=O Amb18644107 [1,1,0,0,0,0|1,0,1]=4 1951 B9R0.14 CCCC(CBr)CC(C)C Amb25712263 [1,1,0,0,0,0|1,0,1]=4 1952 B9R0.14 CCCC(CC(C)C)NC Amb28069955 [1,1,0,0,0,0|2,0,0]=4 1953 B9R0.14 CCCC(CC)CC(C)N Amb27810747 [1,1,0,0,0,0|1,0,1]=4 1954 B9R0.14 CCCC(CCl)CC(C)C Amb25039933 [1,1,0,0,0,0|1,0,1]=4 1955 B9R0.14 CCCC(CO)NC(C)C Amb27460753 [1,1,0,0,0,0|1,0,1]=4 1956 B9R0.14 CCCN(C=O)CC(C)C Amb27243245 [1,1,0,0,0,0|1,0,0]=3 1957 B9R0.14 CCNC(CO)CC(C)C Amb27263036 [1,1,0,0,0,0|1,0,1]=4 1958 B9R0.14 CC\C=C(\C=O)CC(C)C Amb24117969 [1,1,0,0,0,0|0,0,2]=4 1959 B9R0.14 COCC(CO)CC(C)C Amb25088645 [1,1,0,0,0,0|1,0,1]=4 1960 B9R0.17 C#CCC(CCC)CCC Amb32730980 [1,1,0,0,0,0|1,0,1]=4 1961 B9R0.17 CCCC(=CCBr)CCC Amb27592253 [1,1,0,0,0,0|1,0,1]=4 1962 B9R0.17 CCCC(CC#N)CCC Amb32731135 [1,1,0,0,0,0|1,0,1]=4 1963 B9R0.17 CCCC(CC=O)CCC Amb26398952 [1,1,0,0,0,0|0,0,0]=2 1964 B9R0.17 CCCC(CC=O)SCC Amb28143620 [1,1,0,0,0,0|1,0,0]=3 1965 B9R0.17 CCCC(CCC)=NOC Amb28190429 [1,1,0,0,0,0|1,0,1]=4 1966 B9R0.17 CCCC(CCC)CCC Amb22229877 [1,1,0,0,0,0|1,0,1]=4 1967 B9R0.17 CCCC(CCC)CCN Amb839084 [1,1,0,0,0,0|1,0,1]=4 1968 B9R0.17 CCCC(CCC)CCO Amb26022800 [1,1,0,0,0,0|0,0,1]=3 1969 B9R0.17 CCCC(CCC)CCS Amb33273116 [1,1,0,0,0,0|0,1,1]=4 1970 B9R0.17 CCCC(CCC)CNC Amb26503095 [1,1,0,0,0,0|1,0,1]=4 1971 B9R0.17 CCCC(CCC)CNN Amb24757385 [1,1,0,0,0,0|1,0,1]=4 1972 B9R0.17 CCCC(CCC)CNO Amb32731173 [1,1,0,0,0,0|0,0,1]=3 1973 B9R0.17 CCCC(CCC)CON Amb32730927 [1,1,0,0,0,0|0,0,1]=3 1974 B9R0.17 CCCC(CCC)N=C=O Amb27770437 [1,1,0,0,0,0|0,0,1]=3 1975 B9R0.17 CCCC(CCC)OCCl Amb27628325 [1,1,0,0,0,0|1,0,1]=4 1976 B9R0.17 CCCC(CCO)NCC Amb28182457 [1,1,0,0,0,0|1,0,1]=4 1977 B9R0.17 CCCC(CCO)OCC Amb27839269 [1,1,0,0,0,0|1,0,1]=4 1978 B9R0.17 CCCC(COC)NCC Amb27797959 [1,1,0,0,0,0|1,0,1]=4 1979 B9R0.17 CCCN(CCC)CCO Amb8395266 [1,1,0,0,0,0|1,0,1]=4 1980 B9R0.17 CCSC(CC=O)SCC Amb27636944 [1,1,0,0,0,0|2,0,0]=4 1981 B9R0.17 CC\C=C(/CC=O)CCC Amb27620355 [1,1,0,0,0,0|0,0,2]=4 1982 B9R0.17 CC\C=C(\CCC)NC=O Amb27174643 [1,1,0,0,0,0|0,0,2]=4 1983 B9R0.17 COCC(CC=O)COC Amb28322194 [1,1,0,0,0,0|2,0,0]=4 1984 B9R0.17 [C-]#[N+]CC(CCC)CCC Amb32731025 [1,1,0,0,0,0|1,0,1]=4 1985 B9R0.40 C#CC(CCC)NCCC Amb27770399 [1,1,0,0,0,0|1,0,1]=4 1986 B9R0.40 C=CC(CCC)OCOC Amb28050417 [1,1,0,0,0,0|2,0,0]=4 1987 B9R0.40 C=CC(CCCC)CNC Amb27770600 [1,1,0,0,0,0|2,0,0]=4 1988 B9R0.40 C=CC(CCCO)COC Amb27424919 [1,1,0,0,0,0|2,0,0]=4 1989 B9R0.40 C=CC(COCC)NCC Amb27639938 [1,1,0,0,0,0|2,0,0]=4 1990 B9R0.40 C=CC(CSCC)NCC Amb27645789 [1,1,0,0,0,0|2,0,0]=4 1991 B9R0.40 C=CCC(C=O)CCCCl Amb27592487 [1,1,0,0,0,0|0,0,2]=4 1992 B9R0.40 C=CCC(C=O)CCOC Amb27851965 [1,1,0,0,0,0|0,0,2]=4 1993 B9R0.40 C=CCOC(C=O)CCC Amb27409278 [1,1,0,0,0,0|0,0,2]=4 1994 B9R0.40 C=CC[C@H](C=O)CCCC Amb27401115 [1,1,0,0,0,0|0,0,2]=4 1995 B9R0.40 CCC#CC(CO)CCC Amb27394890 [1,1,0,0,0,0|0,0,2]=4 1996 B9R0.40 CCCC(C=O)CCC#N Amb28049915 [1,1,0,0,0,0|0,0,1]=3 1997 B9R0.40 CCCC(CBr)CCOC Amb25796735 [1,1,0,0,0,0|1,0,1]=4 1998 B9R0.40 CCCC(CBr)CCSC Amb25216790 [1,1,0,0,0,0|1,0,1]=4 1999 B9R0.40 CCCC(CBr)COCC Amb26343288 [1,1,0,0,0,0|1,0,1]=4 2000 B9R0.40 CCCC(CCCCl)NN Amb28208512 [1,1,0,0,0,0|2,0,0]=4 2001 B9R0.40 CCCC(CCNC)OC Amb27253172 [1,1,0,0,0,0|2,0,0]=4 2002 B9R0.40 CCCC(CCOC)NN Amb27601346 [1,1,0,0,0,0|2,0,0]=4 2003 B9R0.40 CCCC(CCSC)NN Amb28289041 [1,1,0,0,0,0|2,0,0]=4 2004 B9R0.40 CCCC(CCl)CCOC Amb26369527 [1,1,0,0,0,0|1,0,1]=4 2005 B9R0.40 CCCC(CCl)CCSC Amb24509339 [1,1,0,0,0,0|1,0,1]=4 2006 B9R0.40 CCCC(CCl)COCC Amb27617007 [1,1,0,0,0,0|1,0,1]=4 2007 B9R0.40 CCCC(CO)CCCO Amb27424905 [1,1,0,0,0,0|0,0,1]=3 2008 B9R0.40 CCCC(CS)CSCC Amb27837882 [1,1,0,0,0,0|0,1,1]=4 2009 B9R0.40 CCCC(CSCC)NN Amb28348039 [1,1,0,0,0,0|2,0,0]=4 2010 B9R0.40 CCCCC(C=O)CCC Amb27237029 [1,1,0,0,0,0|0,0,0]=2 2011 B9R0.40 CCCCC(C=O)OCC Amb27261094 [1,1,0,0,0,0|1,0,0]=3 2012 B9R0.40 CCCCC(CBr)CCC Amb26369676 [1,1,0,0,0,0|1,0,1]=4 2013 B9R0.40 CCCCC(CC)CCC Amb25335776 [1,1,0,0,0,0|1,0,1]=4 2014 B9R0.40 CCCCC(CCC)ON Amb28292987 [1,1,0,0,0,0|2,0,0]=4 2015 B9R0.40 CCCCC(CCl)CCC Amb25206828 [1,1,0,0,0,0|1,0,1]=4 2016 B9R0.40 CCCCC(CN)CCC Amb20632050 [1,1,0,0,0,0|1,0,1]=4 2017 B9R0.40 CCCCC(CO)CCC Amb26011965 [1,1,0,0,0,0|0,0,1]=3 2018 B9R0.40 CCCCC(CO)CCO Amb27810571 [1,1,0,0,0,0|1,0,1]=4 2019 B9R0.40 CCCCC(CO)OCC Amb27216686 [1,1,0,0,0,0|1,0,1]=4 2020 B9R0.40 CCCCN(C=O)CCO Amb26609531 [1,1,0,0,0,0|2,0,0]=4 2021 B9R0.40 CCCCN(CCC)N=O Amb26462487 [1,1,0,0,0,0|2,0,0]=4 2022 B9R0.40 CCCC[C@@H](CO)CCO Amb27665485 [1,1,0,0,0,0|1,0,1]=4 2023 B9R0.40 CCCNC(C#N)CCC Amb9205143 [1,1,0,0,0,0|1,0,1]=4 2024 B9R0.40 CCCNC(CC)CCC Amb28064267 [1,1,0,0,0,0|1,0,1]=4 2025 B9R0.40 CCCN[C@H](CO)CCC Amb27195642 [1,1,0,0,0,0|0,0,1]=3 2026 B9R0.40 CCCN\C(CCC)=N\O Amb27428034 [1,1,0,0,0,0|1,0,1]=4 2027 B9R0.40 CCCOC(C=O)CC=O Amb27268515 [1,1,0,0,0,0|1,0,1]=4 2028 B9R0.40 CCC\C(C=O)=C/OCC Amb18643884 [1,1,0,0,0,0|0,0,2]=4 2029 B9R0.40 CCNC(CO)CCCO Amb27838837 [1,1,0,0,0,0|1,0,1]=4 2030 B9R0.40 CCNC(CO)CCOC Amb27839139 [1,1,0,0,0,0|1,0,1]=4 2031 B9R0.40 CCNC(CO)CSCC Amb27770375 [1,1,0,0,0,0|1,0,1]=4 2032 B9R0.40 CCOC(C=O)CCCO Amb28050007 [1,1,0,0,0,0|1,0,0]=3 2033 B9R0.40 CCOC(C=O)CCSC Amb27955424 [1,1,0,0,0,0|1,0,0]=3 2034 B9R0.40 CCSCC(CO)SCC Amb17594636 [1,1,0,0,0,0|1,0,1]=4 2035 B9R0.40 CC\C=C(/C=O)CCCC Amb27966532 [1,1,0,0,0,0|0,0,2]=4 2036 B9R0.40 CC\C=C(\C=O)CCCO Amb28399203 [1,1,0,0,0,0|0,0,2]=4 2037 B9R0.40 CC\C=C\C(CO)CCC Amb27775503 [1,1,0,0,0,0|0,0,2]=4 2038 B9R0.40 COCC(C=O)OCCO Amb27760652 [1,1,0,0,0,0|2,0,0]=4 2039 B9R0.40 COCCN(C=O)CCO Amb27607421 [1,1,0,0,0,0|2,0,0]=4 2040 B9R0.40 OCCC[C@@H](CO)CCO Amb28460677 [1,1,0,0,0,0|1,0,1]=4 2041 B9R0.59 C#CC(Cl)(CCC)CCC Amb28050416 [1,1,0,0,0,0|1,0,1]=4 2042 B9R0.59 C#CC(O)(CCC)CCC Amb27455745 [1,1,0,0,0,0|1,0,1]=4 2043 B9R0.59 C=CC(O)(CCC)CCC Amb28050538 [1,1,0,0,0,0|1,0,0]=3 2044 B9R0.59 C=CP(=O)(CCC)CCC Amb26016948 [1,1,0,0,0,0|2,0,0]=4 2045 B9R0.59 CCCC(Br)(C#N)CCC Amb27404164 [1,1,0,0,0,0|1,0,1]=4 2046 B9R0.59 CCCC(C)(C=O)CCC Amb18643969 [1,1,0,0,0,0|0,0,0]=2 2047 B9R0.59 CCCC(C)(CBr)CCC Amb25821529 [1,1,0,0,0,0|1,0,1]=4 2048 B9R0.59 CCCC(C)(CCl)CCC Amb24399133 [1,1,0,0,0,0|1,0,1]=4 2049 B9R0.59 CCCC(C)(CO)NCC Amb27632941 [1,1,0,0,0,0|1,0,1]=4 2050 B9R0.59 CCCC(Cl)(C#N)CCC Amb18177678 [1,1,0,0,0,0|1,0,1]=4 2051 B9R0.59 CCCC(N)(C#N)CCC Amb6246120 [1,1,0,0,0,0|1,0,1]=4 2052 B9R0.59 CCCC(N)(CO)CCC Amb28049283 [1,1,0,0,0,0|0,0,1]=3 2053 B9R0.59 CCCC(O)(CN)CCC Amb9295078 [1,1,0,0,0,0|1,0,1]=4 2054 B9R0.59 CCCC(O)(CO)CCC Amb28430637 [1,1,0,0,0,0|0,0,1]=3 2055 B9R0.59 CCCP(=O)(CO)CCC Amb28370061 [1,1,0,0,0,0|1,0,1]=4 2056 B9R0.59 CCOC(C)(C=O)COC Amb28043275 [1,1,0,0,0,0|2,0,0]=4 2057 B11R0.35 CCCC(CC(=O)O)CC(=O)O Amb2720782 [0,1,0,0,0,1|1,0,1]=4 2058 B11R0.35 CCCC(CC(=O)O)NC(C)=O Amb33042695 [0,1,0,0,0,1|1,0,1]=4 2059 B11R0.47 CCOCC(CCN)CC(=O)O Amb32654961 [0,1,0,0,0,1|1,0,0]=3 2060 B11R0.95 CCCC(CCC)CC(C)(C)O Amb32731041 [0,1,0,0,0,1|1,0,1]=4 2061 B11R0.95 CCCC(CCC)OS(C)(=O)=O Amb27657029 [0,1,0,0,0,1|1,0,1]=4 2062 B11R0.98 C=C(C(=O)O)C(CCC)CCC Amb33273446 [0,1,0,0,0,1|0,0,0]=2 2063 B11R0.98 C=C(C(=O)O)C(OCC)OCC Amb33343251 [0,1,0,0,0,1|2,0,0]=4 2064 B11R0.98 CCCC(CCC)C(=O)C(=O)O Amb33450188 [0,1,0,0,0,1|0,0,0]=2 2065 B11R0.98 CCCC(CCC)C(C)C(=O)O Amb33449211 [0,1,0,0,0,1|0,0,0]=2 2066 B11R0.98 CCCC(CCC)C(N)C(=O)O Amb33474282 [0,1,0,0,0,1|0,0,0]=2 2067 B11R0.98 CCCC(CCC)C(O)C(=O)O Amb33226408 [0,1,0,0,0,1|0,0,0]=2 2068 B11R0.98 CCCN(CCC)C(C)C(=O)O Amb5761343 [0,1,0,0,0,1|1,0,0]=3 2069 B11R0.98 CCOC(OCC)C(C)C(=O)O Amb24117038 [0,1,0,0,0,1|2,0,0]=4 2070 B11R0.98 CCOC(OCC)C(O)C(=O)O Amb33341405 [0,1,0,0,0,1|2,0,0]=4 2071 B11R0.98 COCC(COC)C(N)C(=O)O Amb33065532 [0,1,0,0,0,1|2,0,0]=4 2072 B11R0.98 COCC(COC)[C@@H](N)C(=O)O Amb33036465 [0,1,0,0,0,1|2,0,0]=4 2073 B11R0.98 COCC(COC)[C@H](N)C(=O)O Amb33065378 [0,1,0,0,0,1|2,0,0]=4 2074 B11R0.279 CCCC(=CC(=O)OC)CCC Amb33472102 [0,1,0,0,0,1|0,0,1]=3 2075 B11R0.279 CCCC(CCC)CC(N)CO Amb32731019 [0,1,0,0,0,1|1,0,1]=4 2076 B11R0.279 CCCC(CCC)CC(O)CN Amb33273411 [0,1,0,0,0,1|1,0,1]=4 2077 B11R0.279 CCCN(CCC)CC(=O)NN Amb17604761 [0,1,0,0,0,1|2,0,0]=4 2078 B11R0.279 CCCN(CCC)CC(=O)OC Amb7760840 [0,1,0,0,0,1|1,0,0]=3 2079 B11R0.279 CCOC(CC(=O)OC)OCC Amb32644819 [0,1,0,0,0,1|2,0,0]=4 2080 B11R0.352 CCCC(N)(CCC)CC(=O)O Amb33254195 [0,1,0,0,0,1|0,0,0]=2 2081 B11R0.352 CCCC(N)(CCC)CC(N)=O Amb33254216 [0,1,0,0,0,1|1,0,0]=3 2082 B11R0.352 CCCC(O)(CCC)CC(=O)O Amb18803981 [0,1,0,0,0,1|0,0,0]=2 2083 B11R0.352 COCC(N)(COC)CC(=O)O Amb33254057 [0,1,0,0,0,1|2,0,0]=4 2084 B11R0.16 CCCC(NS(C)(=O)=O)C(=O)O Amb9495872 [0,2,0,0,0,0|2,0,0]=4 2085 B11R0.16 COC[C@H](CC(F)(F)F)C(=O)O Amb35753054 [0,2,0,0,0,0|2,0,0]=4 2086 B11R0.32 CC(=O)C(CC(C)C)CN(C)C Amb22235887 [0,2,0,0,0,0|2,0,0]=4 2087 B11R0.32 CC(=O)NC(CC(C)C)C(=O)O Amb2543580 [0,2,0,0,0,0|1,0,1]=4 2088 B11R0.32 CC(=O)NC(CC(C)O)C(=O)O Amb33308548 [0,2,0,0,0,0|1,0,1]=4 2089 B11R0.32 CC(=O)N[C@@H](CC(C)C)C(=O)O Amb2722946 [0,2,0,0,0,0|1,0,1]=4 2090 B11R0.32 CC(=O)N[C@H](CC(C)C)C(=O)O Amb2732384 [0,2,0,0,0,0|1,0,1]=4 2091 B11R0.32 CC(C)CC(CC(=O)O)C(=O)O Amb33072394 [0,2,0,0,0,0|1,0,1]=4 2092 B11R0.32 CC(C)CC(CC(C)C)C(=O)O Amb18794408 [0,2,0,0,0,0|0,0,0]=2 2093 B11R0.32 CC(C)CC(NC(C)C)C(=O)O Amb33446957 [0,2,0,0,0,0|1,0,0]=3 2094 B11R0.32 CC(C)CC(NC(C)C)C(=O)O Amb9620425 [0,2,0,0,0,0|1,0,0]=3 2095 B11R0.32 CC(C)CN(CC(C)C)C(=O)Cl Amb17563066 [0,2,0,0,0,0|2,0,0]=4 2096 B11R0.44 CCCC(C(=O)O)C(O)C(=O)O Amb33041388 [0,2,0,0,0,0|1,0,1]=4 2097 B11R0.115 CCC(C)C(CC(=O)O)C(=O)O Amb33449650 [0,2,0,0,0,0|1,0,1]=4 2098 B11R0.115 CCC(C)C(NC(C)=O)C(=O)O Amb9706300 [0,2,0,0,0,0|1,0,1]=4 2099 B11R0.115 CCC(C)[C@H](NC(C)=O)C(=O)O Amb33523725 [0,2,0,0,0,0|1,0,1]=4 2100 B11R0.115 CC[C@H](C)[C@@H](NC(C)=O)C(=O)O Amb22230215 [0,2,0,0,0,0|1,0,1]=4 2101 B11R0.115 CC[C@H](C)[C@H](NC(C)=O)C(=O)O Amb3939886 [0,2,0,0,0,0|1,0,1]=4 2102 B11R0.115 COC(=O)C(CC(C)C)C(=O)O Amb33746105 [0,2,0,0,0,0|1,0,1]=4 2103 B11R0.160 C=CCCC(CC(C)C)C(=O)O Amb33483522 [0,2,0,0,0,0|0,0,1]=3 2104 B11R0.160 CC(=O)NC(CCCF)C(=O)O Amb33308610 [0,2,0,0,0,0|1,0,1]=4 2105 B11R0.160 CC(=O)NC(CCCO)C(=O)O Amb33036789 [0,2,0,0,0,0|1,0,1]=4 2106 B11R0.160 CC(C)CC(CN=C=O)C(=O)O Amb33471477 [0,2,0,0,0,0|1,0,1]=4 2107 B11R0.160 CC(C)CC(CN=C=S)C(=O)O Amb33471715 [0,2,0,0,0,0|1,0,1]=4 2108 B11R0.160 CCCCC(CC(=O)O)C(=O)O Amb17933248 [0,2,0,0,0,0|1,0,1]=4 2109 B11R0.160 CCCCC(NC(C)=O)C(=O)O Amb2732387 [0,2,0,0,0,0|1,0,1]=4 2110 B11R0.160 CCCCN(CC(C)O)C(C)=O Amb18265600 [0,2,0,0,0,0|2,0,0]=4 2111 B11R0.160 CCCC[C@H](NC(C)=O)C(=O)O Amb2732388 [0,2,0,0,0,0|1,0,1]=4 2112 B11R0.160 CCOCC(NC(C)=O)C(=O)O Amb33308943 [0,2,0,0,0,0|1,0,1]=4 2113 B11R0.160 CCSCC(CC(=O)O)C(=O)O Amb33323654 [0,2,0,0,0,0|1,0,1]=4 2114 B11R0.160 COCCC(CC(=O)O)C(=O)O Amb33377343 [0,2,0,0,0,0|1,0,1]=4 2115 B11R0.160 COCCC(NC(C)=O)C(=O)O Amb13952178 [0,2,0,0,0,0|1,0,1]=4 2116 B11R0.160 CSCCC(CC(=O)O)C(=O)O Amb33475227 [0,2,0,0,0,0|1,0,1]=4 2117 B11R0.160 CSCCC(NC(C)=O)C(=O)O Amb9706349 [0,2,0,0,0,0|1,0,1]=4 2118 B11R0.160 CSCC[C@@H](NC(C)=O)C(=O)O Amb8629159 [0,2,0,0,0,0|1,0,1]=4 2119 B11R0.160 CSCC[C@H](NC(C)=O)C(=O)O Amb2720580 [0,2,0,0,0,0|1,0,1]=4 2120 B11R0.181 CC(C)CC(N)(CCF)C(=O)O Amb32670156 [0,2,0,0,0,0|1,0,0]=3 2121 B11R0.181 CCCC(O)(CC(=O)O)C(=O)O Amb33346916 [0,2,0,0,0,0|1,0,1]=4 2122 B11R0.236 CCCC(NC(=O)CC)C(=O)O Amb9494928 [0,2,0,0,0,0|0,0,1]=3 2123 B11R0.236 CCC[C@@H](NC(=O)CC)C(=O)O Amb32757138 [0,2,0,0,0,0|0,0,1]=3 2124 B11R0.236 CCC[C@H](NC(=O)CC)C(=O)O Amb32757125 [0,2,0,0,0,0|0,0,1]=3 2125 B11R0.236 CCC[C@H](NC(=O)CCl)C(=O)O Amb2781696 [0,2,0,0,0,0|1,0,1]=4 2126 B11R0.41 CCCC(C(=O)OC)C(=O)OC Amb15692534 [0,2,0,0,0,0|1,0,1]=4 2127 B11R0.57 CCCC(C(C)=O)C(=O)OCC Amb10605316 [0,2,0,0,0,0|1,0,1]=4 2128 B11R0.121 CCC(C)N(C(=O)Cl)C(C)CC Amb22230315 [0,2,0,0,0,0|2,0,0]=4 2129 B11R0.138 CCCN(C(C)=O)C(CC)CO Amb18928404 [0,2,0,0,0,0|2,0,0]=4 2130 B11R0.189 CCCC(F)(C(N)=O)C(C)CC Amb24116997 [0,2,0,0,0,0|1,0,0]=3 2131 B11R0.38 CCCN(CCCO)C(=O)CC Amb18928523 [0,2,0,0,0,0|2,0,0]=4 2132 B11R0.61 C=C(CCN)C(CCC)CCC Amb33273193 [0,2,0,0,0,0|2,0,0]=4 2133 B11R0.61 CCCC(CCC)C(=O)CCN Amb32731144 [0,2,0,0,0,0|1,0,0]=3 2134 B11R0.61 CCCC(CCC)C(=O)CNC Amb32731140 [0,2,0,0,0,0|1,0,0]=3 2135 B11R0.61 CCCC(CCC)C(=O)NCO Amb19942306 [0,2,0,0,0,0|0,0,0]=2 2136 B11R0.61 CCCC(CCC)C(=O)OCCl Amb32413746 [0,2,0,0,0,0|0,0,0]=2 2137 B11R0.61 CCCC(CCC)C(C)CON Amb32731003 [0,2,0,0,0,0|1,0,1]=4 2138 B11R0.61 CCCC(CCC)C(C)N=C=O Amb32731120 [0,2,0,0,0,0|1,0,1]=4 2139 B11R0.61 CCCC(CCC)C(N)CCO Amb32731157 [0,2,0,0,0,0|1,0,1]=4 2140 B11R0.61 CCCC(CCC)C(O)CC#N Amb33273447 [0,2,0,0,0,0|1,0,1]=4 2141 B11R0.61 CCCC(CCC)C(O)CCN Amb33474798 [0,2,0,0,0,0|1,0,1]=4 2142 B11R0.61 CCCC(CCC)C(O)CNC Amb32731141 [0,2,0,0,0,0|1,0,1]=4 2143 B11R0.61 CCCC(CCC)[C@@H](O)CCN Amb32731952 [0,2,0,0,0,0|1,0,1]=4 2144 B11R0.61 CCCC(CCC)[C@H](O)CCN Amb32731953 [0,2,0,0,0,0|1,0,1]=4 2145 B11R0.61 CCCN(CCC)C(=O)CC#N Amb6272026 [0,2,0,0,0,0|2,0,0]=4 2146 B11R0.61 CCCN(CCC)C(=O)CCCl Amb1127550 [0,2,0,0,0,0|2,0,0]=4 2147 B11R0.61 CCCN(CCC)C(=O)CCN Amb21957794 [0,2,0,0,0,0|2,0,0]=4 2148 B11R0.61 CCCN(CCC)C(=O)CNC Amb6257052 [0,2,0,0,0,0|2,0,0]=4 2149 B11R0.61 CCOC(=O)C(OCC)OCC Amb2725658 [0,2,0,0,0,0|2,0,0]=4 2150 B11R0.61 CCOC(=O)C(SCC)SCC Amb8514412 [0,2,0,0,0,0|2,0,0]=4 2151 B11R0.96 CCCC(CCC)C(CN)CO Amb32731017 [0,2,0,0,0,0|1,0,1]=4 2152 B11R0.97 CCCC(CCC)C(C)(C)C=O Amb32731052 [0,2,0,0,0,0|1,0,1]=4 2153 B11R0.97 CCCC(CCC)C(C)(C)CO Amb32731051 [0,2,0,0,0,0|1,0,1]=4 2154 B11R0.97 CCCC(CCC)C(C)(C)ON Amb32731002 [0,2,0,0,0,0|1,0,1]=4 2155 B11R0.97 CCCC(CCC)C(C)(N)CO Amb33273436 [0,2,0,0,0,0|1,0,1]=4 2156 B11R0.97 CCCC(CCC)C(C)(O)CN Amb33273437 [0,2,0,0,0,0|1,0,1]=4 2157 B11R0.97 CCCC(CCC)S(=O)(=O)NC Amb32692392 [0,2,0,0,0,0|1,0,1]=4 2158 B11R0.36 CCCCC(CCCC)C(C)=O Amb4017818 [0,2,0,0,0,0|1,0,0]=3 2159 B11R0.36 CCCCN(CCCC)C(=O)Cl Amb17563107 [0,2,0,0,0,0|2,0,0]=4 2160 B11R0.36 CCCCN(CCCC)C(C)=O Amb6366485 [0,2,0,0,0,0|2,0,0]=4 2161 B11R0.36 CCCCN(CCCO)C(C)=O Amb18262963 [0,2,0,0,0,0|2,0,0]=4 2162 B11R0.36 COCCN(CCOC)C(=O)Cl Amb17563079 [0,2,0,0,0,0|2,0,0]=4 2163 B11R0.78 CCCC(CCCCN)C(=O)O Amb28653062 [0,2,0,0,0,0|0,0,0]=2 2164 B11R0.78 CCCC(CCCCN)C(=O)O Amb8506428 [0,2,0,0,0,0|0,0,0]=2 2165 B11R0.78 CCCCCC(CCC)C(=O)O Amb18794407 [0,2,0,0,0,0|0,0,0]=2 2166 B11R0.146 CCCC(CCC(C)=O)C(=O)O Amb533087 [0,2,0,0,0,0|0,0,0]=2 2167 B11R0.146 CCN[C@@H](CCC(N)=O)C(=O)O Amb16232996 [0,2,0,0,0,0|1,0,1]=4 2168 B9R1.6 C=C(Br)C1CCCCC1 Amb27812306 [1,0,0,1,0,0|2,0,0]=4 2169 B9R1.6 C=C(C)C1CCCCC1 Amb24478631 [1,0,0,1,0,0|2,0,0]=4 2170 B9R1.6 CC(=O)C1CCCCC1 Amb4037310 [1,0,0,1,0,0|1,0,0]=3 2171 B9R1.6 CC(=O)C1CCCCN1 Amb21962174 [1,0,0,1,0,0|2,0,0]=4 2172 B9R1.6 CC(=O)C1CCCCN1 Amb2700057 [1,0,0,1,0,0|2,0,0]=4 2173 B9R1.6 CC(=O)C1CCCCO1 Amb23585662 [1,0,0,1,0,0|2,0,0]=4 2174 B9R1.6 CC(=O)C1CCCCS1 Amb23568664 [1,0,0,1,0,0|2,0,0]=4 2175 B9R1.6 CC(=O)C1CCCNC1 Amb22496258 [1,0,0,1,0,0|2,0,0]=4 2176 B9R1.6 CC(=O)C1CCCNC1 Amb3941186 [1,0,0,1,0,0|2,0,0]=4 2177 B9R1.6 CC(=O)C1CCCOC1 Amb26932950 [1,0,0,1,0,0|2,0,0]=4 2178 B9R1.6 CC(=O)C1CCNCC1 Amb10603454 [1,0,0,1,0,0|2,0,0]=4 2179 B9R1.6 CC(=O)C1CCNCC1 Amb19958038 [1,0,0,1,0,0|2,0,0]=4 2180 B9R1.6 CC(=O)C1CCOCC1 Amb16231304 [1,0,0,1,0,0|2,0,0]=4 2181 B9R1.6 CC(=O)C1CCSCC1 Amb24748894 [1,0,0,1,0,0|2,0,0]=4 2182 B9R1.6 CC(=O)N1CCCCC1 Amb2694530 [1,0,0,1,0,0|2,0,0]=4 2183 B9R1.6 CC(=O)[C@@H]1CCCCN1 Amb26891406 [1,0,0,1,0,0|2,0,0]=4 2184 B9R1.6 CC(=O)[C@@H]1CCCCN1 Amb28555630 [1,0,0,1,0,0|2,0,0]=4 2185 B9R1.6 CC(=O)[C@@H]1CCCNC1 Amb33131879 [1,0,0,1,0,0|2,0,0]=4 2186 B9R1.6 CC(=O)[C@H]1CCCCN1 Amb25072730 [1,0,0,1,0,0|2,0,0]=4 2187 B9R1.6 CC(=O)[C@H]1CCCCN1 Amb28935031 [1,0,0,1,0,0|2,0,0]=4 2188 B9R1.6 CC(=O)[C@H]1CCCNC1 Amb33131684 [1,0,0,1,0,0|2,0,0]=4 2189 B9R1.6 CC(O)C1CCCCC1 Amb9283574 [1,0,0,1,0,0|1,0,1]=4 2190 B9R1.6 C[C@H](O)C1CCCCC1 Amb13952949 [1,0,0,1,0,0|1,0,1]=4 2191 B9R1.6 N=C(N)C1CCCCC1 Amb2695062 [1,0,0,1,0,0|2,0,0]=4 2192 B9R1.6 N=C(N)C1CCCCC1 Amb8630087 [1,0,0,1,0,0|2,0,0]=4 2193 B9R1.6 NC(=O)C1CCCCC1 Amb6335833 [1,0,0,1,0,0|1,0,0]=3 2194 B9R1.6 NC(=O)C1CCCCN1 Amb2370929 [1,0,0,1,0,0|2,0,0]=4 2195 B9R1.6 NC(=O)C1CCCCN1 Amb433771 [1,0,0,1,0,0|2,0,0]=4 2196 B9R1.6 NC(=O)C1CCCCS1 Amb26316109 [1,0,0,1,0,0|2,0,0]=4 2197 B9R1.6 NC(=O)C1CCCNC1 Amb33527502 [1,0,0,1,0,0|2,0,0]=4 2198 B9R1.6 NC(=O)C1CCCNC1 Amb9702850 [1,0,0,1,0,0|2,0,0]=4 2199 B9R1.6 NC(=O)C1CCCOC1 Amb9173672 [1,0,0,1,0,0|2,0,0]=4 2200 B9R1.6 NC(=O)C1CCNCC1 Amb21957241 [1,0,0,1,0,0|2,0,0]=4 2201 B9R1.6 NC(=O)C1CCNCC1 Amb2720321 [1,0,0,1,0,0|2,0,0]=4 2202 B9R1.6 NC(=O)C1CCOCC1 Amb7990052 [1,0,0,1,0,0|2,0,0]=4 2203 B9R1.6 NC(=O)C1CCSCC1 Amb27252383 [1,0,0,1,0,0|2,0,0]=4 2204 B9R1.6 NC(=O)N1CCCCC1 Amb1151731 [1,0,0,1,0,0|2,0,0]=4 2205 B9R1.6 NC(=O)[C@@H]1CCCCN1 Amb25315367 [1,0,0,1,0,0|2,0,0]=4 2206 B9R1.6 NC(=O)[C@@H]1CCCNC1 Amb25757310 [1,0,0,1,0,0|2,0,0]=4 2207 B9R1.6 NC(=O)[C@@H]1CCCNC1 Amb31204722 [1,0,0,1,0,0|2,0,0]=4 2208 B9R1.6 NC(=O)[C@H]1CCCCN1 Amb27490731 [1,0,0,1,0,0|2,0,0]=4 2209 B9R1.6 NC(=O)[C@H]1CCCNC1 Amb23401436 [1,0,0,1,0,0|2,0,0]=4 2210 B9R1.6 NC(=O)[C@H]1CCCNC1 Amb23439159 [1,0,0,1,0,0|2,0,0]=4 2211 B9R1.6 NC(=S)C1CCCCC1 Amb6373985 [1,0,0,1,0,0|1,1,0]=4 2212 B9R1.6 NS(=O)C1CCCCC1 Amb26389954 [1,0,0,1,0,0|2,0,0]=4 2213 B9R1.6 O=C(Cl)C1CCCCC1 Amb2792904 [1,0,0,1,0,0|1,0,0]=3 2214 B9R1.6 O=C(Cl)C1CCCCO1 Amb2723690 [1,0,0,1,0,0|2,0,0]=4 2215 B9R1.6 O=C(Cl)C1CCCCS1 Amb27658766 [1,0,0,1,0,0|2,0,0]=4 2216 B9R1.6 O=C(Cl)C1CCCOC1 Amb18280558 [1,0,0,1,0,0|2,0,0]=4 2217 B9R1.6 O=C(Cl)C1CCOCC1 Amb2723452 [1,0,0,1,0,0|2,0,0]=4 2218 B9R1.6 O=C(Cl)C1CCSCC1 Amb6572254 [1,0,0,1,0,0|2,0,0]=4 2219 B9R1.6 O=C(Cl)N1CCCCC1 Amb17563099 [1,0,0,1,0,0|2,0,0]=4 2220 B9R1.6 O=C(Cl)[C@H]1CCCCO1 Amb24478586 [1,0,0,1,0,0|2,0,0]=4 2221 B9R1.6 O=C(O)C1=CCCCC1 Amb2720517 [1,0,0,1,0,0|0,0,2]=4 2222 B9R1.6 O=C(O)C1=NCCCC1 Amb24597785 [1,0,0,1,0,0|1,0,1]=4 2223 B9R1.6 O=C(O)C1C=CCCC1 Amb18642396 [1,0,0,1,0,0|0,0,2]=4 2224 B9R1.6 O=C(O)C1CC=CCC1 Amb2695197 [1,0,0,1,0,0|0,0,2]=4 2225 B9R1.6 O=C(O)C1CCCCC1 Amb2721294 [1,0,0,1,0,0|0,0,0]=2 2226 B9R1.6 O=C(O)C1CCCCN1 Amb6754083 [1,0,0,1,0,0|1,0,0]=3 2227 B9R1.6 O=C(O)C1CCCCN1 Amb9703161 [1,0,0,1,0,0|1,0,0]=3 2228 B9R1.6 O=C(O)C1CCCCO1 Amb2723689 [1,0,0,1,0,0|1,0,0]=3 2229 B9R1.6 O=C(O)C1CCCCS1 Amb18202314 [1,0,0,1,0,0|1,0,0]=3 2230 B9R1.6 O=C(O)C1CCCNC1 Amb6239367 [1,0,0,1,0,0|1,0,0]=3 2231 B9R1.6 O=C(O)C1CCCNC1 Amb9703145 [1,0,0,1,0,0|1,0,0]=3 2232 B9R1.6 O=C(O)C1CCCOC1 Amb1102367 [1,0,0,1,0,0|1,0,0]=3 2233 B9R1.6 O=C(O)C1CCCSC1 Amb33545067 [1,0,0,1,0,0|1,0,0]=3 2234 B9R1.6 O=C(O)C1CCCSS1 Amb24480090 [1,0,0,1,0,0|2,0,0]=4 2235 B9R1.6 O=C(O)C1CCNCC1 Amb2720245 [1,0,0,1,0,0|1,0,0]=3 2236 B9R1.6 O=C(O)C1CCNCC1 Amb932842 [1,0,0,1,0,0|1,0,0]=3 2237 B9R1.6 O=C(O)C1CCOCC1 Amb426862 [1,0,0,1,0,0|1,0,0]=3 2238 B9R1.6 O=C(O)C1CCOCN1 Amb28042897 [1,0,0,1,0,0|2,0,0]=4 2239 B9R1.6 O=C(O)C1CCSCC1 Amb6572253 [1,0,0,1,0,0|1,0,0]=3 2240 B9R1.6 O=C(O)C1CCSCN1 Amb1102215 [1,0,0,1,0,0|2,0,0]=4 2241 B9R1.6 O=C(O)C1CCSCN1 Amb22284134 [1,0,0,1,0,0|2,0,0]=4 2242 B9R1.6 O=C(O)C1CCSSC1 Amb26422767 [1,0,0,1,0,0|2,0,0]=4 2243 B9R1.6 O=C(O)C1CNCCN1 Amb22490977 [1,0,0,1,0,0|2,0,0]=4 2244 B9R1.6 O=C(O)C1CNCCN1 Amb2690349 [1,0,0,1,0,0|2,0,0]=4 2245 B9R1.6 O=C(O)C1CNCCN1 Amb2720318 [1,0,0,1,0,0|2,0,0]=4 2246 B9R1.6 O=C(O)C1CNCCO1 Amb16232076 [1,0,0,1,0,0|2,0,0]=4 2247 B9R1.6 O=C(O)C1CNCCO1 Amb2696640 [1,0,0,1,0,0|2,0,0]=4 2248 B9R1.6 O=C(O)C1CNCCS1 Amb8631056 [1,0,0,1,0,0|2,0,0]=4 2249 B9R1.6 O=C(O)C1COCCN1 Amb10607157 [1,0,0,1,0,0|2,0,0]=4 2250 B9R1.6 O=C(O)C1COCCN1 Amb2694767 [1,0,0,1,0,0|2,0,0]=4 2251 B9R1.6 O=C(O)C1COCCO1 Amb5399760 [1,0,0,1,0,0|2,0,0]=4 2252 B9R1.6 O=C(O)C1CSCCN1 Amb19888398 [1,0,0,1,0,0|2,0,0]=4 2253 B9R1.6 O=C(O)C1CSCCN1 Amb2695006 [1,0,0,1,0,0|2,0,0]=4 2254 B9R1.6 O=C(O)C1CSCCS1 Amb20622962 [1,0,0,1,0,0|2,0,0]=4 2255 B9R1.6 O=C(O)C1C[NH2+]CC[NH2+]1 Amb5722241 [1,0,0,1,0,0|2,0,0]=4 2256 B9R1.6 O=C(O)C1NCCCN1 Amb27473323 [1,0,0,1,0,0|2,0,0]=4 2257 B9R1.6 O=C(O)C1NCCCO1 Amb33193117 [1,0,0,1,0,0|2,0,0]=4 2258 B9R1.6 O=C(O)C1NCCCS1 Amb22899084 [1,0,0,1,0,0|2,0,0]=4 2259 B9R1.6 O=C(O)C1OCCCO1 Amb24715581 [1,0,0,1,0,0|2,0,0]=4 2260 B9R1.6 O=C(O)C1SCCCS1 Amb22167283 [1,0,0,1,0,0|2,0,0]=4 2261 B9R1.6 O=C(O)N1CCCCC1 Amb20242677 [1,0,0,1,0,0|1,0,0]=3 2262 B9R1.6 O=C(O)N1CCCCC1 Amb35825557 [1,0,0,1,0,0|1,0,0]=3 2263 B9R1.6 O=C(O)N1CCSCC1 Amb24099831 [1,0,0,1,0,0|2,0,0]=4 2264 B9R1.6 O=C(O)[C@@H]1CC=CCC1 Amb19131346 [1,0,0,1,0,0|0,0,2]=4 2265 B9R1.6 O=C(O)[C@@H]1CCCCN1 Amb2690345 [1,0,0,1,0,0|1,0,0]=3 2266 B9R1.6 O=C(O)[C@@H]1CCCCN1 Amb8384272 [1,0,0,1,0,0|1,0,0]=3 2267 B9R1.6 O=C(O)[C@@H]1CCCCO1 Amb22746821 [1,0,0,1,0,0|1,0,0]=3 2268 B9R1.6 O=C(O)[C@@H]1CCCNC1 Amb16232354 [1,0,0,1,0,0|1,0,0]=3 2269 B9R1.6 O=C(O)[C@@H]1CCCNC1 Amb8628966 [1,0,0,1,0,0|1,0,0]=3 2270 B9R1.6 O=C(O)[C@@H]1CCCNN1 Amb30666630 [1,0,0,1,0,0|2,0,0]=4 2271 B9R1.6 O=C(O)[C@@H]1CCCOC1 Amb26885613 [1,0,0,1,0,0|1,0,0]=3 2272 B9R1.6 O=C(O)[C@@H]1CCCSC1 Amb27826589 [1,0,0,1,0,0|1,0,0]=3 2273 B9R1.6 O=C(O)[C@@H]1CNCCN1 Amb6307277 [1,0,0,1,0,0|2,0,0]=4 2274 B9R1.6 O=C(O)[C@@H]1CNCCN1 Amb6307319 [1,0,0,1,0,0|2,0,0]=4 2275 B9R1.6 O=C(O)[C@@H]1CNCCO1 Amb22737231 [1,0,0,1,0,0|2,0,0]=4 2276 B9R1.6 O=C(O)[C@@H]1CNCCO1 Amb8631069 [1,0,0,1,0,0|2,0,0]=4 2277 B9R1.6 O=C(O)[C@@H]1COCCN1 Amb10576585 [1,0,0,1,0,0|2,0,0]=4 2278 B9R1.6 O=C(O)[C@@H]1COCCN1 Amb2696709 [1,0,0,1,0,0|2,0,0]=4 2279 B9R1.6 O=C(O)[C@@H]1COCCO1 Amb23438856 [1,0,0,1,0,0|2,0,0]=4 2280 B9R1.6 O=C(O)[C@@H]1CSCCN1 Amb22386830 [1,0,0,1,0,0|2,0,0]=4 2281 B9R1.6 O=C(O)[C@@H]1CSCCN1 Amb8630483 [1,0,0,1,0,0|2,0,0]=4 2282 B9R1.6 O=C(O)[C@H]1CC=CCC1 Amb17611453 [1,0,0,1,0,0|0,0,2]=4 2283 B9R1.6 O=C(O)[C@H]1CCCCN1 Amb2700060 [1,0,0,1,0,0|1,0,0]=3 2284 B9R1.6 O=C(O)[C@H]1CCCCN1 Amb8515100 [1,0,0,1,0,0|1,0,0]=3 2285 B9R1.6 O=C(O)[C@H]1CCCCO1 Amb26865454 [1,0,0,1,0,0|1,0,0]=3 2286 B9R1.6 O=C(O)[C@H]1CCCNC1 Amb8384271 [1,0,0,1,0,0|1,0,0]=3 2287 B9R1.6 O=C(O)[C@H]1CCCNC1 Amb8389307 [1,0,0,1,0,0|1,0,0]=3 2288 B9R1.6 O=C(O)[C@H]1CCCNN1 Amb27154761 [1,0,0,1,0,0|2,0,0]=4 2289 B9R1.6 O=C(O)[C@H]1CCCSC1 Amb27809148 [1,0,0,1,0,0|1,0,0]=3 2290 B9R1.6 O=C(O)[C@H]1CCSCN1 Amb25773953 [1,0,0,1,0,0|2,0,0]=4 2291 B9R1.6 O=C(O)[C@H]1CNCCN1 Amb20241207 [1,0,0,1,0,0|2,0,0]=4 2292 B9R1.6 O=C(O)[C@H]1CNCCN1 Amb2694998 [1,0,0,1,0,0|2,0,0]=4 2293 B9R1.6 O=C(O)[C@H]1CNCCN1 Amb8628465 [1,0,0,1,0,0|2,0,0]=4 2294 B9R1.6 O=C(O)[C@H]1CNCCO1 Amb10067023 [1,0,0,1,0,0|2,0,0]=4 2295 B9R1.6 O=C(O)[C@H]1CNCCO1 Amb22737232 [1,0,0,1,0,0|2,0,0]=4 2296 B9R1.6 O=C(O)[C@H]1COCCN1 Amb16232575 [1,0,0,1,0,0|2,0,0]=4 2297 B9R1.6 O=C(O)[C@H]1COCCN1 Amb2696766 [1,0,0,1,0,0|2,0,0]=4 2298 B9R1.6 O=C(O)[C@H]1COCCO1 Amb26430807 [1,0,0,1,0,0|2,0,0]=4 2299 B9R1.6 O=C(O)[C@H]1CSCCN1 Amb2700568 [1,0,0,1,0,0|2,0,0]=4 2300 B9R1.6 O=S(Cl)C1CCCCC1 Amb25305792 [1,0,0,1,0,0|2,0,0]=4 2301 B9R1.6 O=S(O)C1CCCCC1 Amb24603074 [1,0,0,1,0,0|1,0,0]=3 2302 B9R1.6 O=S([O-])C1CCCCC1 Amb19893330 [1,0,0,1,0,0|1,0,1]=4 2303 B9R1.6 O=[N+]([O-])C1CCCCC1 Amb10604036 [1,0,0,1,0,0|1,0,1]=4 2304 B9R1.6 O=[PH](O)C1CCCCN1 Amb28131021 [1,0,0,1,0,0|2,0,0]=4 2305 B9R1.6 OB(O)C1CCCCC1 Amb1630358 [1,0,0,1,0,0|1,0,1]=4 2306 B9R1.15 C=C1CCCCC1CC Amb27952112 [1,0,0,1,0,0|2,0,0]=4 2307 B9R1.15 CCC1CCCCC1=O Amb22002104 [1,0,0,1,0,0|1,0,0]=3 2308 B9R1.15 CCC1CCCCC1O Amb6608702 [1,0,0,1,0,0|1,0,1]=4 2309 B9R1.15 CCC1CCCCN1O Amb27483076 [1,0,0,1,0,0|2,0,0]=4 2310 B9R1.15 CCC1CCCNC1=N Amb27252267 [1,0,0,1,0,0|2,0,0]=4 2311 B9R1.15 CCC1CCCNC1=O Amb22276357 [1,0,0,1,0,0|1,0,0]=3 2312 B9R1.15 CCC1CCOCC1=O Amb33295409 [1,0,0,1,0,0|2,0,0]=4 2313 B9R1.15 CCC1CNCCC1=O Amb18642532 [1,0,0,1,0,0|2,0,0]=4 2314 B9R1.15 CCC1CNCCC1=O Amb23400918 [1,0,0,1,0,0|2,0,0]=4 2315 B9R1.15 CCC1COCCC1=O Amb25687037 [1,0,0,1,0,0|2,0,0]=4 2316 B9R1.15 CCC1NCCCC1=O Amb19888368 [1,0,0,1,0,0|2,0,0]=4 2317 B9R1.15 CCC1NCCCC1=O Amb28055859 [1,0,0,1,0,0|2,0,0]=4 2318 B9R1.15 CCC1NCCNC1=O Amb8503280 [1,0,0,1,0,0|2,0,0]=4 2319 B9R1.15 CCC1NCCNC1=O Amb9778903 [1,0,0,1,0,0|2,0,0]=4 2320 B9R1.15 CCC1SCCNC1=O Amb2796294 [1,0,0,1,0,0|2,0,0]=4 2321 B9R1.15 CCN1CCCNC1=O Amb15701510 [1,0,0,1,0,0|2,0,0]=4 2322 B9R1.15 CC[C@@H]1CCCCC1=O Amb25706912 [1,0,0,1,0,0|1,0,0]=3 2323 B9R1.15 CC[C@@H]1CCCC[C@H]1O Amb24671850 [1,0,0,1,0,0|1,0,1]=4 2324 B9R1.15 CC[C@@H]1CCCNC1=O Amb28436118 [1,0,0,1,0,0|1,0,0]=3 2325 B9R1.15 CC[C@@H]1CCCOC1=O Amb26601602 [1,0,0,1,0,0|0,0,0]=2 2326 B9R1.15 CC[C@H]1CCCC[C@@H]1O Amb27852810 [1,0,0,1,0,0|1,0,1]=4 2327 B9R1.15 CC[C@H]1CCCC[C@H]1O Amb28061782 [1,0,0,1,0,0|1,0,1]=4 2328 B9R1.15 CC[C@H]1CCCOC1=O Amb24477860 [1,0,0,1,0,0|0,0,0]=2 2329 B9R1.15 CNC1CCCCC1=O Amb28984230 [1,0,0,1,0,0|2,0,0]=4 2330 B9R1.15 CNC1CCCCC1=O Amb3644506 [1,0,0,1,0,0|2,0,0]=4 2331 B9R1.15 CNC1CCCNC1=O Amb28934961 [1,0,0,1,0,0|2,0,0]=4 2332 B9R1.15 COC1CCCCC1=O Amb4606000 [1,0,0,1,0,0|2,0,0]=4 2333 B9R1.15 COC1CCCNC1=O Amb16231349 [1,0,0,1,0,0|2,0,0]=4 2334 B9R1.15 CO[C@@H]1CCCCC1=O Amb22799901 [1,0,0,1,0,0|2,0,0]=4 2335 B9R1.15 CO[C@H]1CCCCC1=O Amb8386937 [1,0,0,1,0,0|2,0,0]=4 2336 B9R1.15 CSC1CCCCC1=O Amb19267090 [1,0,0,1,0,0|2,0,0]=4 2337 B9R1.15 NCC1CCCCC1=O Amb18203259 [1,0,0,1,0,0|2,0,0]=4 2338 B9R1.15 NCC1CCCNC1=O Amb19514595 [1,0,0,1,0,0|2,0,0]=4 2339 B9R1.15 NCC1CCCNC1=O Amb23586199 [1,0,0,1,0,0|2,0,0]=4 2340 B9R1.15 O=C1CCCCC1CO Amb16231080 [1,0,0,1,0,0|2,0,0]=4 2341 B9R1.15 O=C1CCCCC1CS Amb27838753 [1,0,0,1,0,0|2,0,0]=4 2342 B9R1.15 O=C1CCCC[C@@H]1CO Amb27750239 [1,0,0,1,0,0|2,0,0]=4 2343 B9R1.15 O=C1CCCC[C@H]1CO Amb27956173 [1,0,0,1,0,0|2,0,0]=4 2344 B9R1.15 O=C1NCCCC1CO Amb27814971 [1,0,0,1,0,0|2,0,0]=4 2345 B9R1.15 O=C1NCCCC1CS Amb27473272 [1,0,0,1,0,0|2,0,0]=4 2346 B9R1.22 CCC1CC(=O)OC1=O Amb24571652 [1,0,0,1,0,0|1,0,1]=4 2347 B9R1.22 CCC1CN(C)CC1=O Amb27589818 [1,0,0,1,0,0|2,0,0]=4 2348 B9R1.22 CO[C@@H]1C[C@@H](C)CC1=O Amb27802508 [1,0,0,1,0,0|2,0,0]=4 2349 B9R1.25 C=C1C(CC)C1C(=O)O Amb27635776 [1,0,0,1,0,0|0,0,2]=4 2350 B9R1.25 CCC1C(Cl)C1C(=O)O Amb32656378 [1,0,0,1,0,0|1,0,0]=3 2351 B9R1.25 C[C@H]1[C@H](CO)[C@@H]1C(=O)O Amb28428452 [1,0,0,1,0,0|1,0,0]=3 2352 B9R1.25 C\C=C1/[C@@H](C)[C@H]1C(=O)O Amb27614281 [1,0,0,1,0,0|0,0,2]=4 2353 B9R1.33 C=CCC1CCOC1=O Amb26353280 [1,0,0,1,0,0|0,0,2]=4 2354 B9R1.33 CCCC1CC=CC1=O Amb27838711 [1,0,0,1,0,0|1,0,1]=4 2355 B9R1.33 CCCC1CCCC1=O Amb8503562 [1,0,0,1,0,0|1,0,0]=3 2356 B9R1.33 CCCC1CCCC1O Amb26922499 [1,0,0,1,0,0|1,0,1]=4 2357 B9R1.33 CCCC1CCOS1=O Amb27408512 [1,0,0,1,0,0|1,0,0]=3 2358 B9R1.33 CCCC1COCC1=O Amb35639022 [1,0,0,1,0,0|2,0,0]=4 2359 B9R1.33 CCCN1CCCC1=O Amb15691721 [1,0,0,1,0,0|2,0,0]=4 2360 B9R1.33 CCC[C@@H]1CCCC1=O Amb28054357 [1,0,0,1,0,0|1,0,0]=3 2361 B9R1.33 CCC[C@@H]1CCC[C@H]1O Amb24519919 [1,0,0,1,0,0|1,0,1]=4 2362 B9R1.33 CCC[C@H]1CCNC1=O Amb27624920 [1,0,0,1,0,0|1,0,0]=3 2363 B9R1.33 CCNC1CCNC1=O Amb28249830 [1,0,0,1,0,0|2,0,0]=4 2364 B9R1.33 CCNC1CCNC1=O Amb28960288 [1,0,0,1,0,0|2,0,0]=4 2365 B9R1.33 CCNC1CCSC1=O Amb25706233 [1,0,0,1,0,0|1,1,0]=4 2366 B9R1.33 CCN[C@H]1CCOC1=O Amb28249000 [1,0,0,1,0,0|1,0,0]=3 2367 B9R1.33 CCOC1CCCC1=O Amb25147133 [1,0,0,1,0,0|2,0,0]=4 2368 B9R1.33 CCSC1CCNC1=O Amb27837709 [1,0,0,1,0,0|2,0,0]=4 2369 B9R1.33 CCSC1CCOC1=O Amb27975642 [1,0,0,1,0,0|1,0,0]=3 2370 B9R1.33 CC\C=C1\CCOC1=O Amb25225082 [1,0,0,1,0,0|0,0,2]=4 2371 B9R1.33 CNCC1CCCC1=O Amb27202013 [1,0,0,1,0,0|2,0,0]=4 2372 B9R1.33 COCC1CCCC1=O Amb25766356 [1,0,0,1,0,0|2,0,0]=4 2373 B9R1.33 CONC1CCOC1=O Amb28128618 [1,0,0,1,0,0|2,0,0]=4 2374 B9R1.33 CSCC1CCCC1=O Amb27838797 [1,0,0,1,0,0|2,0,0]=4 2375 B9R1.33 NCCC1CCCC1=O Amb18832679 [1,0,0,1,0,0|2,0,0]=4 2376 B9R1.33 NCCC1CCNC1=O Amb18832608 [1,0,0,1,0,0|2,0,0]=4 2377 B9R1.33 NCCN1CCOC1=O Amb22491260 [1,0,0,1,0,0|2,0,0]=4 2378 B9R1.33 NCCN1CCOC1=O Amb6673432 [1,0,0,1,0,0|2,0,0]=4 2379 B9R1.33 O=C1CCCC1CCBr Amb20623655 [1,0,0,1,0,0|2,0,0]=4 2380 B9R1.33 O=C1CCCC1CCF Amb33551119 [1,0,0,1,0,0|2,0,0]=4 2381 B9R1.33 O=C1CCCC1CCO Amb27221111 [1,0,0,1,0,0|2,0,0]=4 2382 B9R1.33 O=C1NCCC1CCBr Amb27956490 [1,0,0,1,0,0|2,0,0]=4 2383 B9R1.33 O=C1NCCC1CCCl Amb25946315 [1,0,0,1,0,0|2,0,0]=4 2384 B9R1.33 O=C1NCCC1CCO Amb33531266 [1,0,0,1,0,0|2,0,0]=4 2385 B9R1.33 O=C1NCC[C@@H]1CCO Amb27593854 [1,0,0,1,0,0|2,0,0]=4 2386 B9R1.33 O=C1OCCC1CCBr Amb20667717 [1,0,0,1,0,0|1,0,0]=3 2387 B9R1.33 O=C1OCCC1CCCl Amb27201250 [1,0,0,1,0,0|1,0,0]=3 2388 B9R1.33 O=C1OCCC1CCO Amb25293532 [1,0,0,1,0,0|1,0,0]=3 2389 B9R1.33 O=C1OCCN1CCBr Amb33533050 [1,0,0,1,0,0|2,0,0]=4 2390 B9R1.33 O=C1OCCN1CCCl Amb33527230 [1,0,0,1,0,0|2,0,0]=4 2391 B9R1.33 O=C1OCCN1CCI Amb35703773 [1,0,0,1,0,0|2,0,0]=4 2392 B9R1.33 O=C1OCCN1CCO Amb2720764 [1,0,0,1,0,0|2,0,0]=4 2393 B9R1.33 O=C1OCCN1CCS Amb27838578 [1,0,0,1,0,0|2,0,0]=4 2394 B9R1.35 C=C1CCC(C(=O)O)C1 Amb28369274 [1,0,0,1,0,0|0,0,2]=4 2395 B9R1.35 CC(=O)C1CC(C)CO1 Amb27780018 [1,0,0,1,0,0|2,0,0]=4 2396 B9R1.35 CC(=O)C1CCC(N)C1 Amb27960182 [1,0,0,1,0,0|2,0,0]=4 2397 B9R1.35 CC(=O)C1CCC(N)C1 Amb33447083 [1,0,0,1,0,0|2,0,0]=4 2398 B9R1.35 CC(=O)C1CCN(C)C1 Amb27829019 [1,0,0,1,0,0|2,0,0]=4 2399 B9R1.35 CC(=O)C1CC[C@@H](C)O1 Amb33423868 [1,0,0,1,0,0|2,0,0]=4 2400 B9R1.35 CC(=O)C1CC[C@H](C)C1 Amb27261938 [1,0,0,1,0,0|1,0,0]=3 2401 B9R1.35 CC(=O)[C@@H]1CC[C@@H](C)C1 Amb27861348 [1,0,0,1,0,0|1,0,0]=3 2402 B9R1.35 CC(=O)[C@@H]1CC[C@H](C)C1 Amb27861349 [1,0,0,1,0,0|1,0,0]=3 2403 B9R1.35 CC(=O)[C@@H]1CC[C@H](C)O1 Amb26958731 [1,0,0,1,0,0|2,0,0]=4 2404 B9R1.35 CC1=NC(C(=O)O)CC1 Amb23438203 [1,0,0,1,0,0|1,0,1]=4 2405 B9R1.35 CC1=NC(C(=O)O)CC1 Amb32409643 [1,0,0,1,0,0|1,0,1]=4 2406 B9R1.35 CC1=N[C@H](C(=O)O)CC1 Amb27455557 [1,0,0,1,0,0|1,0,1]=4 2407 B9R1.35 CC1C=C(C(=O)O)CC1 Amb18642397 [1,0,0,1,0,0|0,0,2]=4 2408 B9R1.35 CC1CC(C(=O)O)CN1 Amb18832566 [1,0,0,1,0,0|1,0,0]=3 2409 B9R1.35 CC1CC(C(=O)O)CO1 Amb25922998 [1,0,0,1,0,0|1,0,0]=3 2410 B9R1.35 CC1CC(C(=O)O)SS1 Amb28385584 [1,0,0,1,0,0|2,0,0]=4 2411 B9R1.35 CC1CC(C(N)=O)CN1 Amb27665690 [1,0,0,1,0,0|2,0,0]=4 2412 B9R1.35 CC1CCC(C(=O)Cl)O1 Amb27424709 [1,0,0,1,0,0|2,0,0]=4 2413 B9R1.35 CC1CCC(C(=O)O)C1 Amb18642624 [1,0,0,1,0,0|0,0,0]=2 2414 B9R1.35 CC1CCC(C(=O)O)N1 Amb18832572 [1,0,0,1,0,0|1,0,0]=3 2415 B9R1.35 CC1CCC(C(=O)O)N1 Amb32652343 [1,0,0,1,0,0|1,0,0]=3 2416 B9R1.35 CC1CCC(C(=O)O)O1 Amb17593370 [1,0,0,1,0,0|1,0,0]=3 2417 B9R1.35 CC1CCC(C(=O)O)S1 Amb25719281 [1,0,0,1,0,0|1,0,0]=3 2418 B9R1.35 CC1CCC(C(N)=O)O1 Amb27838521 [1,0,0,1,0,0|2,0,0]=4 2419 B9R1.35 CC1CCC(S(=O)Cl)C1 Amb32720564 [1,0,0,1,0,0|2,0,0]=4 2420 B9R1.35 CC1CCC(S(=O)[O-])C1 Amb32755283 [1,0,0,1,0,0|1,0,1]=4 2421 B9R1.35 CC1CCC(S(N)=O)C1 Amb32720565 [1,0,0,1,0,0|2,0,0]=4 2422 B9R1.35 CC1CCN(C(=O)Cl)C1 Amb27391470 [1,0,0,1,0,0|2,0,0]=4 2423 B9R1.35 CC1CC[C@H](C(=O)O)N1 Amb22748252 [1,0,0,1,0,0|1,0,0]=3 2424 B9R1.35 CC1CNC(C(N)=O)C1 Amb27783370 [1,0,0,1,0,0|2,0,0]=4 2425 B9R1.35 CC1CN[C@H](C(=O)O)C1 Amb33756822 [1,0,0,1,0,0|1,0,0]=3 2426 B9R1.35 CC1CN[C@H](C(=O)O)C1 Amb8386516 [1,0,0,1,0,0|1,0,0]=3 2427 B9R1.35 CC1COC(C(=O)O)C1 Amb32679237 [1,0,0,1,0,0|1,0,0]=3 2428 B9R1.35 CC1NC(C(=O)O)CS1 Amb9718451 [1,0,0,1,0,0|2,0,0]=4 2429 B9R1.35 CC1N[C@H](C(=O)O)CS1 Amb16203706 [1,0,0,1,0,0|2,0,0]=4 2430 B9R1.35 CN1CCC(C(=O)O)C1 Amb3941190 [1,0,0,1,0,0|1,0,0]=3 2431 B9R1.35 CN1CCC(C(=O)O)C1 Amb9154860 [1,0,0,1,0,0|1,0,0]=3 2432 B9R1.35 CN1CC[C@@H](C(=O)O)C1 Amb22746030 [1,0,0,1,0,0|1,0,0]=3 2433 B9R1.35 CN1CC[C@@H](C(=O)O)C1 Amb22756448 [1,0,0,1,0,0|1,0,0]=3 2434 B9R1.35 CN1CC[C@H](C(=O)O)C1 Amb26635487 [1,0,0,1,0,0|1,0,0]=3 2435 B9R1.35 C[C@@H]1C=N[C@H](C(=O)O)C1 Amb27468755 [1,0,0,1,0,0|1,0,1]=4 2436 B9R1.35 C[C@@H]1CCC(C(=O)O)O1 Amb33423875 [1,0,0,1,0,0|1,0,0]=3 2437 B9R1.35 C[C@@H]1CC[C@@H](C(=O)O)C1 Amb28429501 [1,0,0,1,0,0|0,0,0]=2 2438 B9R1.35 C[C@@H]1CC[C@@H](C(=O)O)N1 Amb31308105 [1,0,0,1,0,0|1,0,0]=3 2439 B9R1.35 C[C@@H]1CC[C@@H](C(N)=O)N1 Amb28456271 [1,0,0,1,0,0|2,0,0]=4 2440 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)C1 Amb10843961 [1,0,0,1,0,0|0,0,0]=2 2441 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)N1 Amb24399449 [1,0,0,1,0,0|1,0,0]=3 2442 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)N1 Amb32652487 [1,0,0,1,0,0|1,0,0]=3 2443 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)O1 Amb22886534 [1,0,0,1,0,0|1,0,0]=3 2444 B9R1.35 C[C@@H]1CN[C@H](C(=O)O)C1 Amb19888348 [1,0,0,1,0,0|1,0,0]=3 2445 B9R1.35 C[C@@H]1CN[C@H](C(=O)O)C1 Amb33812626 [1,0,0,1,0,0|1,0,0]=3 2446 B9R1.35 C[C@@H]1C[C@H](C(=O)O)CO1 Amb27961253 [1,0,0,1,0,0|1,0,0]=3 2447 B9R1.35 C[C@@H]1O[C@H](C(=O)O)CS1 Amb26951854 [1,0,0,1,0,0|2,0,0]=4 2448 B9R1.35 C[C@H]1CC[C@@H](C(=O)O)N1 Amb24598417 [1,0,0,1,0,0|1,0,0]=3 2449 B9R1.35 C[C@H]1CC[C@@H](C(=O)O)N1 Amb35745779 [1,0,0,1,0,0|1,0,0]=3 2450 B9R1.35 C[C@H]1CC[C@@H](C(=O)O)O1 Amb24651587 [1,0,0,1,0,0|1,0,0]=3 2451 B9R1.35 C[C@H]1CC[C@@H](C(N)=O)C1 Amb27630457 [1,0,0,1,0,0|1,0,0]=3 2452 B9R1.35 C[C@H]1CC[C@@H](C(N)=O)N1 Amb28059269 [1,0,0,1,0,0|2,0,0]=4 2453 B9R1.35 C[C@H]1CC[C@@H](C(N)=O)O1 Amb27390111 [1,0,0,1,0,0|2,0,0]=4 2454 B9R1.35 C[C@H]1CC[C@H](C(=O)O)N1 Amb33871500 [1,0,0,1,0,0|1,0,0]=3 2455 B9R1.35 C[C@H]1CC[C@H](C(N)=O)N1 Amb27204783 [1,0,0,1,0,0|2,0,0]=4 2456 B9R1.35 C[C@H]1CN[C@@H](C(=O)O)C1 Amb19887682 [1,0,0,1,0,0|1,0,0]=3 2457 B9R1.35 C[C@H]1CN[C@@H](C(=O)O)C1 Amb23439040 [1,0,0,1,0,0|1,0,0]=3 2458 B9R1.35 C[C@H]1N[C@@H](C(=O)O)CS1 Amb28198473 [1,0,0,1,0,0|2,0,0]=4 2459 B9R1.35 C[C@H]1O[C@H](C(=O)O)CS1 Amb27252305 [1,0,0,1,0,0|2,0,0]=4 2460 B9R1.35 NC(=O)C1CCC(Cl)C1 Amb27253059 [1,0,0,1,0,0|2,0,0]=4 2461 B9R1.35 NC(=O)C1CCC(F)C1 Amb27155322 [1,0,0,1,0,0|2,0,0]=4 2462 B9R1.35 NC(=O)C1CCC(N)C1 Amb25104222 [1,0,0,1,0,0|2,0,0]=4 2463 B9R1.35 NC(=O)C1CCC(N)C1 Amb32663130 [1,0,0,1,0,0|2,0,0]=4 2464 B9R1.35 NC(=O)[C@@H]1CC[C@H](S)C1 Amb25290990 [1,0,0,1,0,0|2,0,0]=4 2465 B9R1.35 NC(=O)[C@H]1CC[C@@H](N)C1 Amb25321319 [1,0,0,1,0,0|2,0,0]=4 2466 B9R1.35 NC(=O)[C@H]1CC[C@@H](N)C1 Amb28921043 [1,0,0,1,0,0|2,0,0]=4 2467 B9R1.35 NC1CCC(C(=O)O)C1 Amb10066880 [1,0,0,1,0,0|1,0,0]=3 2468 B9R1.35 NC1CCC(C(=O)O)C1 Amb2694935 [1,0,0,1,0,0|1,0,0]=3 2469 B9R1.35 NC1CN[C@H](C(=O)O)C1 Amb28145911 [1,0,0,1,0,0|2,0,0]=4 2470 B9R1.35 NC1COC(C(=O)O)C1 Amb18642828 [1,0,0,1,0,0|2,0,0]=4 2471 B9R1.35 NC1CSC(C(=O)O)C1 Amb18831415 [1,0,0,1,0,0|2,0,0]=4 2472 B9R1.35 N[C@@H]1CCC(C(=O)O)C1 Amb27263056 [1,0,0,1,0,0|1,0,0]=3 2473 B9R1.35 N[C@@H]1CC[C@@H](C(=O)O)C1 Amb10066881 [1,0,0,1,0,0|1,0,0]=3 2474 B9R1.35 N[C@@H]1CC[C@@H](C(=O)O)C1 Amb33801942 [1,0,0,1,0,0|1,0,0]=3 2475 B9R1.35 N[C@@H]1CC[C@H](C(=O)O)C1 Amb33801272 [1,0,0,1,0,0|1,0,0]=3 2476 B9R1.35 N[C@@H]1CC[C@H](C(=O)O)C1 Amb8516357 [1,0,0,1,0,0|1,0,0]=3 2477 B9R1.35 N[C@@H]1CN[C@@H](C(=O)O)C1 Amb19515889 [1,0,0,1,0,0|2,0,0]=4 2478 B9R1.35 N[C@@H]1CN[C@@H](C(=O)O)C1 Amb25992752 [1,0,0,1,0,0|2,0,0]=4 2479 B9R1.35 N[C@@H]1CN[C@H](C(=O)O)C1 Amb10070446 [1,0,0,1,0,0|2,0,0]=4 2480 B9R1.35 N[C@@H]1CN[C@H](C(=O)O)C1 Amb10603136 [1,0,0,1,0,0|2,0,0]=4 2481 B9R1.35 N[C@@H]1CO[C@@H](C(=O)O)C1 Amb25691536 [1,0,0,1,0,0|2,0,0]=4 2482 B9R1.35 N[C@H]1CC[C@@H](C(=O)O)C1 Amb22746692 [1,0,0,1,0,0|1,0,0]=3 2483 B9R1.35 N[C@H]1CC[C@@H](C(=O)O)C1 Amb8516356 [1,0,0,1,0,0|1,0,0]=3 2484 B9R1.35 N[C@H]1CC[C@H](C(=O)O)C1 Amb10066883 [1,0,0,1,0,0|1,0,0]=3 2485 B9R1.35 N[C@H]1CC[C@H](C(=O)O)C1 Amb22756038 [1,0,0,1,0,0|1,0,0]=3 2486 B9R1.35 N[C@H]1CN[C@@H](C(=O)O)C1 Amb27255323 [1,0,0,1,0,0|2,0,0]=4 2487 B9R1.35 N[C@H]1CN[C@H](C(=O)O)C1 Amb10070445 [1,0,0,1,0,0|2,0,0]=4 2488 B9R1.35 N[C@H]1CN[C@H](C(=O)O)C1 Amb10603131 [1,0,0,1,0,0|2,0,0]=4 2489 B9R1.35 N[C@H]1CO[C@H](C(=O)O)C1 Amb24117069 [1,0,0,1,0,0|2,0,0]=4 2490 B9R1.35 O=C(Cl)C1CCC(Cl)C1 Amb24707520 [1,0,0,1,0,0|2,0,0]=4 2491 B9R1.35 O=C(O)C1CC(Cl)CN1 Amb28436107 [1,0,0,1,0,0|2,0,0]=4 2492 B9R1.35 O=C(O)C1CC(F)CN1 Amb10608925 [1,0,0,1,0,0|2,0,0]=4 2493 B9R1.35 O=C(O)C1CC(I)CN1 Amb27467588 [1,0,0,1,0,0|2,0,0]=4 2494 B9R1.35 O=C(O)C1CC(O)CN1 Amb32666298 [1,0,0,1,0,0|2,0,0]=4 2495 B9R1.35 O=C(O)C1CC(O)CN1 Amb33481348 [1,0,0,1,0,0|2,0,0]=4 2496 B9R1.35 O=C(O)C1CC(O)CN1 Amb9702801 [1,0,0,1,0,0|2,0,0]=4 2497 B9R1.35 O=C(O)C1CC(O)CO1 Amb18642869 [1,0,0,1,0,0|2,0,0]=4 2498 B9R1.35 O=C(O)C1CCC(Br)C1 Amb2695404 [1,0,0,1,0,0|1,0,0]=3 2499 B9R1.35 O=C(O)C1CCC(F)C1 Amb22886545 [1,0,0,1,0,0|1,0,0]=3 2500 B9R1.35 O=C(O)C1CCC(I)C1 Amb23456141 [1,0,0,1,0,0|1,0,0]=3 2501 B9R1.35 O=C(O)C1CCC(O)C1 Amb21963572 [1,0,0,1,0,0|1,0,0]=3 2502 B9R1.35 O=C(O)C1CCC(S)C1 Amb27403449 [1,0,0,1,0,0|1,0,0]=3 2503 B9R1.35 O=C(O)C1C[C@H](O)CN1 Amb34913473 [1,0,0,1,0,0|2,0,0]=4 2504 B9R1.35 O=C(O)[C@@H]1CC(O)CN1 Amb25743296 [1,0,0,1,0,0|2,0,0]=4 2505 B9R1.35 O=C(O)[C@@H]1CC(S)CN1 Amb28430216 [1,0,0,1,0,0|2,0,0]=4 2506 B9R1.35 O=C(O)[C@@H]1CC[C@@H](O)C1 Amb22746558 [1,0,0,1,0,0|1,0,0]=3 2507 B9R1.35 O=C(O)[C@@H]1CC[C@H](O)C1 Amb27784295 [1,0,0,1,0,0|1,0,0]=3 2508 B9R1.35 O=C(O)[C@@H]1CC[C@H](S)C1 Amb26438302 [1,0,0,1,0,0|1,0,0]=3 2509 B9R1.35 O=C(O)[C@@H]1C[C@@H](Br)CN1 Amb10603132 [1,0,0,1,0,0|2,0,0]=4 2510 B9R1.35 O=C(O)[C@@H]1C[C@@H](F)CN1 Amb16232298 [1,0,0,1,0,0|2,0,0]=4 2511 B9R1.35 O=C(O)[C@@H]1C[C@@H](F)CN1 Amb8386381 [1,0,0,1,0,0|2,0,0]=4 2512 B9R1.35 O=C(O)[C@@H]1C[C@@H](O)CN1 Amb1994991 [1,0,0,1,0,0|2,0,0]=4 2513 B9R1.35 O=C(O)[C@@H]1C[C@@H](O)CO1 Amb28287549 [1,0,0,1,0,0|2,0,0]=4 2514 B9R1.35 O=C(O)[C@@H]1C[C@@H](S)CN1 Amb22831348 [1,0,0,1,0,0|2,0,0]=4 2515 B9R1.35 O=C(O)[C@@H]1C[C@H](Br)CN1 Amb10603137 [1,0,0,1,0,0|2,0,0]=4 2516 B9R1.35 O=C(O)[C@@H]1C[C@H](Cl)CN1 Amb27630657 [1,0,0,1,0,0|2,0,0]=4 2517 B9R1.35 O=C(O)[C@@H]1C[C@H](Cl)CN1 Amb35749342 [1,0,0,1,0,0|2,0,0]=4 2518 B9R1.35 O=C(O)[C@@H]1C[C@H](F)CN1 Amb10603139 [1,0,0,1,0,0|2,0,0]=4 2519 B9R1.35 O=C(O)[C@@H]1C[C@H](F)CN1 Amb22757085 [1,0,0,1,0,0|2,0,0]=4 2520 B9R1.35 O=C(O)[C@@H]1C[C@H](O)CN1 Amb22748218 [1,0,0,1,0,0|2,0,0]=4 2521 B9R1.35 O=C(O)[C@@H]1C[C@H](O)CN1 Amb8384483 [1,0,0,1,0,0|2,0,0]=4 2522 B9R1.35 O=C(O)[C@@H]1C[C@H](O)CN1 Amb8629987 [1,0,0,1,0,0|2,0,0]=4 2523 B9R1.35 O=C(O)[C@@H]1C[C@H](S)CN1 Amb27783148 [1,0,0,1,0,0|2,0,0]=4 2524 B9R1.35 O=C(O)[C@@H]1C[C@H](S)CN1 Amb28994765 [1,0,0,1,0,0|2,0,0]=4 2525 B9R1.35 O=C(O)[C@H]1CC(F)CN1 Amb27447262 [1,0,0,1,0,0|2,0,0]=4 2526 B9R1.35 O=C(O)[C@H]1CC[C@H](O)C1 Amb26960428 [1,0,0,1,0,0|1,0,0]=3 2527 B9R1.35 O=C(O)[C@H]1CC[C@H](O)N1 Amb27421972 [1,0,0,1,0,0|2,0,0]=4 2528 B9R1.35 O=C(O)[C@H]1C[C@@H](F)CN1 Amb10839999 [1,0,0,1,0,0|2,0,0]=4 2529 B9R1.35 O=C(O)[C@H]1C[C@@H](F)CN1 Amb33726117 [1,0,0,1,0,0|2,0,0]=4 2530 B9R1.35 O=C(O)[C@H]1C[C@@H](O)CN1 Amb5718663 [1,0,0,1,0,0|2,0,0]=4 2531 B9R1.35 O=C(O)[C@H]1C[C@@H](O)CN1 Amb5719209 [1,0,0,1,0,0|2,0,0]=4 2532 B9R1.35 O=C(O)[C@H]1C[C@H](F)CN1 Amb10067741 [1,0,0,1,0,0|2,0,0]=4 2533 B9R1.35 O=C(O)[C@H]1C[C@H](F)CN1 Amb28989995 [1,0,0,1,0,0|2,0,0]=4 2534 B9R1.35 O=C(O)[C@H]1C[C@H](O)CN1 Amb16230723 [1,0,0,1,0,0|2,0,0]=4 2535 B9R1.35 O=C(O)[C@H]1C[C@H](O)CN1 Amb8628928 [1,0,0,1,0,0|2,0,0]=4 2536 B9R1.35 O=C1CCC(C(=O)O)C1 Amb2695400 [1,0,0,1,0,0|1,0,1]=4 2537 B9R1.35 O=C1CC[C@@H](C(=O)O)C1 Amb27254141 [1,0,0,1,0,0|1,0,1]=4 2538 B9R1.35 O=C1CC[C@H](C(=O)O)C1 Amb22746923 [1,0,0,1,0,0|1,0,1]=4 2539 B9R1.41 CC(=O)C1CCCC1N Amb26959185 [1,0,0,1,0,0|2,0,0]=4 2540 B9R1.41 CC(=O)C1CCCC1O Amb25086736 [1,0,0,1,0,0|2,0,0]=4 2541 B9R1.41 CC(=O)C1CCCN1C Amb25295317 [1,0,0,1,0,0|2,0,0]=4 2542 B9R1.41 CC(=O)C1CCNC1C Amb24393053 [1,0,0,1,0,0|2,0,0]=4 2543 B9R1.41 CC(=O)C1CCOC1C Amb25882003 [1,0,0,1,0,0|2,0,0]=4 2544 B9R1.41 CC(=O)C1CNCC1C Amb28346154 [1,0,0,1,0,0|2,0,0]=4 2545 B9R1.41 CC(=O)C1CSCC1C Amb32988245 [1,0,0,1,0,0|2,0,0]=4 2546 B9R1.41 CC(=O)N1CCCC1C Amb26494370 [1,0,0,1,0,0|2,0,0]=4 2547 B9R1.41 CC(=O)[C@@H]1CCC[C@@H]1N Amb33132196 [1,0,0,1,0,0|2,0,0]=4 2548 B9R1.41 CC(=O)[C@@H]1CCC[C@H]1C Amb24692616 [1,0,0,1,0,0|1,0,0]=3 2549 B9R1.41 CC(=O)[C@@H]1CCC[C@H]1O Amb27440450 [1,0,0,1,0,0|2,0,0]=4 2550 B9R1.41 CC(=O)[C@H]1CCC[C@H]1C Amb27428390 [1,0,0,1,0,0|1,0,0]=3 2551 B9R1.41 CC1=C(C(=O)O)CCC1 Amb4021851 [1,0,0,1,0,0|0,0,2]=4 2552 B9R1.41 CC1CCCC1B(O)O Amb27244083 [1,0,0,1,0,0|1,0,1]=4 2553 B9R1.41 CC1CCCC1C(=N)N Amb28286052 [1,0,0,1,0,0|2,0,0]=4 2554 B9R1.41 CC1CCCC1C(=O)Cl Amb26447682 [1,0,0,1,0,0|1,0,0]=3 2555 B9R1.41 CC1CCCC1C(=O)O Amb8496598 [1,0,0,1,0,0|0,0,0]=2 2556 B9R1.41 CC1CCCC1[C@@H](C)O Amb28322680 [1,0,0,1,0,0|1,0,1]=4 2557 B9R1.41 CC1CCCN1C(=O)Cl Amb25131803 [1,0,0,1,0,0|2,0,0]=4 2558 B9R1.41 CC1CCNC1C(=O)O Amb22496299 [1,0,0,1,0,0|1,0,0]=3 2559 B9R1.41 CC1CCNC1C(=O)O Amb28895929 [1,0,0,1,0,0|1,0,0]=3 2560 B9R1.41 CC1CCNC1C(N)=O Amb26893292 [1,0,0,1,0,0|2,0,0]=4 2561 B9R1.41 CC1CCNC1C(N)=O Amb33307145 [1,0,0,1,0,0|2,0,0]=4 2562 B9R1.41 CC1CCN[C@@H]1C(=O)O Amb25786199 [1,0,0,1,0,0|1,0,0]=3 2563 B9R1.41 CC1CCOC1C(=O)O Amb20668280 [1,0,0,1,0,0|1,0,0]=3 2564 B9R1.41 CC1CCSC1C(=O)O Amb33038449 [1,0,0,1,0,0|1,0,0]=3 2565 B9R1.41 CC1CNCC1C(=O)O Amb2695368 [1,0,0,1,0,0|1,0,0]=3 2566 B9R1.41 CC1CNCC1C(=O)O Amb32665482 [1,0,0,1,0,0|1,0,0]=3 2567 B9R1.41 CC1CNCC1C(N)=O Amb26454427 [1,0,0,1,0,0|2,0,0]=4 2568 B9R1.41 CC1CNCC1C(N)=O Amb32663022 [1,0,0,1,0,0|2,0,0]=4 2569 B9R1.41 CC1NCCC1C(=O)O Amb18118138 [1,0,0,1,0,0|1,0,0]=3 2570 B9R1.41 CC1NCCC1C(=O)O Amb28555367 [1,0,0,1,0,0|1,0,0]=3 2571 B9R1.41 CC1OCCC1C(=O)O Amb33548509 [1,0,0,1,0,0|1,0,0]=3 2572 B9R1.41 CC1OCOC1C(=O)O Amb27828880 [1,0,0,1,0,0|2,0,0]=4 2573 B9R1.41 CC1SCNC1C(=O)O Amb27591597 [1,0,0,1,0,0|2,0,0]=4 2574 B9R1.41 CN1CCCC1C(=O)Cl Amb25250467 [1,0,0,1,0,0|2,0,0]=4 2575 B9R1.41 CN1CCCC1C(=O)O Amb33545070 [1,0,0,1,0,0|1,0,0]=3 2576 B9R1.41 CN1CCCC1C(=O)O Amb8559038 [1,0,0,1,0,0|1,0,0]=3 2577 B9R1.41 CN1CCCC1C(N)=O Amb22371060 [1,0,0,1,0,0|2,0,0]=4 2578 B9R1.41 CN1CCC[C@@H]1C(=O)O Amb17935722 [1,0,0,1,0,0|1,0,0]=3 2579 B9R1.41 CN1CCC[C@@H]1C(=O)O Amb18559228 [1,0,0,1,0,0|1,0,0]=3 2580 B9R1.41 CN1CCC[C@@H]1C(=O)O Amb22748316 [1,0,0,1,0,0|1,0,0]=3 2581 B9R1.41 CN1CCC[C@H]1C(=O)O Amb10604041 [1,0,0,1,0,0|1,0,0]=3 2582 B9R1.41 CN1CCC[C@H]1C(=O)O Amb22587172 [1,0,0,1,0,0|1,0,0]=3 2583 B9R1.41 CN1CCC[C@H]1C(=O)O Amb9825903 [1,0,0,1,0,0|1,0,0]=3 2584 B9R1.41 CN1CCC[C@H]1C(N)=O Amb28059484 [1,0,0,1,0,0|2,0,0]=4 2585 B9R1.41 CN1CSCC1C(=O)O Amb19650934 [1,0,0,1,0,0|2,0,0]=4 2586 B9R1.41 CN1CSCC1C(=O)O Amb21959971 [1,0,0,1,0,0|2,0,0]=4 2587 B9R1.41 CN1CSC[C@@H]1C(=O)O Amb27157377 [1,0,0,1,0,0|2,0,0]=4 2588 B9R1.41 CN1CSC[C@H]1C(=O)O Amb10608462 [1,0,0,1,0,0|2,0,0]=4 2589 B9R1.41 CN1CSC[C@H]1C(=O)O Amb22587250 [1,0,0,1,0,0|2,0,0]=4 2590 B9R1.41 C[C@@H]1CCCC1C(=O)O Amb27167847 [1,0,0,1,0,0|0,0,0]=2 2591 B9R1.41 C[C@@H]1CCC[C@@H]1C(=O)O Amb10843957 [1,0,0,1,0,0|0,0,0]=2 2592 B9R1.41 C[C@@H]1CCC[C@H]1C(=O)O Amb10843949 [1,0,0,1,0,0|0,0,0]=2 2593 B9R1.41 C[C@@H]1CCN[C@@H]1C(N)=O Amb27446302 [1,0,0,1,0,0|2,0,0]=4 2594 B9R1.41 C[C@@H]1CCN[C@H]1C(=O)O Amb22747259 [1,0,0,1,0,0|1,0,0]=3 2595 B9R1.41 C[C@@H]1CCO[C@@H]1C(=O)O Amb25251332 [1,0,0,1,0,0|1,0,0]=3 2596 B9R1.41 C[C@@H]1CCO[C@H]1C(=O)O Amb34916171 [1,0,0,1,0,0|1,0,0]=3 2597 B9R1.41 C[C@@H]1CNC[C@@H]1C(=O)O Amb27440055 [1,0,0,1,0,0|1,0,0]=3 2598 B9R1.41 C[C@@H]1CNC[C@H]1C(=O)O Amb26442159 [1,0,0,1,0,0|1,0,0]=3 2599 B9R1.41 C[C@@H]1CNC[C@H]1C(=O)O Amb32664837 [1,0,0,1,0,0|1,0,0]=3 2600 B9R1.41 C[C@@H]1CNC[C@H]1C(N)=O Amb25319543 [1,0,0,1,0,0|2,0,0]=4 2601 B9R1.41 C[C@@H]1CNC[C@H]1C(N)=O Amb26066427 [1,0,0,1,0,0|2,0,0]=4 2602 B9R1.41 C[C@@H]1COC[C@H]1C(=O)O Amb28286229 [1,0,0,1,0,0|1,0,0]=3 2603 B9R1.41 C[C@@H]1NCC[C@@H]1C(=O)O Amb27969130 [1,0,0,1,0,0|1,0,0]=3 2604 B9R1.41 C[C@@H]1NCC[C@@H]1C(N)=O Amb27851822 [1,0,0,1,0,0|2,0,0]=4 2605 B9R1.41 C[C@@H]1NCC[C@H]1C(=O)O Amb18832568 [1,0,0,1,0,0|1,0,0]=3 2606 B9R1.41 C[C@@H]1OCC[C@@H]1C(=O)O Amb22886528 [1,0,0,1,0,0|1,0,0]=3 2607 B9R1.41 C[C@@H]1OCC[C@H]1C(=O)O Amb25992190 [1,0,0,1,0,0|1,0,0]=3 2608 B9R1.41 C[C@H]1CCC[C@@H]1B(O)O Amb24566352 [1,0,0,1,0,0|1,0,1]=4 2609 B9R1.41 C[C@H]1CCC[C@@H]1C(=O)O Amb10843959 [1,0,0,1,0,0|0,0,0]=2 2610 B9R1.41 C[C@H]1CCC[C@H]1C(=O)O Amb10843950 [1,0,0,1,0,0|0,0,0]=2 2611 B9R1.41 C[C@H]1CCN[C@@H]1C(=O)O Amb8387164 [1,0,0,1,0,0|1,0,0]=3 2612 B9R1.41 C[C@H]1CNC[C@@H]1C(=O)O Amb27217270 [1,0,0,1,0,0|1,0,0]=3 2613 B9R1.41 C[C@H]1NCC[C@H]1C(=O)O Amb27655604 [1,0,0,1,0,0|1,0,0]=3 2614 B9R1.41 C[C@H]1OCC[C@H]1C(=O)O Amb25253338 [1,0,0,1,0,0|1,0,0]=3 2615 B9R1.41 C[C@H]1OCNC1C(=O)O Amb28057581 [1,0,0,1,0,0|2,0,0]=4 2616 B9R1.41 C[C@H]1OCN[C@@H]1C(=O)O Amb27782646 [1,0,0,1,0,0|2,0,0]=4 2617 B9R1.41 C[C@H]1OCO[C@@H]1C(=O)O Amb27782406 [1,0,0,1,0,0|2,0,0]=4 2618 B9R1.41 NC(=O)C1CCCC1N Amb19148786 [1,0,0,1,0,0|2,0,0]=4 2619 B9R1.41 NC(=O)C1CCCC1N Amb32644747 [1,0,0,1,0,0|2,0,0]=4 2620 B9R1.41 NC(=O)C1CCCC1N Amb32662680 [1,0,0,1,0,0|2,0,0]=4 2621 B9R1.41 NC(=O)C1CCCC1O Amb25310986 [1,0,0,1,0,0|2,0,0]=4 2622 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1N Amb8515831 [1,0,0,1,0,0|2,0,0]=4 2623 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1O Amb8515027 [1,0,0,1,0,0|2,0,0]=4 2624 B9R1.41 NC(=O)[C@H]1CCC[C@H]1N Amb26432403 [1,0,0,1,0,0|2,0,0]=4 2625 B9R1.41 NC(=O)[C@H]1CCC[C@H]1N Amb32662604 [1,0,0,1,0,0|2,0,0]=4 2626 B9R1.41 NC(=O)[C@H]1CCC[C@H]1N Amb32662606 [1,0,0,1,0,0|2,0,0]=4 2627 B9R1.41 NC(=O)[C@H]1CCC[C@H]1O Amb26630221 [1,0,0,1,0,0|2,0,0]=4 2628 B9R1.41 NC1CCCC1C(=O)O Amb2697364 [1,0,0,1,0,0|1,0,0]=3 2629 B9R1.41 NC1CCCC1C(=O)O Amb8630257 [1,0,0,1,0,0|1,0,0]=3 2630 B9R1.41 NC1CCCC1C(O)=[ClH] Amb27883058 [1,0,0,1,0,0|2,0,0]=4 2631 B9R1.41 NC1CCNC1C(=O)O Amb27153692 [1,0,0,1,0,0|2,0,0]=4 2632 B9R1.41 NC1CCOC1C(=O)O Amb26642919 [1,0,0,1,0,0|2,0,0]=4 2633 B9R1.41 NC1CNCC1C(=O)O Amb8630131 [1,0,0,1,0,0|2,0,0]=4 2634 B9R1.41 NC1COCC1C(=O)O Amb24709230 [1,0,0,1,0,0|2,0,0]=4 2635 B9R1.41 NC1CSCC1C(=O)O Amb24457278 [1,0,0,1,0,0|2,0,0]=4 2636 B9R1.41 NN1CCCC1C(=O)O Amb18642792 [1,0,0,1,0,0|2,0,0]=4 2637 B9R1.41 NN1CCC[C@H]1C(=O)O Amb25887284 [1,0,0,1,0,0|2,0,0]=4 2638 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O Amb8387462 [1,0,0,1,0,0|1,0,0]=3 2639 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O Amb8516030 [1,0,0,1,0,0|1,0,0]=3 2640 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O Amb20241297 [1,0,0,1,0,0|1,0,0]=3 2641 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O Amb33524005 [1,0,0,1,0,0|1,0,0]=3 2642 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O Amb19929517 [1,0,0,1,0,0|2,0,0]=4 2643 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O Amb31028940 [1,0,0,1,0,0|2,0,0]=4 2644 B9R1.41 N[C@@H]1CCO[C@@H]1C(=O)O Amb31264036 [1,0,0,1,0,0|2,0,0]=4 2645 B9R1.41 N[C@@H]1CCO[C@@H]1C(=O)O Amb32666901 [1,0,0,1,0,0|2,0,0]=4 2646 B9R1.41 N[C@@H]1CNC[C@H]1C(=O)O Amb27207888 [1,0,0,1,0,0|2,0,0]=4 2647 B9R1.41 N[C@@H]1COC[C@@H]1C(=O)O Amb24078777 [1,0,0,1,0,0|2,0,0]=4 2648 B9R1.41 N[C@@H]1COC[C@@H]1C(=O)O Amb33330248 [1,0,0,1,0,0|2,0,0]=4 2649 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O Amb20241298 [1,0,0,1,0,0|1,0,0]=3 2650 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O Amb22224860 [1,0,0,1,0,0|1,0,0]=3 2651 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O Amb1993719 [1,0,0,1,0,0|1,0,0]=3 2652 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O Amb1993764 [1,0,0,1,0,0|1,0,0]=3 2653 B9R1.41 N[C@H]1CCN[C@@H]1C(=O)O Amb27460833 [1,0,0,1,0,0|2,0,0]=4 2654 B9R1.41 N[C@H]1CCN[C@H]1C(=O)O Amb26904835 [1,0,0,1,0,0|2,0,0]=4 2655 B9R1.41 N[C@H]1CNC[C@@H]1C(=O)O Amb27880509 [1,0,0,1,0,0|2,0,0]=4 2656 B9R1.41 N[C@H]1COC[C@@H]1C(=O)O Amb24605467 [1,0,0,1,0,0|2,0,0]=4 2657 B9R1.41 N[C@H]1CSC[C@H]1C(=O)O Amb25980819 [1,0,0,1,0,0|2,0,0]=4 2658 B9R1.41 O=C(Cl)C1CCCC1O Amb24524192 [1,0,0,1,0,0|2,0,0]=4 2659 B9R1.41 O=C(Cl)[C@@H]1CCC[C@@H]1O Amb27475951 [1,0,0,1,0,0|2,0,0]=4 2660 B9R1.41 O=C(O)C1CCCC1=O Amb18642571 [1,0,0,1,0,0|1,0,1]=4 2661 B9R1.41 O=C(O)C1CCCC1O Amb19148040 [1,0,0,1,0,0|1,0,0]=3 2662 B9R1.41 O=C(O)C1CCCC1S Amb18280971 [1,0,0,1,0,0|1,0,0]=3 2663 B9R1.41 O=C(O)C1CNCC1F Amb26864070 [1,0,0,1,0,0|2,0,0]=4 2664 B9R1.41 O=C(O)C1CNCC1F Amb33496211 [1,0,0,1,0,0|2,0,0]=4 2665 B9R1.41 O=C(O)C1CNCC1O Amb22886381 [1,0,0,1,0,0|2,0,0]=4 2666 B9R1.41 O=C(O)C1CNCC1O Amb26026738 [1,0,0,1,0,0|2,0,0]=4 2667 B9R1.41 O=C(O)C1COCC1O Amb27270738 [1,0,0,1,0,0|2,0,0]=4 2668 B9R1.41 O=C(O)C1CSCC1O Amb18831363 [1,0,0,1,0,0|2,0,0]=4 2669 B9R1.41 O=C(O)C1NCCC1F Amb25772909 [1,0,0,1,0,0|2,0,0]=4 2670 B9R1.41 O=C(O)C1NCCC1O Amb22387784 [1,0,0,1,0,0|2,0,0]=4 2671 B9R1.41 O=C(O)C1NCC[C@@H]1O Amb34913313 [1,0,0,1,0,0|2,0,0]=4 2672 B9R1.41 O=C(O)C1SCCC1F Amb27201981 [1,0,0,1,0,0|2,0,0]=4 2673 B9R1.41 O=C(O)[C@@H]1CNC[C@@H]1O Amb27186915 [1,0,0,1,0,0|2,0,0]=4 2674 B9R1.41 O=C(O)[C@@H]1CNC[C@H]1O Amb24120417 [1,0,0,1,0,0|2,0,0]=4 2675 B9R1.41 O=C(O)[C@@H]1NCCC1F Amb30988050 [1,0,0,1,0,0|2,0,0]=4 2676 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1F Amb26904377 [1,0,0,1,0,0|2,0,0]=4 2677 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O Amb22230426 [1,0,0,1,0,0|2,0,0]=4 2678 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O Amb33801217 [1,0,0,1,0,0|2,0,0]=4 2679 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O Amb33801367 [1,0,0,1,0,0|2,0,0]=4 2680 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1F Amb26891987 [1,0,0,1,0,0|2,0,0]=4 2681 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1F Amb30988051 [1,0,0,1,0,0|2,0,0]=4 2682 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O Amb22746713 [1,0,0,1,0,0|2,0,0]=4 2683 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O Amb24183557 [1,0,0,1,0,0|2,0,0]=4 2684 B9R1.41 O=C(O)[C@H]1CCC[C@@H]1O Amb27437088 [1,0,0,1,0,0|1,0,0]=3 2685 B9R1.41 O=C(O)[C@H]1CCC[C@H]1O Amb22747315 [1,0,0,1,0,0|1,0,0]=3 2686 B9R1.41 O=C(O)[C@H]1CNC[C@@H]1O Amb27421639 [1,0,0,1,0,0|2,0,0]=4 2687 B9R1.41 O=C(O)[C@H]1CNC[C@H]1O Amb27818119 [1,0,0,1,0,0|2,0,0]=4 2688 B9R1.41 O=C(O)[C@H]1NCCC1O Amb10604192 [1,0,0,1,0,0|2,0,0]=4 2689 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1Cl Amb27618755 [1,0,0,1,0,0|2,0,0]=4 2690 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O Amb24055327 [1,0,0,1,0,0|2,0,0]=4 2691 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O Amb34154004 [1,0,0,1,0,0|2,0,0]=4 2692 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O Amb8515204 [1,0,0,1,0,0|2,0,0]=4 2693 B9R1.41 O=C(O)[C@H]1NCC[C@H]1Br Amb27232994 [1,0,0,1,0,0|2,0,0]=4 2694 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O Amb22746928 [1,0,0,1,0,0|2,0,0]=4 2695 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O Amb23439285 [1,0,0,1,0,0|2,0,0]=4 2696 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O Amb24183503 [1,0,0,1,0,0|2,0,0]=4 2697 B9R1.41 O=C(O)[C@H]1NCC[C@H]1S Amb27421961 [1,0,0,1,0,0|2,0,0]=4 2698 B9R1.55 CC(O)C1CC(C)C1C Amb27174537 [1,0,0,1,0,0|1,0,1]=4 2699 B9R1.55 CC1CC(C(=O)Cl)N1C Amb27594214 [1,0,0,1,0,0|2,0,0]=4 2700 B9R1.55 CC1CC(C(=O)O)N1C Amb28285280 [1,0,0,1,0,0|1,0,0]=3 2701 B9R1.55 C[C@@H]1C[C@@H](C(=O)Cl)N1C Amb25336470 [1,0,0,1,0,0|2,0,0]=4 2702 B9R1.55 C[C@@H]1C[C@H](C(=O)Cl)N1C Amb27654275 [1,0,0,1,0,0|2,0,0]=4 2703 B9R1.55 C[C@H]1CC(C(=O)O)[C@@H]1C Amb28132441 [1,0,0,1,0,0|0,0,0]=2 2704 B9R1.55 C[C@H]1C[C@@H](C(=O)Cl)N1C Amb27858264 [1,0,0,1,0,0|2,0,0]=4 2705 B9R1.55 N[C@H]1[C@@H](C(=O)O)C[C@H]1O Amb27848566 [1,0,0,1,0,0|2,0,0]=4 2706 B9R1.90 CCC1C(=O)CC1OC Amb27838695 [1,0,0,1,0,0|2,0,0]=4 2707 B9R1.90 CCC1C(=O)NC1CO Amb27445041 [1,0,0,1,0,0|2,0,0]=4 2708 B9R1.90 CCC1NC(=O)C1CC Amb22364987 [1,0,0,1,0,0|1,0,0]=3 2709 B9R1.90 CC[C@@H]1C(=O)N[C@H]1SC Amb27636377 [1,0,0,1,0,0|2,0,0]=4 2710 B9R1.90 CC[C@@H]1NC(=O)[C@@H]1CC Amb28325086 [1,0,0,1,0,0|1,0,0]=3 2711 B9R1.90 CC[C@@H]1NC(=O)[C@H]1CC Amb27458919 [1,0,0,1,0,0|1,0,0]=3 2712 B9R1.90 CC[C@H]1C(=O)N[C@@H]1OC Amb28195391 [1,0,0,1,0,0|2,0,0]=4 2713 B9R1.90 CC[C@H]1C(=O)N[C@H]1CO Amb27222345 [1,0,0,1,0,0|2,0,0]=4 2714 B9R1.96 CCC1CCC1C(=O)O Amb25727014 [1,0,0,1,0,0|0,0,0]=2 2715 B9R1.96 CCC1CN[C@@H]1C(=O)O Amb30633665 [1,0,0,1,0,0|1,0,0]=3 2716 B9R1.96 CCN1CCC1C(=O)O Amb22011877 [1,0,0,1,0,0|1,0,0]=3 2717 B9R1.96 CCN1CC[C@@H]1C(=O)O Amb24634744 [1,0,0,1,0,0|1,0,0]=3 2718 B9R1.96 CCN1CC[C@H]1C(=O)O Amb25347394 [1,0,0,1,0,0|1,0,0]=3 2719 B9R1.96 COC1CCC1C(=O)O Amb26516125 [1,0,0,1,0,0|1,0,0]=3 2720 B9R1.96 COC1CCC1C(N)=O Amb27645560 [1,0,0,1,0,0|2,0,0]=4 2721 B9R1.96 CO[C@@H]1CC[C@@H]1C(=O)O Amb34912847 [1,0,0,1,0,0|1,0,0]=3 2722 B9R1.96 CO[C@@H]1CC[C@H]1C(=O)O Amb26636288 [1,0,0,1,0,0|1,0,0]=3 2723 B9R1.96 N#CC1CCC1C(=O)O Amb26949285 [1,0,0,1,0,0|1,0,1]=4 2724 B9R1.96 NC[C@@H]1CC[C@H]1C(=O)O Amb27259838 [1,0,0,1,0,0|1,0,0]=3 2725 B9R1.96 NC[C@H]1CC[C@@H]1C(N)=O Amb27966233 [1,0,0,1,0,0|2,0,0]=4 2726 B9R1.96 O=C(O)C1CCC1CF Amb20667674 [1,0,0,1,0,0|1,0,0]=3 2727 B9R1.96 O=C(O)C1CCC1CO Amb24340315 [1,0,0,1,0,0|1,0,0]=3 2728 B9R1.96 O=C(O)N1CCC1CO Amb22756926 [1,0,0,1,0,0|2,0,0]=4 2729 B9R1.116 CCC(C(=O)O)C1CC1 Amb18832627 [1,0,0,1,0,0|0,0,0]=2 2730 B9R1.116 CCN(C(=O)Cl)C1CC1 Amb32863827 [1,0,0,1,0,0|2,0,0]=4 2731 B9R1.116 CNC(C(=O)O)C1CC1 Amb18975569 [1,0,0,1,0,0|1,0,0]=3 2732 B9R1.116 CNC(C(N)=O)C1CC1 Amb18975566 [1,0,0,1,0,0|2,0,0]=4 2733 B9R1.116 COC(C(=O)O)C1CC1 Amb24524177 [1,0,0,1,0,0|1,0,0]=3 2734 B9R1.116 COC(C(C)=O)C1CC1 Amb27235075 [1,0,0,1,0,0|2,0,0]=4 2735 B9R1.116 COC(C(N)=O)C1CC1 Amb27257225 [1,0,0,1,0,0|2,0,0]=4 2736 B9R1.116 NCC(C(=O)O)C1CC1 Amb26482230 [1,0,0,1,0,0|1,0,0]=3 2737 B9R1.116 NCC(C(N)=O)C1CC1 Amb27642892 [1,0,0,1,0,0|2,0,0]=4 2738 B9R1.116 NOC(C(=O)O)C1CC1 Amb26560827 [1,0,0,1,0,0|2,0,0]=4 2739 B9R1.116 NOC(C(=O)O)C1CC1 Amb32655968 [1,0,0,1,0,0|2,0,0]=4 2740 B9R1.116 O=C(O)C(CF)C1CC1 Amb27816769 [1,0,0,1,0,0|1,0,0]=3 2741 B9R1.116 O=C(O)C(NO)C1CC1 Amb27410795 [1,0,0,1,0,0|2,0,0]=4 2742 B9R1.119 C#CC1(C(=O)O)CCC1 Amb25975068 [1,0,0,1,0,0|0,0,2]=4 2743 B9R1.119 C=CC1(C(=O)O)CCC1 Amb25112500 [1,0,0,1,0,0|0,0,2]=4 2744 B9R1.119 CC(=O)C1(CN)CCC1 Amb25984648 [1,0,0,1,0,0|2,0,0]=4 2745 B9R1.119 CCC1(C(=N)N)CCC1 Amb33423510 [1,0,0,1,0,0|2,0,0]=4 2746 B9R1.119 CCC1(C(=O)O)C=CC1 Amb27664148 [1,0,0,1,0,0|0,0,2]=4 2747 B9R1.119 CCC1(C(=O)O)CCC1 Amb20622799 [1,0,0,1,0,0|0,0,0]=2 2748 B9R1.119 CCC1(C(=O)O)CCO1 Amb25073494 [1,0,0,1,0,0|1,0,0]=3 2749 B9R1.119 CCC1(C(=O)O)CNC1 Amb25250552 [1,0,0,1,0,0|1,0,0]=3 2750 B9R1.119 CCC1(C(=O)O)COC1 Amb16233482 [1,0,0,1,0,0|1,0,0]=3 2751 B9R1.119 CCC1(C(=O)O)CSC1 Amb27192075 [1,0,0,1,0,0|1,0,0]=3 2752 B9R1.119 CCC1(C(C)=O)CCC1 Amb33275008 [1,0,0,1,0,0|1,0,0]=3 2753 B9R1.119 CCC1(C(C)=O)CNC1 Amb33307015 [1,0,0,1,0,0|2,0,0]=4 2754 B9R1.119 CCC1(C(C)=O)COC1 Amb25675461 [1,0,0,1,0,0|2,0,0]=4 2755 B9R1.119 CCC1(C(N)=S)CCC1 Amb33423686 [1,0,0,1,0,0|1,1,0]=4 2756 B9R1.119 CCC1([C@@H](C)O)CCC1 Amb33273626 [1,0,0,1,0,0|1,0,1]=4 2757 B9R1.119 CCC1([C@H](C)O)CCC1 Amb33273770 [1,0,0,1,0,0|1,0,1]=4 2758 B9R1.119 CC[C@@]1(C(=O)O)CCN1 Amb27392754 [1,0,0,1,0,0|1,0,0]=3 2759 B9R1.119 CNC1(C(=O)O)CCC1 Amb18285791 [1,0,0,1,0,0|1,0,0]=3 2760 B9R1.119 CNC1(C(=O)O)CCC1 Amb28895922 [1,0,0,1,0,0|1,0,0]=3 2761 B9R1.119 CNC1(C(=O)O)COC1 Amb25888932 [1,0,0,1,0,0|2,0,0]=4 2762 B9R1.119 CNC1(C(=O)O)COC1 Amb33295337 [1,0,0,1,0,0|2,0,0]=4 2763 B9R1.119 CNC1(C(C)=O)CCC1 Amb25694506 [1,0,0,1,0,0|2,0,0]=4 2764 B9R1.119 CNC1(C(N)=O)CCC1 Amb18523737 [1,0,0,1,0,0|2,0,0]=4 2765 B9R1.119 COC1(C(=O)Cl)CCC1 Amb24056452 [1,0,0,1,0,0|2,0,0]=4 2766 B9R1.119 COC1(C(=O)O)CCC1 Amb23596685 [1,0,0,1,0,0|1,0,0]=3 2767 B9R1.119 COC1(C(=O)O)CNC1 Amb22737546 [1,0,0,1,0,0|2,0,0]=4 2768 B9R1.119 COC1(C(=O)O)CNC1 Amb27217798 [1,0,0,1,0,0|2,0,0]=4 2769 B9R1.119 COC1(C(=O)O)CSC1 Amb27253480 [1,0,0,1,0,0|2,0,0]=4 2770 B9R1.119 COC1(C(C)=O)CCC1 Amb26658063 [1,0,0,1,0,0|2,0,0]=4 2771 B9R1.119 CSC1(C(=O)O)CCC1 Amb25721376 [1,0,0,1,0,0|1,0,0]=3 2772 B9R1.119 N#CC1(C(=O)O)CCC1 Amb9677773 [1,0,0,1,0,0|1,0,1]=4 2773 B9R1.119 NC(=O)C1(CO)CCC1 Amb10608145 [1,0,0,1,0,0|2,0,0]=4 2774 B9R1.119 NCC1(C(=O)O)CCC1 Amb18284930 [1,0,0,1,0,0|1,0,0]=3 2775 B9R1.119 NCC1(C(=O)O)CCC1 Amb22371111 [1,0,0,1,0,0|1,0,0]=3 2776 B9R1.119 NCC1(C(=O)O)COC1 Amb33804840 [1,0,0,1,0,0|2,0,0]=4 2777 B9R1.119 NCC1(C(N)=O)CCC1 Amb18908293 [1,0,0,1,0,0|2,0,0]=4 2778 B9R1.119 O=C(O)C1(CBr)CCC1 Amb26332547 [1,0,0,1,0,0|1,0,0]=3 2779 B9R1.119 O=C(O)C1(CBr)COC1 Amb26916740 [1,0,0,1,0,0|2,0,0]=4 2780 B9R1.119 O=C(O)C1(CF)CCC1 Amb26609390 [1,0,0,1,0,0|1,0,0]=3 2781 B9R1.119 O=C(O)C1(CF)CNC1 Amb34158350 [1,0,0,1,0,0|2,0,0]=4 2782 B9R1.119 O=C(O)C1(CF)COC1 Amb25212429 [1,0,0,1,0,0|2,0,0]=4 2783 B9R1.119 O=C(O)C1(CI)CCC1 Amb27436444 [1,0,0,1,0,0|1,0,0]=3 2784 B9R1.119 O=C(O)C1(CO)CCC1 Amb20248637 [1,0,0,1,0,0|1,0,0]=3 2785 B9R1.119 O=C(O)C1(CO)CNC1 Amb24622488 [1,0,0,1,0,0|2,0,0]=4 2786 B9R1.119 O=C(O)C1(CO)COC1 Amb20668032 [1,0,0,1,0,0|2,0,0]=4 2787 B9R1.119 O=C(O)C1(NO)CCC1 Amb28127460 [1,0,0,1,0,0|2,0,0]=4 2788 B9R1.119 O=CC1(C(=O)O)CCC1 Amb24519608 [1,0,0,1,0,0|1,0,1]=4 2789 B9R1.130 CC1CC1(C#N)C(=O)O Amb28457724 [1,0,0,1,0,0|1,0,1]=4 2790 B9R1.130 CC1CC1(CN)C(=O)O Amb24502348 [1,0,0,1,0,0|1,0,0]=3 2791 B9R1.130 CC1CC1(CN)C(=O)O Amb33747377 [1,0,0,1,0,0|1,0,0]=3 2792 B9R1.130 CC1CC1(CO)C(=O)O Amb27876946 [1,0,0,1,0,0|1,0,0]=3 2793 B9R1.130 CCC1(C(=N)N)CC1C Amb28199586 [1,0,0,1,0,0|2,0,0]=4 2794 B9R1.130 CCC1(C(=O)O)CC1F Amb27956509 [1,0,0,1,0,0|1,0,0]=3 2795 B9R1.130 CCC1(C(C)=O)OC1C Amb25242557 [1,0,0,1,0,0|2,0,0]=4 2796 B9R1.130 CC[C@@]1(C(=O)O)C[C@@H]1F Amb27631299 [1,0,0,1,0,0|1,0,0]=3 2797 B9R1.130 CC[C@@]1(C(=O)O)C[C@H]1F Amb27879637 [1,0,0,1,0,0|1,0,0]=3 2798 B9R1.130 CC[C@@]1(C(C)=O)O[C@H]1C Amb27427845 [1,0,0,1,0,0|2,0,0]=4 2799 B9R1.130 CC[C@]1(C(=O)O)C[C@H]1F Amb25082106 [1,0,0,1,0,0|1,0,0]=3 2800 B9R1.130 CN[C@]1(C(=O)O)C[C@H]1C Amb28347002 [1,0,0,1,0,0|1,0,0]=3 2801 B9R1.130 CSC1(C(=O)O)CC1C Amb24540432 [1,0,0,1,0,0|1,0,0]=3 2802 B9R1.130 C[C@@H]1C[C@@]1(CN)C(=O)O Amb33734028 [1,0,0,1,0,0|1,0,0]=3 2803 B9R1.130 C[C@@H]1C[C@@]1(CN)C(=O)O Amb33742278 [1,0,0,1,0,0|1,0,0]=3 2804 B9R1.154 CCCC1C(=O)CC1C Amb27838721 [1,0,0,1,0,0|1,0,0]=3 2805 B9R1.154 CCC[C@@H]1C(=O)C[C@H]1C Amb27261959 [1,0,0,1,0,0|1,0,0]=3 2806 B9R1.154 CCOC1C(=O)CC1C Amb27838667 [1,0,0,1,0,0|2,0,0]=4 2807 B9R1.179 C#CCC1(C(=O)O)CC1 Amb27436433 [1,0,0,1,0,0|0,0,2]=4 2808 B9R1.179 C=CCC1(C(=O)O)CC1 Amb16230762 [1,0,0,1,0,0|0,0,2]=4 2809 B9R1.179 CC(=O)C1(CCF)CC1 Amb25889537 [1,0,0,1,0,0|2,0,0]=4 2810 B9R1.179 CC(=O)C1(CCO)CC1 Amb27969719 [1,0,0,1,0,0|2,0,0]=4 2811 B9R1.179 CCCC1(C(=O)Cl)CC1 Amb28366564 [1,0,0,1,0,0|1,0,0]=3 2812 B9R1.179 CCCC1(C(=O)O)CC1 Amb18062273 [1,0,0,1,0,0|0,0,0]=2 2813 B9R1.179 CCCC1(C(C)=O)CC1 Amb18062173 [1,0,0,1,0,0|1,0,0]=3 2814 B9R1.179 CCCC1(C(C)O)CC1 Amb25889630 [1,0,0,1,0,0|1,0,1]=4 2815 B9R1.179 CCNC1(C(=O)O)CC1 Amb27962756 [1,0,0,1,0,0|1,0,0]=3 2816 B9R1.179 CCOC1(C(=O)Cl)CC1 Amb28054832 [1,0,0,1,0,0|2,0,0]=4 2817 B9R1.179 CCOC1(C(=O)O)CC1 Amb25921160 [1,0,0,1,0,0|1,0,0]=3 2818 B9R1.179 CCSC1(C(=O)O)CC1 Amb26976150 [1,0,0,1,0,0|1,0,0]=3 2819 B9R1.179 COCC1(C(=O)O)CC1 Amb10608153 [1,0,0,1,0,0|1,0,0]=3 2820 B9R1.179 COCC1(C(C)=O)CC1 Amb33428662 [1,0,0,1,0,0|2,0,0]=4 2821 B9R1.179 CSCC1(C(=O)O)CC1 Amb25195907 [1,0,0,1,0,0|1,0,0]=3 2822 B9R1.179 CSCC1(C(C)=O)CC1 Amb33271703 [1,0,0,1,0,0|2,0,0]=4 2823 B9R1.179 NC(=O)C1(CCF)CC1 Amb27455977 [1,0,0,1,0,0|2,0,0]=4 2824 B9R1.179 NCCC1(C(=O)O)CC1 Amb20668330 [1,0,0,1,0,0|1,0,0]=3 2825 B9R1.179 NCCC1(C(=O)O)CC1 Amb2694937 [1,0,0,1,0,0|1,0,0]=3 2826 B9R1.179 O=C(O)C1(CCCl)CC1 Amb26370639 [1,0,0,1,0,0|1,0,0]=3 2827 B9R1.179 O=C(O)C1(CCF)CC1 Amb24751115 [1,0,0,1,0,0|1,0,0]=3 2828 B9R1.179 O=C(O)C1(CCO)CC1 Amb27648466 [1,0,0,1,0,0|1,0,0]=3 2829 B9R1.179 O=C(O)C1(CCS)CC1 Amb27453929 [1,0,0,1,0,0|1,0,0]=3 2830 B9R1.2 C#CC1CCCC(C)C1 Amb27440120 [1,0,0,1,0,0|1,0,1]=4 2831 B9R1.2 C=CC1CCCC(C)N1 Amb27630668 [1,0,0,1,0,0|2,0,0]=4 2832 B9R1.2 C=CC1CCCC(N)C1 Amb26996279 [1,0,0,1,0,0|2,0,0]=4 2833 B9R1.2 C=CC1CCCC(O)C1 Amb25846990 [1,0,0,1,0,0|2,0,0]=4 2834 B9R1.2 C=CC1CCCN(C)C1 Amb30526904 [1,0,0,1,0,0|2,0,0]=4 2835 B9R1.2 C=C[C@@H]1CCC[C@@H](N)C1 Amb27220130 [1,0,0,1,0,0|2,0,0]=4 2836 B9R1.2 C=C[C@@H]1CCC[C@@H](N)C1 Amb31251611 [1,0,0,1,0,0|2,0,0]=4 2837 B9R1.2 C=C[C@@H]1CCC[C@H](O)C1 Amb27631254 [1,0,0,1,0,0|2,0,0]=4 2838 B9R1.2 C=C[C@H]1CCC[C@@H](O)C1 Amb25205028 [1,0,0,1,0,0|2,0,0]=4 2839 B9R1.2 C=C[C@H]1CCC[C@H](C)N1 Amb26419074 [1,0,0,1,0,0|2,0,0]=4 2840 B9R1.2 CC1C=C(C=O)CCC1 Amb4035517 [1,0,0,1,0,0|0,0,2]=4 2841 B9R1.2 CC1CC(C=O)CCO1 Amb18642617 [1,0,0,1,0,0|1,0,0]=3 2842 B9R1.2 CC1CC(CO)CCN1 Amb25921106 [1,0,0,1,0,0|1,0,1]=4 2843 B9R1.2 CC1CC(CO)CCN1 Amb32653256 [1,0,0,1,0,0|1,0,1]=4 2844 B9R1.2 CC1CC(CO)CCO1 Amb24679585 [1,0,0,1,0,0|1,0,1]=4 2845 B9R1.2 CC1CC(NO)CCN1 Amb35734323 [1,0,0,1,0,0|2,0,0]=4 2846 B9R1.2 CC1CCCC(C#N)C1 Amb8950073 [1,0,0,1,0,0|1,0,1]=4 2847 B9R1.2 CC1CCCC(C=O)C1 Amb22059519 [1,0,0,1,0,0|0,0,0]=2 2848 B9R1.2 CC1CCCC(C=O)O1 Amb27956485 [1,0,0,1,0,0|1,0,0]=3 2849 B9R1.2 CC1CCCC(CBr)C1 Amb22059638 [1,0,0,1,0,0|1,0,1]=4 2850 B9R1.2 CC1CCCC(CCl)C1 Amb27664585 [1,0,0,1,0,0|1,0,1]=4 2851 B9R1.2 CC1CCCC(CI)C1 Amb28128033 [1,0,0,1,0,0|1,0,1]=4 2852 B9R1.2 CC1CCCC(CN)C1 Amb8950171 [1,0,0,1,0,0|1,0,1]=4 2853 B9R1.2 CC1CCCC(CO)C1 Amb20248640 [1,0,0,1,0,0|0,0,1]=3 2854 B9R1.2 CC1CCCC(CO)N1 Amb20090381 [1,0,0,1,0,0|1,0,1]=4 2855 B9R1.2 CC1CCCC(CS)C1 Amb26505263 [1,0,0,1,0,0|0,1,1]=4 2856 B9R1.2 CC1CCCC(NN)C1 Amb10610509 [1,0,0,1,0,0|2,0,0]=4 2857 B9R1.2 CC1CCCC(NN)C1 Amb28990931 [1,0,0,1,0,0|2,0,0]=4 2858 B9R1.2 CC1CCCC(NN)C1 Amb6246756 [1,0,0,1,0,0|2,0,0]=4 2859 B9R1.2 CC1CCCC(NO)C1 Amb27436769 [1,0,0,1,0,0|1,0,0]=3 2860 B9R1.2 CC1CCCN(N=O)C1 Amb27266128 [1,0,0,1,0,0|2,0,0]=4 2861 B9R1.2 CC1CCC\C(=N/O)C1 Amb27752449 [1,0,0,1,0,0|1,0,1]=4 2862 B9R1.2 CC1CCC\[N+](=C/Cl)C1 Amb27484106 [1,0,0,1,0,0|2,0,0]=4 2863 B9R1.2 CC1CCNC(CO)C1 Amb24571948 [1,0,0,1,0,0|1,0,1]=4 2864 B9R1.2 CC1CCNC(CO)C1 Amb32668395 [1,0,0,1,0,0|1,0,1]=4 2865 B9R1.2 CC1CCOC(C=O)C1 Amb25032291 [1,0,0,1,0,0|1,0,0]=3 2866 B9R1.2 CC1CN(C=O)CCN1 Amb27984457 [1,0,0,1,0,0|2,0,0]=4 2867 B9R1.2 CC1CNCC(CO)C1 Amb24554370 [1,0,0,1,0,0|1,0,1]=4 2868 B9R1.2 CC1CNCC(NO)C1 Amb30018267 [1,0,0,1,0,0|2,0,0]=4 2869 B9R1.2 CC1OCC[C@@H](C=O)O1 Amb27603449 [1,0,0,1,0,0|2,0,0]=4 2870 B9R1.2 CCC1CCCC(C)C1 Amb27267046 [1,0,0,1,0,0|1,0,1]=4 2871 B9R1.2 CN1CCCC(C=O)C1 Amb33532140 [1,0,0,1,0,0|1,0,0]=3 2872 B9R1.2 CN1CCCC(CO)C1 Amb615876 [1,0,0,1,0,0|1,0,1]=4 2873 B9R1.2 CN1CCCC(NO)C1 Amb27424634 [1,0,0,1,0,0|2,0,0]=4 2874 B9R1.2 CN1CCC[C@@H](CO)C1 Amb10068404 [1,0,0,1,0,0|1,0,1]=4 2875 B9R1.2 CN1CCC[C@H](CO)C1 Amb10068405 [1,0,0,1,0,0|1,0,1]=4 2876 B9R1.2 CN1CCOC(C=O)C1 Amb27593054 [1,0,0,1,0,0|2,0,0]=4 2877 B9R1.2 CNC1CCCC(C)C1 Amb33526835 [1,0,0,1,0,0|2,0,0]=4 2878 B9R1.2 CNC1CCCC(C)C1 Amb6892926 [1,0,0,1,0,0|2,0,0]=4 2879 B9R1.2 CN[C@@H]1CCCC(C)C1 Amb27947967 [1,0,0,1,0,0|2,0,0]=4 2880 B9R1.2 COC1CCCC(C)C1 Amb6608954 [1,0,0,1,0,0|2,0,0]=4 2881 B9R1.2 CSC1CCCC(C)C1 Amb28288627 [1,0,0,1,0,0|2,0,0]=4 2882 B9R1.2 C[C@@H]1CCCC(CO)N1 Amb27413400 [1,0,0,1,0,0|1,0,1]=4 2883 B9R1.2 C[C@@H]1CCC[C@@H](CO)O1 Amb27213296 [1,0,0,1,0,0|1,0,1]=4 2884 B9R1.2 C[C@@H]1CCC[C@H](CO)N1 Amb24647659 [1,0,0,1,0,0|1,0,1]=4 2885 B9R1.2 C[C@@H]1CCO[C@@H](CO)C1 Amb28142359 [1,0,0,1,0,0|1,0,1]=4 2886 B9R1.2 C[C@@H]1C[C@@H](C=O)CCO1 Amb27966706 [1,0,0,1,0,0|1,0,0]=3 2887 B9R1.2 C[C@@H]1C[C@@H](CO)CCO1 Amb33484246 [1,0,0,1,0,0|1,0,1]=4 2888 B9R1.2 C[C@@H]1C[C@H](C=O)OCO1 Amb28287271 [1,0,0,1,0,0|2,0,0]=4 2889 B9R1.2 C[C@@H]1C[C@H](CO)CCN1 Amb26849936 [1,0,0,1,0,0|1,0,1]=4 2890 B9R1.2 C[C@@H]1C[C@H](CO)CCN1 Amb32653271 [1,0,0,1,0,0|1,0,1]=4 2891 B9R1.2 C[C@H]1CCC[C@@H](C=O)N1 Amb27866254 [1,0,0,1,0,0|1,0,0]=3 2892 B9R1.2 C[C@H]1CCN[C@@H](CO)C1 Amb28429761 [1,0,0,1,0,0|1,0,1]=4 2893 B9R1.2 C[C@H]1CCN[C@@H](CO)C1 Amb32668515 [1,0,0,1,0,0|1,0,1]=4 2894 B9R1.2 C[C@H]1CCOC(C=O)C1 Amb26406399 [1,0,0,1,0,0|1,0,0]=3 2895 B9R1.2 C[C@H]1CCO[C@H](C=O)C1 Amb25914480 [1,0,0,1,0,0|1,0,0]=3 2896 B9R1.2 C[C@H]1C[C@@H](C=O)CCO1 Amb27194769 [1,0,0,1,0,0|1,0,0]=3 2897 B9R1.2 C[C@H]1C[C@@H](CO)CCN1 Amb24558717 [1,0,0,1,0,0|1,0,1]=4 2898 B9R1.2 C[C@H]1C[C@@H](CO)CCN1 Amb28577880 [1,0,0,1,0,0|1,0,1]=4 2899 B9R1.2 C[C@H]1C[C@H](C=O)CCO1 Amb27629806 [1,0,0,1,0,0|1,0,0]=3 2900 B9R1.2 NC1CCCC(CO)C1 Amb33532803 [1,0,0,1,0,0|1,0,1]=4 2901 B9R1.2 NC1CCCC(NO)C1 Amb28046309 [1,0,0,1,0,0|2,0,0]=4 2902 B9R1.2 N[C@@H]1CCC[C@@H](CO)C1 Amb25973785 [1,0,0,1,0,0|1,0,1]=4 2903 B9R1.2 N[C@@H]1CCC[C@H](CO)C1 Amb27791190 [1,0,0,1,0,0|1,0,1]=4 2904 B9R1.2 N[C@H]1CCC[C@@H](CO)C1 Amb23385323 [1,0,0,1,0,0|1,0,1]=4 2905 B9R1.2 N[C@H]1CCC[C@@H](CO)C1 Amb30526953 [1,0,0,1,0,0|1,0,1]=4 2906 B9R1.2 N[C@H]1CCC[C@H](CO)C1 Amb28399575 [1,0,0,1,0,0|1,0,1]=4 2907 B9R1.2 O=CC1CCCC(Cl)C1 Amb28456028 [1,0,0,1,0,0|1,0,0]=3 2908 B9R1.2 O=CC1CCCC(F)C1 Amb24541768 [1,0,0,1,0,0|1,0,0]=3 2909 B9R1.2 O=CC1CCCS(=O)C1 Amb27767985 [1,0,0,1,0,0|2,0,0]=4 2910 B9R1.2 O=CC1CCNC(Br)C1 Amb8629163 [1,0,0,1,0,0|2,0,0]=4 2911 B9R1.2 O=CN1CCCC(F)C1 Amb29876084 [1,0,0,1,0,0|2,0,0]=4 2912 B9R1.2 O=CN1CCCC(O)C1 Amb27401500 [1,0,0,1,0,0|2,0,0]=4 2913 B9R1.2 OCC1CCCC(F)C1 Amb24518717 [1,0,0,1,0,0|1,0,1]=4 2914 B9R1.2 OC[C@@H]1CCC[C@@H](O)C1 Amb28076813 [1,0,0,1,0,0|1,0,1]=4 2915 B9R1.2 OC[C@@H]1CCC[C@H](O)C1 Amb28344623 [1,0,0,1,0,0|1,0,1]=4 2916 B9R1.2 OC[C@H]1CCC[C@@H](O)C1 Amb26435184 [1,0,0,1,0,0|1,0,1]=4 2917 B9R1.7 CC1CC(CCN)CO1 Amb35686630 [1,0,0,1,0,0|1,0,1]=4 2918 B9R1.7 CCCC1COC(O)C1 Amb28315446 [1,0,0,1,0,0|1,0,1]=4 2919 B9R1.7 CCC[C@H]1COC(O)C1 Amb28315422 [1,0,0,1,0,0|1,0,1]=4 2920 B9R1.7 CCNC1COC(C)C1 Amb30011413 [1,0,0,1,0,0|1,0,1]=4 2921 B9R1.8 BrCCC1=COCCC1 Amb33335769 [1,0,0,1,0,0|1,0,1]=4 2922 B9R1.8 BrCCC1CCCOC1 Amb33546512 [1,0,0,1,0,0|1,0,1]=4 2923 B9R1.8 CCCC1C=CCCC1 Amb27644637 [1,0,0,1,0,0|1,0,0]=3 2924 B9R1.8 CCCC1CCCCC1 Amb22336542 [1,0,0,1,0,0|1,0,1]=4 2925 B9R1.8 CCCC1CCCCN1 Amb2235347 [1,0,0,1,0,0|2,0,0]=4 2926 B9R1.8 CCCC1CCCCN1 Amb33549801 [1,0,0,1,0,0|2,0,0]=4 2927 B9R1.8 CCCC1CCCNC1 Amb18285007 [1,0,0,1,0,0|1,0,1]=4 2928 B9R1.8 CCCC1CCCNC1 Amb33551237 [1,0,0,1,0,0|1,0,1]=4 2929 B9R1.8 CCCC1COCCN1 Amb10607878 [1,0,0,1,0,0|1,0,1]=4 2930 B9R1.8 CCCN1CCCOC1 Amb27628068 [1,0,0,1,0,0|1,0,1]=4 2931 B9R1.8 CCNC1CCCOC1 Amb27837490 [1,0,0,1,0,0|1,0,1]=4 2932 B9R1.8 CCNC1CCCOC1 Amb28934972 [1,0,0,1,0,0|1,0,1]=4 2933 B9R1.8 CNCC1=COCCC1 Amb26568553 [1,0,0,1,0,0|1,0,1]=4 2934 B9R1.8 CNCC1CCCOC1 Amb18288267 [1,0,0,1,0,0|1,0,1]=4 2935 B9R1.8 CNCC1CCCOC1 Amb30869456 [1,0,0,1,0,0|1,0,1]=4 2936 B9R1.8 ClCCC1C=CCCC1 Amb17672831 [1,0,0,1,0,0|2,0,0]=4 2937 B9R1.8 NCCC1=COCCC1 Amb26588888 [1,0,0,1,0,0|1,0,1]=4 2938 B9R1.8 NCCC1C=CCCC1 Amb25707655 [1,0,0,1,0,0|2,0,0]=4 2939 B9R1.8 NCCC1CCCOC1 Amb10072965 [1,0,0,1,0,0|1,0,1]=4 2940 B9R1.8 OCCC1=COCCC1 Amb32944531 [1,0,0,1,0,0|1,0,1]=4 2941 B9R1.8 OCCC1C=CCCC1 Amb17593314 [1,0,0,1,0,0|2,0,0]=4 2942 B9R1.8 OCCC1CCCOC1 Amb33544109 [1,0,0,1,0,0|1,0,1]=4 2943 B9R1.8 SCCC1=COCCC1 Amb33319968 [1,0,0,1,0,0|1,0,1]=4 2944 B9R1.8 SCCC1CCCOC1 Amb33321789 [1,0,0,1,0,0|1,0,1]=4 2945 B9R1.14 C=C[C@@H]1CCC[C@@H]1C=O Amb28346572 [1,0,0,1,0,0|0,0,2]=4 2946 B9R1.14 C=C[C@@H]1CCC[C@H]1CO Amb28131037 [1,0,0,1,0,0|2,0,0]=4 2947 B9R1.14 CCC1CCCC1CBr Amb27955021 [1,0,0,1,0,0|1,0,1]=4 2948 B9R1.14 CCC1CCCC1CC Amb27236275 [1,0,0,1,0,0|1,0,1]=4 2949 B9R1.14 CCC1CCCC1CN Amb25145993 [1,0,0,1,0,0|1,0,1]=4 2950 B9R1.14 CCC1CCCC1CN Amb32662607 [1,0,0,1,0,0|1,0,1]=4 2951 B9R1.14 CCC1CCCC1NC Amb18282856 [1,0,0,1,0,0|2,0,0]=4 2952 B9R1.14 CCC1CNCC1CO Amb27441323 [1,0,0,1,0,0|1,0,1]=4 2953 B9R1.14 CCC1COCC1C=O Amb29882927 [1,0,0,1,0,0|1,0,0]=3 2954 B9R1.14 CCC1COCC1CO Amb35651599 [1,0,0,1,0,0|1,0,1]=4 2955 B9R1.14 CCC1COCC1NO Amb35612699 [1,0,0,1,0,0|2,0,0]=4 2956 B9R1.14 CCC1NCCC1CO Amb26643148 [1,0,0,1,0,0|1,0,1]=4 2957 B9R1.14 CCC1OCCC1CO Amb27975537 [1,0,0,1,0,0|1,0,1]=4 2958 B9R1.14 CCN1CCCC1CO Amb6537970 [1,0,0,1,0,0|1,0,1]=4 2959 B9R1.14 CCN1CCCC1CO Amb6537973 [1,0,0,1,0,0|1,0,1]=4 2960 B9R1.14 CCN1CCC[C@@H]1CO Amb24678478 [1,0,0,1,0,0|1,0,1]=4 2961 B9R1.14 CCN1CCC[C@H]1CO Amb19517075 [1,0,0,1,0,0|1,0,1]=4 2962 B9R1.14 CC[C@@H]1CCC[C@H]1CC Amb22231650 [1,0,0,1,0,0|1,0,1]=4 2963 B9R1.14 CC[C@@H]1NCC[C@@H]1CO Amb27800143 [1,0,0,1,0,0|1,0,1]=4 2964 B9R1.14 CC[C@H]1CNC[C@@H]1CO Amb33871489 [1,0,0,1,0,0|1,0,1]=4 2965 B9R1.14 COC1CCCC1CO Amb27977996 [1,0,0,1,0,0|1,0,1]=4 2966 B9R1.14 COC1CCCN1C=O Amb24078378 [1,0,0,1,0,0|2,0,0]=4 2967 B9R1.14 CO[C@@H]1CCC[C@@H]1C=O Amb28057513 [1,0,0,1,0,0|1,0,0]=3 2968 B9R1.14 CO[C@@H]1CCC[C@@H]1CO Amb27420276 [1,0,0,1,0,0|1,0,1]=4 2969 B9R1.14 CO[C@H]1CCC[C@@H]1C=O Amb27230343 [1,0,0,1,0,0|1,0,0]=3 2970 B9R1.14 N#C[C@@H]1CCC[C@H]1C=O Amb27440385 [1,0,0,1,0,0|1,0,1]=4 2971 B9R1.14 NCC1CCCC1NO Amb27630274 [1,0,0,1,0,0|2,0,0]=4 2972 B9R1.14 NCC1CCCN1C=O Amb18908290 [1,0,0,1,0,0|2,0,0]=4 2973 B9R1.14 O=CC1CCCC1C=O Amb28053995 [1,0,0,1,0,0|1,0,1]=4 2974 B9R1.14 O=CN1CCC[C@@H]1CO Amb25796504 [1,0,0,1,0,0|2,0,0]=4 2975 B9R1.14 O=CN1CCC[C@H]1CO Amb24362992 [1,0,0,1,0,0|2,0,0]=4 2976 B9R1.14 OCC1CCCC1CF Amb27185976 [1,0,0,1,0,0|1,0,1]=4 2977 B9R1.14 OCC1CCCC1CO Amb27484587 [1,0,0,1,0,0|1,0,1]=4 2978 B9R1.14 OC[C@@H]1CCC[C@H]1CO Amb28053551 [1,0,0,1,0,0|1,0,1]=4 2979 B9R1.14 OC[C@H]1CCC[C@@H]1CO Amb27783101 [1,0,0,1,0,0|1,0,1]=4 2980 B9R1.14 OC[C@H]1CCC[C@H]1CCl Amb27196244 [1,0,0,1,0,0|1,0,1]=4 2981 B9R1.14 OC[C@H]1CCC[C@H]1CO Amb28187775 [1,0,0,1,0,0|1,0,1]=4 2982 B9R1.23 CC1CC(CO)OC1C Amb27484655 [1,0,0,1,0,0|1,0,1]=4 2983 B9R1.23 CC1CC(NO)CN1C Amb27250217 [1,0,0,1,0,0|2,0,0]=4 2984 B9R1.23 CC1OC(C=O)OC1C Amb27591702 [1,0,0,1,0,0|2,0,0]=4 2985 B9R1.29 C=C[C@H]1[C@@H](CO)[C@@H]1CC Amb27427891 [1,0,0,1,0,0|2,0,0]=4 2986 B9R1.29 CC[C@H]1C(NC)[C@@H]1CC Amb27786341 [1,0,0,1,0,0|2,0,0]=4 2987 B9R1.57 CCCC1C(CO)S1=O Amb27605367 [1,0,0,1,0,0|2,0,0]=4 2988 B9R1.57 CCC[C@@H]1[C@H](CO)S1=O Amb27440847 [1,0,0,1,0,0|2,0,0]=4 2989 B9R1.89 BrCC1CCCCCC1 Amb19073228 [1,0,0,1,0,0|1,0,1]=4 2990 B9R1.89 C#CC1CCCCCC1 Amb25277452 [1,0,0,1,0,0|1,0,1]=4 2991 B9R1.89 C=CC1CCCCCC1 Amb25068667 [1,0,0,1,0,0|1,0,0]=3 2992 B9R1.89 CCC1CCCCCC1 Amb26390826 [1,0,0,1,0,0|1,0,1]=4 2993 B9R1.89 CNC1CCCCCC1 Amb1106215 [1,0,0,1,0,0|2,0,0]=4 2994 B9R1.89 CNC1CCCCCC1 Amb22587117 [1,0,0,1,0,0|2,0,0]=4 2995 B9R1.89 ClCC1CCCCCC1 Amb26317790 [1,0,0,1,0,0|1,0,1]=4 2996 B9R1.89 ICC1CCCCCC1 Amb27596090 [1,0,0,1,0,0|1,0,1]=4 2997 B9R1.89 N#CC1CCCCCC1 Amb2721571 [1,0,0,1,0,0|1,0,1]=4 2998 B9R1.89 N=CN1CCCCCC1 Amb27491659 [1,0,0,1,0,0|2,0,0]=4 2999 B9R1.89 NCC1CCCCCC1 Amb22001955 [1,0,0,1,0,0|1,0,1]=4 3000 B9R1.89 NCC1CCCCCC1 Amb8943673 [1,0,0,1,0,0|1,0,1]=4 3001 B9R1.89 NNC1CCCCCC1 Amb19373178 [1,0,0,1,0,0|2,0,0]=4 3002 B9R1.89 NNC1CCCCCC1 Amb22227928 [1,0,0,1,0,0|2,0,0]=4 3003 B9R1.89 NNC1CCCCCC1 Amb6251286 [1,0,0,1,0,0|2,0,0]=4 3004 B9R1.89 O=CC1=CCCCCC1 Amb9790320 [1,0,0,1,0,0|0,0,2]=4 3005 B9R1.89 O=CC1CCCCCC1 Amb9786985 [1,0,0,1,0,0|0,0,0]=2 3006 B9R1.89 O=CC1CCCOCC1 Amb18832626 [1,0,0,1,0,0|1,0,0]=3 3007 B9R1.89 O=CC1CCCSCC1 Amb18202390 [1,0,0,1,0,0|1,0,0]=3 3008 B9R1.89 O=CN1CCCNCC1 Amb1155085 [1,0,0,1,0,0|2,0,0]=4 3009 B9R1.89 O=NN1CCCCCC1 Amb22230749 [1,0,0,1,0,0|2,0,0]=4 3010 B9R1.89 OCC1CCCCCC1 Amb20240529 [1,0,0,1,0,0|0,0,1]=3 3011 B9R1.89 OCC1CCCCCC1 Amb34916703 [1,0,0,1,0,0|0,0,1]=3 3012 B9R1.89 OCC1CCCCCN1 Amb33551226 [1,0,0,1,0,0|1,0,1]=4 3013 B9R1.89 OCC1CCCCCN1 Amb8009310 [1,0,0,1,0,0|1,0,1]=4 3014 B9R1.89 OCC1CCCCCO1 Amb25687959 [1,0,0,1,0,0|1,0,1]=4 3015 B9R1.89 OCC1CCCCNC1 Amb19149352 [1,0,0,1,0,0|1,0,1]=4 3016 B9R1.89 OCC1CCCCNC1 Amb8630389 [1,0,0,1,0,0|1,0,1]=4 3017 B9R1.89 OCC1CCCNCC1 Amb22886282 [1,0,0,1,0,0|1,0,1]=4 3018 B9R1.89 OCC1CCCNCC1 Amb33545032 [1,0,0,1,0,0|1,0,1]=4 3019 B9R1.89 OCC1CCCOCC1 Amb18203196 [1,0,0,1,0,0|1,0,1]=4 3020 B9R1.89 OCC1CCCSCC1 Amb18202263 [1,0,0,1,0,0|1,0,1]=4 3021 B9R1.89 OC[C@@H]1CCCCCN1 Amb24117101 [1,0,0,1,0,0|1,0,1]=4 3022 B9R1.89 OC[C@@H]1CCCCNC1 Amb28315456 [1,0,0,1,0,0|1,0,1]=4 3023 B9R1.89 ON=C1CCCCCC1 Amb7969725 [1,0,0,1,0,0|1,0,1]=4 3024 B9R1.89 ONC1CCCSCC1 Amb35692798 [1,0,0,1,0,0|2,0,0]=4 3025 B9R1.89 SCC1CCCCCC1 Amb25960657 [1,0,0,1,0,0|0,1,1]=4 3026 B9R1.89 [C-]#[N+]C1CCCCCC1 Amb1981029 [1,0,0,1,0,0|2,0,0]=4 3027 B9R1.175 C#CCC1(C=O)CCC1 Amb25784149 [1,0,0,1,0,0|0,0,2]=4 3028 B9R1.175 C=CCC1(C=O)CCC1 Amb24458101 [1,0,0,1,0,0|0,0,2]=4 3029 B9R1.175 CCCC1(C#N)CCC1 Amb22059595 [1,0,0,1,0,0|1,0,1]=4 3030 B9R1.175 CCCC1(C=O)CCC1 Amb23449218 [1,0,0,1,0,0|0,0,0]=2 3031 B9R1.175 CCCC1(C=O)COC1 Amb28342336 [1,0,0,1,0,0|1,0,0]=3 3032 B9R1.175 CCCC1(CBr)CCC1 Amb24720108 [1,0,0,1,0,0|1,0,1]=4 3033 B9R1.175 CCCC1(CCl)CCC1 Amb27260652 [1,0,0,1,0,0|1,0,1]=4 3034 B9R1.175 CCCC1(CN)CCC1 Amb10607993 [1,0,0,1,0,0|1,0,1]=4 3035 B9R1.175 CCCC1(CN)CCC1 Amb20668908 [1,0,0,1,0,0|1,0,1]=4 3036 B9R1.175 CCCC1(CO)CCC1 Amb26363942 [1,0,0,1,0,0|0,0,1]=3 3037 B9R1.175 CCCC1(CS)CCC1 Amb32788272 [1,0,0,1,0,0|0,1,1]=4 3038 B9R1.175 CCNC1(CO)CCC1 Amb24460792 [1,0,0,1,0,0|1,0,1]=4 3039 B9R1.175 CCOC1(C=O)CCC1 Amb27186001 [1,0,0,1,0,0|1,0,0]=3 3040 B9R1.175 CCOC1(C=O)CNC1 Amb32939459 [1,0,0,1,0,0|2,0,0]=4 3041 B9R1.175 CCOC1(C=O)COC1 Amb32939487 [1,0,0,1,0,0|2,0,0]=4 3042 B9R1.175 CCOC1(CO)CCC1 Amb32667461 [1,0,0,1,0,0|1,0,1]=4 3043 B9R1.175 CNCC1(CO)CCC1 Amb33801438 [1,0,0,1,0,0|1,0,1]=4 3044 B9R1.175 CNCC1(CO)CCC1 Amb9902133 [1,0,0,1,0,0|1,0,1]=4 3045 B9R1.175 COCC1(C=O)CCC1 Amb24704378 [1,0,0,1,0,0|1,0,0]=3 3046 B9R1.175 COCC1(CO)CCC1 Amb23510416 [1,0,0,1,0,0|1,0,1]=4 3047 B9R1.175 CSCC1(CO)CCC1 Amb33272043 [1,0,0,1,0,0|1,0,1]=4 3048 B9R1.175 NCCC1(CO)CCC1 Amb32664868 [1,0,0,1,0,0|1,0,1]=4 3049 B9R1.175 O=CC1(CCCl)CCC1 Amb26361266 [1,0,0,1,0,0|1,0,0]=3 3050 B9R1.175 O=CC1(CCF)CCC1 Amb25162117 [1,0,0,1,0,0|1,0,0]=3 3051 B9R1.175 O=CC1(CCO)CCC1 Amb25162079 [1,0,0,1,0,0|1,0,0]=3 3052 B9R1.175 OCC1(CCF)CCC1 Amb33171729 [1,0,0,1,0,0|1,0,1]=4 3053 B9R1.175 OCCC1(CO)CCC1 Amb35789238 [1,0,0,1,0,0|1,0,1]=4 3054 B9R1.182 CCCC1(CCC)CO1 Amb8395535 [1,0,0,1,0,0|0,0,1]=3 3055 B11R1.34 CC1CC(=O)OC(CCO)C1 Amb27172357 [0,0,0,1,0,1|2,0,0]=4 3056 B11R1.34 CCCC1CC(=O)C=C(C)C1 Amb20621716 [0,0,0,1,0,1|1,0,1]=4 3057 B11R1.34 CCCC1CC(=O)CC(O)C1 Amb28381229 [0,0,0,1,0,1|2,0,0]=4 3058 B11R1.34 CCCC1CC(=O)OC(=O)C1 Amb33374804 [0,0,0,1,0,1|1,0,1]=4 3059 B11R1.34 CCCC1CC(C)OC(O)C1 Amb27858027 [0,0,0,1,0,1|0,0,2]=4 3060 B11R1.34 CCCC1CC(O)CC(=O)O1 Amb27970476 [0,0,0,1,0,1|2,0,0]=4 3061 B11R1.34 CCC[C@@H]1CC(=O)C[C@@H](C)N1 Amb27441691 [0,0,0,1,0,1|2,0,0]=4 3062 B11R1.34 CCC[C@@H]1CC(=O)C[C@H](C)N1 Amb27778509 [0,0,0,1,0,1|2,0,0]=4 3063 B11R1.34 CCC[C@@H]1C[C@@H](O)CC(=O)O1 Amb27259046 [0,0,0,1,0,1|2,0,0]=4 3064 B11R1.34 CCC[C@H]1CC(=O)C=C(C)C1 Amb533075 [0,0,0,1,0,1|1,0,1]=4 3065 B11R1.34 CCOC1CC(C)CC(=O)N1 Amb27810938 [0,0,0,1,0,1|2,0,0]=4 3066 B11R1.34 CCS[C@@H]1CC(=O)C[C@H](C)C1 Amb28253893 [0,0,0,1,0,1|2,0,0]=4 3067 B11R1.57 C=C[C@@H]1CCC[C@@H]1CC(=O)O Amb27788425 [0,0,0,1,0,1|0,0,2]=4 3068 B11R1.57 CC(=O)C[C@@H]1CCC[C@H]1CCl Amb27660210 [0,0,0,1,0,1|2,0,0]=4 3069 B11R1.57 CC(=O)NC1CCCC1CCl Amb27235337 [0,0,0,1,0,1|2,0,0]=4 3070 B11R1.57 CC(=O)NC1CCCC1CO Amb28044186 [0,0,0,1,0,1|2,0,0]=4 3071 B11R1.57 CCC1CCCC1NC(=O)Cl Amb35633526 [0,0,0,1,0,1|1,0,0]=3 3072 B11R1.57 CCC1CNCC1CC(=O)O Amb28198977 [0,0,0,1,0,1|1,0,0]=3 3073 B11R1.57 CCC1COCC1CC(=O)O Amb35631919 [0,0,0,1,0,1|1,0,0]=3 3074 B11R1.57 CCC1COCC1NC(=O)Cl Amb35636914 [0,0,0,1,0,1|2,0,0]=4 3075 B11R1.57 CCC1COCC1NC(C)=O Amb35617073 [0,0,0,1,0,1|2,0,0]=4 3076 B11R1.57 CCC1COCC1NC(N)=O Amb35617112 [0,0,0,1,0,1|2,0,0]=4 3077 B11R1.57 CCC1COC\C1=C/C(=O)O Amb35631904 [0,0,0,1,0,1|1,0,1]=4 3078 B11R1.57 CCN1CCCC1CC(=O)O Amb17504530 [0,0,0,1,0,1|1,0,0]=3 3079 B11R1.57 CCN1CCCC1CC(=O)O Amb33550833 [0,0,0,1,0,1|1,0,0]=3 3080 B11R1.57 CC[C@@H]1NCC[C@H]1CC(=O)O Amb18199980 [0,0,0,1,0,1|1,0,0]=3 3081 B11R1.57 CC[C@H]1NCC[C@@H]1CC(=O)O Amb28429151 [0,0,0,1,0,1|1,0,0]=3 3082 B11R1.57 CN[C@@H]1CCC[C@H]1NC(C)=O Amb28052128 [0,0,0,1,0,1|2,0,0]=4 3083 B11R1.57 COC1CCCC1CC(=O)O Amb18199909 [0,0,0,1,0,1|1,0,0]=3 3084 B11R1.57 COC1CCCC1NC(=O)Cl Amb35625873 [0,0,0,1,0,1|2,0,0]=4 3085 B11R1.57 COC1CCCC1NC(N)=O Amb18799940 [0,0,0,1,0,1|2,0,0]=4 3086 B11R1.57 CO[C@@H]1CCC[C@H]1NC(C)=O Amb27598363 [0,0,0,1,0,1|2,0,0]=4 3087 B11R1.57 CO[C@@H]1CCC[C@H]1NC(N)=O Amb28182684 [0,0,0,1,0,1|2,0,0]=4 3088 B11R1.57 CO[C@@H]1CCC[C@H]1OC(=O)Cl Amb33297184 [0,0,0,1,0,1|2,0,0]=4 3089 B11R1.57 CO[C@H]1CCC[C@@H]1NC(N)=O Amb28461097 [0,0,0,1,0,1|2,0,0]=4 3090 B11R1.57 CSC1CCCC1NC(=O)Cl Amb35633373 [0,0,0,1,0,1|2,0,0]=4 3091 B11R1.57 CSC1CCCC1NC(C)=O Amb27469729 [0,0,0,1,0,1|2,0,0]=4 3092 B11R1.57 CS[C@@H]1CCC[C@H]1NC(C)=O Amb27783376 [0,0,0,1,0,1|2,0,0]=4 3093 B11R1.57 N#CC1CCCC1CC(=O)O Amb18201141 [0,0,0,1,0,1|1,0,1]=4 3094 B11R1.57 NCC1CCCC1NC(N)=O Amb18287965 [0,0,0,1,0,1|2,0,0]=4 3095 B11R1.57 NCC1CCCN1CC(=O)O Amb26998361 [0,0,0,1,0,1|2,0,0]=4 3096 B11R1.57 NC[C@@H]1CCCN1CC(=O)O Amb24737565 [0,0,0,1,0,1|2,0,0]=4 3097 B11R1.57 NC[C@@H]1CCC[C@H]1CC(=O)O Amb27967366 [0,0,0,1,0,1|1,0,0]=3 3098 B11R1.57 NC[C@H]1CCCN1CC(=O)O Amb25314232 [0,0,0,1,0,1|2,0,0]=4 3099 B11R1.57 O=C(O)CN1CCCC1CO Amb18984550 [0,0,0,1,0,1|2,0,0]=4 3100 B11R1.57 O=C(O)CN1CCC[C@H]1CO Amb10067045 [0,0,0,1,0,1|2,0,0]=4 3101 B11R1.80 CC1=C(C)CC(CC(=O)O)C1 Amb25361000 [0,0,0,1,0,1|0,0,2]=4 3102 B11R1.80 CC1CN(CC(=O)O)CC1N Amb27260836 [0,0,0,1,0,1|2,0,0]=4 3103 B11R1.80 CC1CN(CC(=O)O)CC1O Amb28138165 [0,0,0,1,0,1|2,0,0]=4 3104 B11R1.110 CCCC1CCCCC(=O)N1 Amb2229640 [0,0,0,1,0,1|1,0,0]=3 3105 B11R1.110 CCCN1CCCNC(=O)C1 Amb27176452 [0,0,0,1,0,1|2,0,0]=4 3106 B11R1.110 CCC[C@@H]1CCC=CC(=O)N1 Amb27960353 [0,0,0,1,0,1|1,0,1]=4 3107 B11R1.110 CCC[C@@H]1CCCSC(N)=N1 Amb27778552 [0,0,0,1,0,1|1,1,0]=4 3108 B11R1.110 CCC[C@@H]1CSCCC(=O)N1 Amb27169108 [0,0,0,1,0,1|2,0,0]=4 3109 B11R1.110 COCC1CCCCC(=O)C1 Amb27246950 [0,0,0,1,0,1|2,0,0]=4 3110 B11R1.110 NCCC1CCCCC(=O)N1 Amb19515432 [0,0,0,1,0,1|2,0,0]=4 3111 B11R1.110 NCCC1CCCNC(=O)C1 Amb27468807 [0,0,0,1,0,1|2,0,0]=4 3112 B11R1.110 O=C1CCCCC(CCCl)O1 Amb27407753 [0,0,0,1,0,1|2,0,0]=4 3113 B11R1.110 O=C1CCCC[C@@H](CCO)O1 Amb27197176 [0,0,0,1,0,1|2,0,0]=4 3114 B11R1.110 O=C1CN(CCO)CCCO1 Amb27613231 [0,0,0,1,0,1|2,0,0]=4 3115 B11R1.157 CC(=O)CC1CC(C)CCN1 Amb25746124 [0,0,0,1,0,1|2,0,0]=4 3116 B11R1.157 CC(=O)CC1CCCC(C)N1 Amb25100933 [0,0,0,1,0,1|2,0,0]=4 3117 B11R1.157 CC(=O)CC1CCCC(N)C1 Amb24685265 [0,0,0,1,0,1|2,0,0]=4 3118 B11R1.157 CC(=O)CN1CCCC(C)C1 Amb8427992 [0,0,0,1,0,1|2,0,0]=4 3119 B11R1.157 CC(=O)C[C@@H]1CCC[C@@H](C)O1 Amb27427875 [0,0,0,1,0,1|2,0,0]=4 3120 B11R1.157 CC(=O)C[C@H]1CCC[C@@H](C)N1 Amb27967295 [0,0,0,1,0,1|2,0,0]=4 3121 B11R1.157 CC(=O)NC1CCCC(Br)C1 Amb30026941 [0,0,0,1,0,1|2,0,0]=4 3122 B11R1.157 CC(=O)NC1CCCC(Cl)C1 Amb35620437 [0,0,0,1,0,1|2,0,0]=4 3123 B11R1.157 CC(=O)NC1CCCC(N)C1 Amb6256148 [0,0,0,1,0,1|2,0,0]=4 3124 B11R1.157 CC(=O)NC1CCOC(C)C1 Amb27666452 [0,0,0,1,0,1|2,0,0]=4 3125 B11R1.157 CC(=O)N[C@@H]1CCC[C@@H](O)C1 Amb27841320 [0,0,0,1,0,1|2,0,0]=4 3126 B11R1.157 CC(=O)N[C@@H]1CCC[C@H](O)C1 Amb28064067 [0,0,0,1,0,1|2,0,0]=4 3127 B11R1.157 CC(=O)OC1CCCC(C)C1 Amb27659422 [0,0,0,1,0,1|1,0,0]=3 3128 B11R1.157 CC(=O)OC1CCCC(Cl)C1 Amb27643574 [0,0,0,1,0,1|2,0,0]=4 3129 B11R1.157 CC(=O)OC1CCCC(N)C1 Amb27461144 [0,0,0,1,0,1|2,0,0]=4 3130 B11R1.157 CC(=O)OC1CCCN(C)C1 Amb27267956 [0,0,0,1,0,1|2,0,0]=4 3131 B11R1.157 CC(=O)O[C@H]1CCC[C@H](O)C1 Amb28318845 [0,0,0,1,0,1|2,0,0]=4 3132 B11R1.157 CC(=O)\C=C1/CCCC(C)C1 Amb28284820 [0,0,0,1,0,1|1,0,1]=4 3133 B11R1.157 CC(O)CC1CCCC(C)C1 Amb27780208 [0,0,0,1,0,1|1,0,1]=4 3134 B11R1.157 CC1=C[C@H](CC(=O)O)CCC1 Amb27823732 [0,0,0,1,0,1|0,0,2]=4 3135 B11R1.157 CC1CC(CC(=O)O)CCN1 Amb8387924 [0,0,0,1,0,1|1,0,0]=3 3136 B11R1.157 CC1CC(CC(=O)O)CCO1 Amb27865036 [0,0,0,1,0,1|1,0,0]=3 3137 B11R1.157 CC1CC(NC(=O)Cl)CCO1 Amb35633326 [0,0,0,1,0,1|2,0,0]=4 3138 B11R1.157 CC1CC=CC(CC(=O)O)C1 Amb18125730 [0,0,0,1,0,1|0,0,2]=4 3139 B11R1.157 CC1CCCC(CB(O)O)C1 Amb27222527 [0,0,0,1,0,1|1,0,1]=4 3140 B11R1.157 CC1CCCC(CC(=O)O)C1 Amb6749251 [0,0,0,1,0,1|0,0,0]=2 3141 B11R1.157 CC1CCCC(CC(=O)O)N1 Amb8387931 [0,0,0,1,0,1|1,0,0]=3 3142 B11R1.157 CC1CCCC(CC(=O)O)O1 Amb18126127 [0,0,0,1,0,1|1,0,0]=3 3143 B11R1.157 CC1CCCC(CC(N)=S)C1 Amb27451234 [0,0,0,1,0,1|1,1,0]=4 3144 B11R1.157 CC1CCCC(NC(=O)Cl)C1 Amb35625665 [0,0,0,1,0,1|1,0,0]=3 3145 B11R1.157 CC1CCCC(NC(N)=O)C1 Amb8953408 [0,0,0,1,0,1|1,0,0]=3 3146 B11R1.157 CC1CCCC(OC(=O)Cl)C1 Amb26372242 [0,0,0,1,0,1|1,0,0]=3 3147 B11R1.157 CC1CCCN(CC(=O)Cl)C1 Amb17142953 [0,0,0,1,0,1|2,0,0]=4 3148 B11R1.157 CC1CCCN(CC(=O)O)C1 Amb2721846 [0,0,0,1,0,1|1,0,0]=3 3149 B11R1.157 CC1CCCN(CC(N)=O)C1 Amb10671448 [0,0,0,1,0,1|2,0,0]=4 3150 B11R1.157 CC1CCC\C(=C\C(=O)O)C1 Amb33189155 [0,0,0,1,0,1|0,0,1]=3 3151 B11R1.157 CC1CCC\C(=C\C(N)=O)C1 Amb28285397 [0,0,0,1,0,1|1,0,1]=4 3152 B11R1.157 CC1CCNC(CC(=O)O)C1 Amb8387930 [0,0,0,1,0,1|1,0,0]=3 3153 B11R1.157 CC1CCNC(CC(N)=O)C1 Amb28051754 [0,0,0,1,0,1|2,0,0]=4 3154 B11R1.157 CC1CNCC(CC(=O)O)C1 Amb28652860 [0,0,0,1,0,1|1,0,0]=3 3155 B11R1.157 CC1CNCC(CC(=O)O)C1 Amb8387927 [0,0,0,1,0,1|1,0,0]=3 3156 B11R1.157 CC1CNCC(NC(N)=O)C1 Amb27951115 [0,0,0,1,0,1|2,0,0]=4 3157 B11R1.157 CN1CCCC(CC(=O)O)C1 Amb13885805 [0,0,0,1,0,1|1,0,0]=3 3158 B11R1.157 CN1CCCC(CC(=O)O)C1 Amb34914084 [0,0,0,1,0,1|1,0,0]=3 3159 B11R1.157 CN1CCCC(CC(N)=O)C1 Amb27485694 [0,0,0,1,0,1|2,0,0]=4 3160 B11R1.157 CN1CCCC(NC(=O)Cl)C1 Amb35625812 [0,0,0,1,0,1|2,0,0]=4 3161 B11R1.157 CN1CCC\C(=C/C(=O)O)C1 Amb31161564 [0,0,0,1,0,1|1,0,1]=4 3162 B11R1.157 CN1CCNC(CC(=O)O)C1 Amb18830480 [0,0,0,1,0,1|2,0,0]=4 3163 B11R1.157 CN1CCOC(CC(=O)O)C1 Amb18061928 [0,0,0,1,0,1|2,0,0]=4 3164 B11R1.157 C[C@@H]1CCC[C@H](CC(=O)O)O1 Amb27657703 [0,0,0,1,0,1|1,0,0]=3 3165 B11R1.157 NC(=O)CC1CCCC(N)C1 Amb18964224 [0,0,0,1,0,1|2,0,0]=4 3166 B11R1.157 O=C(O)CC1CCCC(=O)C1 Amb8487121 [0,0,0,1,0,1|1,0,1]=4 3167 B11R1.157 O=C(O)CC1CCCC(F)C1 Amb24651233 [0,0,0,1,0,1|1,0,0]=3 3168 B11R1.157 O=C(O)CC1CCCC(O)C1 Amb18645020 [0,0,0,1,0,1|1,0,0]=3 3169 B11R1.157 O=C(O)CN1CCCC(F)C1 Amb30028543 [0,0,0,1,0,1|2,0,0]=4 3170 B11R1.157 O=C(O)CN1CCCC(O)C1 Amb15701257 [0,0,0,1,0,1|2,0,0]=4 3171 B11R1.157 O=C(O)CN1CCC[C@@H](O)C1 Amb22224754 [0,0,0,1,0,1|2,0,0]=4 3172 B11R1.157 O=C(O)CN1CCC[C@H](O)C1 Amb22224789 [0,0,0,1,0,1|2,0,0]=4 3173 B11R1.157 O=C(O)C[C@@H]1CCC[C@@H](F)C1 Amb34912969 [0,0,0,1,0,1|1,0,0]=3 3174 B11R1.157 O=C(O)C[C@H]1CCCC(=O)C1 Amb28289879 [0,0,0,1,0,1|1,0,1]=4 3175 B11R1.157 O=C(O)C[C@H]1CCC[C@@H](F)C1 Amb34912973 [0,0,0,1,0,1|1,0,0]=3 3176 B11R1.183 C=CC1OC(=O)NC1CCC Amb27879543 [0,0,0,1,0,1|0,0,2]=4 3177 B11R1.183 C=CC1OC(=O)OC1CCC Amb27221730 [0,0,0,1,0,1|0,0,2]=4 3178 B11R1.183 CCC1OC(=O)OC1CCO Amb27805266 [0,0,0,1,0,1|1,0,0]=3 3179 B11R1.183 CCCC1CC(=O)CC1CC Amb28343137 [0,0,0,1,0,1|1,0,0]=3 3180 B11R1.183 CCCC1CC(=O)OC1CO Amb27768434 [0,0,0,1,0,1|1,0,0]=3 3181 B11R1.183 CCCC1OC(=O)NC1CO Amb28068824 [0,0,0,1,0,1|2,0,0]=4 3182 B11R1.183 CCC[C@@H]1CC(=O)C[C@H]1CC Amb24604137 [0,0,0,1,0,1|1,0,0]=3 3183 B11R1.183 CCC[C@@H]1OC(=O)N[C@@H]1CO Amb27981987 [0,0,0,1,0,1|2,0,0]=4 3184 B11R1.183 CCC[C@H]1CC(=O)C[C@@H]1CC Amb27632339 [0,0,0,1,0,1|1,0,0]=3 3185 B11R1.183 CCC[C@H]1CC(=O)O[C@@H]1CO Amb27213796 [0,0,0,1,0,1|1,0,0]=3 3186 B11R1.183 CC[C@H]1OC(=O)O[C@H]1CCO Amb27981932 [0,0,0,1,0,1|1,0,0]=3 3187 B11R1.193 CCCC1CCCC1C(=O)O Amb18644850 [0,0,0,1,0,1|0,0,0]=2 3188 B11R1.193 CCCC1CCCN1C(=O)Cl Amb27493472 [0,0,0,1,0,1|1,0,0]=3 3189 B11R1.193 CCCC1CCCN1C(C)=N Amb27252244 [0,0,0,1,0,1|2,0,0]=4 3190 B11R1.193 CCCC1CCCN1C(N)=S Amb27795050 [0,0,0,1,0,1|1,1,0]=4 3191 B11R1.193 CCCC1CCNC1C(=O)O Amb25241187 [0,0,0,1,0,1|1,0,0]=3 3192 B11R1.193 CCCC1CCNC1C(=O)O Amb28652947 [0,0,0,1,0,1|1,0,0]=3 3193 B11R1.193 CCCC1CCN[C@@H]1C(=O)O Amb28340938 [0,0,0,1,0,1|1,0,0]=3 3194 B11R1.193 CCCC1COCC1C(=O)O Amb27864218 [0,0,0,1,0,1|1,0,0]=3 3195 B11R1.193 CCCC1COCC1C(C)=O Amb29882922 [0,0,0,1,0,1|2,0,0]=4 3196 B11R1.193 CCCC1SCCN1C(C)=O Amb28061197 [0,0,0,1,0,1|2,0,0]=4 3197 B11R1.193 CCCN1CCCC1C(=O)O Amb9704298 [0,0,0,1,0,1|1,0,0]=3 3198 B11R1.193 CCCN1CCCC1C(N)=O Amb26327231 [0,0,0,1,0,1|2,0,0]=4 3199 B11R1.193 CCCN1CCC[C@@H]1C(=O)O Amb27591265 [0,0,0,1,0,1|1,0,0]=3 3200 B11R1.193 CCCN1CCC[C@@H]1C(=O)O Amb27839891 [0,0,0,1,0,1|1,0,0]=3 3201 B11R1.193 CCCN1CCC[C@H]1C(=O)O Amb25864864 [0,0,0,1,0,1|1,0,0]=3 3202 B11R1.193 CCCN1CCC[C@H]1C(N)=O Amb26480008 [0,0,0,1,0,1|2,0,0]=4 3203 B11R1.193 CCC[C@@H]1CCC[C@@H]1C(=O)O Amb27878683 [0,0,0,1,0,1|0,0,0]=2 3204 B11R1.193 CCC[C@@H]1CCN[C@H]1C(=O)O Amb26452406 [0,0,0,1,0,1|1,0,0]=3 3205 B11R1.193 CCC[C@@H]1CNC[C@H]1C(=O)O Amb32992396 [0,0,0,1,0,1|1,0,0]=3 3206 B11R1.193 CCC[C@@H]1CNC[C@H]1C(=O)O Amb32992397 [0,0,0,1,0,1|1,0,0]=3 3207 B11R1.193 CCOC1=C(C(=O)O)CCC1 Amb24487805 [0,0,0,1,0,1|1,0,1]=4 3208 B11R1.193 CCOC1CNCC1C(=O)O Amb35592518 [0,0,0,1,0,1|2,0,0]=4 3209 B11R1.193 CNCC1CCCC1C(=O)O Amb27654981 [0,0,0,1,0,1|1,0,0]=3 3210 B11R1.193 CNC[C@@H]1CCCN1C(C)=O Amb22227518 [0,0,0,1,0,1|2,0,0]=4 3211 B11R1.193 COCC1CCCC1C(=O)O Amb25200900 [0,0,0,1,0,1|1,0,0]=3 3212 B11R1.193 COCC1CCCN1C(=O)Cl Amb26914646 [0,0,0,1,0,1|2,0,0]=4 3213 B11R1.193 COCC1CCCN1C(C)=O Amb27872243 [0,0,0,1,0,1|2,0,0]=4 3214 B11R1.193 COC[C@@H]1CCCN1C(=O)Cl Amb25945308 [0,0,0,1,0,1|2,0,0]=4 3215 B11R1.193 COC[C@@H]1CCCN1C(C)=O Amb27834362 [0,0,0,1,0,1|2,0,0]=4 3216 B11R1.193 COC[C@@H]1CCC[C@@H]1C(=O)O Amb27758197 [0,0,0,1,0,1|1,0,0]=3 3217 B11R1.193 COC[C@H]1CCCN1C(=O)Cl Amb33296755 [0,0,0,1,0,1|2,0,0]=4 3218 B11R1.193 COC[C@H]1CCCN1C(N)=O Amb25797982 [0,0,0,1,0,1|2,0,0]=4 3219 B11R1.193 COC[C@H]1CCC[C@H]1C(=O)O Amb25295380 [0,0,0,1,0,1|1,0,0]=3 3220 B11R1.193 COC[C@H]1CCO[C@H]1C(=O)O Amb27867716 [0,0,0,1,0,1|2,0,0]=4 3221 B11R1.193 CSCC1CCCN1C(N)=O Amb27456218 [0,0,0,1,0,1|2,0,0]=4 3222 B11R1.193 N#CCC1CCC[C@@H]1C(=O)O Amb27427596 [0,0,0,1,0,1|1,0,1]=4 3223 B11R1.193 NCCN1CCCC1C(=O)O Amb27764990 [0,0,0,1,0,1|2,0,0]=4 3224 B11R1.193 O=C(O)C1CCCC1CCF Amb27635907 [0,0,0,1,0,1|1,0,0]=3 3225 B11R1.193 O=C(O)C1CNCC1CCO Amb2696583 [0,0,0,1,0,1|2,0,0]=4 3226 B11R1.193 O=C(O)[C@@H]1CCCN1CCO Amb27839895 [0,0,0,1,0,1|2,0,0]=4 3227 B11R1.193 O=C(O)[C@H]1CCCN1CCO Amb25700707 [0,0,0,1,0,1|2,0,0]=4 3228 B11R1.193 O=CCC1CCCC1C(=O)O Amb28367096 [0,0,0,1,0,1|1,0,1]=4 3229 B11R1.193 O=CC[C@@H]1CCC[C@@H]1C(=O)O Amb27234851 [0,0,0,1,0,1|1,0,1]=4 3230 B11R1.742 CC(=N)NC1CCCCCC1 Amb27213610 [0,0,0,1,0,1|2,0,0]=4 3231 B11R1.742 CC(=O)C=C1CCCCCC1 Amb27948607 [0,0,0,1,0,1|1,0,1]=4 3232 B11R1.742 CC(=O)CC1CCCCCC1 Amb25094261 [0,0,0,1,0,1|1,0,0]=3 3233 B11R1.742 CC(=O)CC1CCCCCN1 Amb23585599 [0,0,0,1,0,1|2,0,0]=4 3234 B11R1.742 CC(=O)CC1CCCOCC1 Amb27486093 [0,0,0,1,0,1|2,0,0]=4 3235 B11R1.742 CC(=O)CN1CCCCCC1 Amb8427988 [0,0,0,1,0,1|2,0,0]=4 3236 B11R1.742 CC(=O)CN1CCCCCC1 Amb9173328 [0,0,0,1,0,1|2,0,0]=4 3237 B11R1.742 CC(=O)NC1CCCSCC1 Amb35691520 [0,0,0,1,0,1|2,0,0]=4 3238 B11R1.742 CC(=O)OC1CCCCCC1 Amb26487005 [0,0,0,1,0,1|1,0,0]=3 3239 B11R1.742 CC(O)CC1CCCCCC1 Amb27195551 [0,0,0,1,0,1|1,0,1]=4 3240 B11R1.742 CN(O)CC1CCCCCC1 Amb33224395 [0,0,0,1,0,1|2,0,0]=4 3241 B11R1.742 C[C@@H](O)CC1CCCCCC1 Amb33267867 [0,0,0,1,0,1|1,0,1]=4 3242 B11R1.742 C[C@H](O)CC1CCCCCC1 Amb33267868 [0,0,0,1,0,1|1,0,1]=4 3243 B11R1.742 N=C(N)CC1CCCCCC1 Amb32882353 [0,0,0,1,0,1|2,0,0]=4 3244 B11R1.742 N=C(N)NC1CCCCCC1 Amb6429445 [0,0,0,1,0,1|2,0,0]=4 3245 B11R1.742 NC(=O)CC1CCCCCC1 Amb24487974 [0,0,0,1,0,1|1,0,0]=3 3246 B11R1.742 NC(=O)CC1CCCNCC1 Amb24363656 [0,0,0,1,0,1|2,0,0]=4 3247 B11R1.742 NC(=O)CC1CCCNCC1 Amb26473933 [0,0,0,1,0,1|2,0,0]=4 3248 B11R1.742 NC(=O)CC1CCCNCC1 Amb32663654 [0,0,0,1,0,1|2,0,0]=4 3249 B11R1.742 NC(=O)CN1CCCCCC1 Amb8326954 [0,0,0,1,0,1|2,0,0]=4 3250 B11R1.742 NC(=O)NC1CCCCCC1 Amb4008281 [0,0,0,1,0,1|1,0,0]=3 3251 B11R1.742 NC(=O)NC1CCCNCC1 Amb24595706 [0,0,0,1,0,1|2,0,0]=4 3252 B11R1.742 NC(=O)NC1CCCNCC1 Amb35753064 [0,0,0,1,0,1|2,0,0]=4 3253 B11R1.742 NC(=O)NC1CCCSCC1 Amb29861268 [0,0,0,1,0,1|2,0,0]=4 3254 B11R1.742 NC(=O)OC1CCCNCC1 Amb35723380 [0,0,0,1,0,1|2,0,0]=4 3255 B11R1.742 NC(=S)CC1CCCCCC1 Amb33267826 [0,0,0,1,0,1|1,1,0]=4 3256 B11R1.742 NC(=S)NC1CCCCCC1 Amb8999214 [0,0,0,1,0,1|1,1,0]=4 3257 B11R1.742 O=C(Cl)NC1CCCCCC1 Amb35637080 [0,0,0,1,0,1|1,0,0]=3 3258 B11R1.742 O=C(Cl)NC1CCCOCC1 Amb35633431 [0,0,0,1,0,1|2,0,0]=4 3259 B11R1.742 O=C(Cl)NC1CCCSCC1 Amb35633351 [0,0,0,1,0,1|2,0,0]=4 3260 B11R1.742 O=C(Cl)OC1CCCCCC1 Amb28365356 [0,0,0,1,0,1|1,0,0]=3 3261 B11R1.742 O=C(O)C=C1CCCCCC1 Amb6749176 [0,0,0,1,0,1|0,0,1]=3 3262 B11R1.742 O=C(O)CC1C=CCCCC1 Amb26951387 [0,0,0,1,0,1|0,0,2]=4 3263 B11R1.742 O=C(O)CC1CCC=CCC1 Amb26054605 [0,0,0,1,0,1|0,0,2]=4 3264 B11R1.742 O=C(O)CC1CCCCCC1 Amb6749261 [0,0,0,1,0,1|0,0,0]=2 3265 B11R1.742 O=C(O)CC1CCCCCN1 Amb18199972 [0,0,0,1,0,1|1,0,0]=3 3266 B11R1.742 O=C(O)CC1CCCCCO1 Amb27823132 [0,0,0,1,0,1|1,0,0]=3 3267 B11R1.742 O=C(O)CC1CCCCNC1 Amb18199974 [0,0,0,1,0,1|1,0,0]=3 3268 B11R1.742 O=C(O)CC1CCCNCC1 Amb18199994 [0,0,0,1,0,1|1,0,0]=3 3269 B11R1.742 O=C(O)CC1CCCNCC1 Amb30584770 [0,0,0,1,0,1|1,0,0]=3 3270 B11R1.742 O=C(O)CC1CCCOCC1 Amb18199912 [0,0,0,1,0,1|1,0,0]=3 3271 B11R1.742 O=C(O)CC1CCCSCC1 Amb18197457 [0,0,0,1,0,1|1,0,0]=3 3272 B11R1.742 O=C(O)CC1COCCOC1 Amb27847958 [0,0,0,1,0,1|2,0,0]=4 3273 B11R1.742 O=C(O)CN1CCCCCC1 Amb2536986 [0,0,0,1,0,1|1,0,0]=3 3274 B11R1.742 O=C(O)CN1CCCCCC1 Amb9677404 [0,0,0,1,0,1|1,0,0]=3 3275 B11R1.742 O=C(O)CN1CCCNCC1 Amb13952776 [0,0,0,1,0,1|2,0,0]=4 3276 B11R1.742 O=C(O)CN1CCCNCC1 Amb9380317 [0,0,0,1,0,1|2,0,0]=4 3277 B11R1.742 O=C(O)\C=C1\CCCOCC1 Amb28313065 [0,0,0,1,0,1|1,0,1]=4 3278 B11R1.742 O=C(O)\C=C1\CCCSCC1 Amb35691471 [0,0,0,1,0,1|1,0,1]=4 3279 B11R1.742 O=[N+]([O-])CC1CCCCCC1 Amb33267271 [0,0,0,1,0,1|1,0,1]=4 3280 B11R1.771 CC(=O)NC1(CCO)CCC1 Amb27840388 [0,0,0,1,0,1|2,0,0]=4 3281 B11R1.771 CCCC1(CC(=O)O)CCC1 Amb33314634 [0,0,0,1,0,1|0,0,0]=2 3282 B11R1.771 CCNC1(CC(=O)O)CNC1 Amb27989558 [0,0,0,1,0,1|2,0,0]=4 3283 B11R1.771 CCOC1(CC(=O)O)CCC1 Amb25381560 [0,0,0,1,0,1|1,0,0]=3 3284 B11R1.771 CCOC1(CC(=O)O)CNC1 Amb27989562 [0,0,0,1,0,1|2,0,0]=4 3285 B11R1.771 CCSC1(CC(=O)O)CNC1 Amb27989560 [0,0,0,1,0,1|2,0,0]=4 3286 B11R1.771 CNOC1(CC(=O)O)CCC1 Amb33098073 [0,0,0,1,0,1|2,0,0]=4 3287 B11R1.771 COCC1(CC(=O)O)CCC1 Amb27988229 [0,0,0,1,0,1|1,0,0]=3 3288 B11R1.771 COCC1(NC(=O)Cl)CCC1 Amb35633443 [0,0,0,1,0,1|2,0,0]=4 3289 B11R1.771 CSCC1(CC(=O)O)CCC1 Amb33272042 [0,0,0,1,0,1|1,0,0]=3 3290 B11R1.771 O=C(Cl)OC1(CCBr)CCC1 Amb33297202 [0,0,0,1,0,1|2,0,0]=4 3291 B11R1.771 O=C(O)CC1(CCF)CCC1 Amb33196443 [0,0,0,1,0,1|1,0,0]=3 3292 B11R1.785 CCCC1(CCC)CC(=O)C1 Amb27988322 [0,0,0,1,0,1|1,0,0]=3 3293 B11R1.785 CCCC1(CCC)CC(O)C1 Amb27988331 [0,0,0,1,0,1|1,0,1]=4 3294 B11R1.799 CCCC(CCC)CC1CO1 Amb33273450 [0,0,0,1,0,1|1,0,1]=4 3295 B11R1.804 CCCC(CC(=O)O)C1CC1 Amb33232171 [0,0,0,1,0,1|0,0,0]=2 3296 B11R1.804 CCCC(NC(=N)N)C1CC1 Amb27674142 [0,0,0,1,0,1|2,0,0]=4 3297 B11R1.804 CCCC(NC(C)=N)C1CC1 Amb27673907 [0,0,0,1,0,1|2,0,0]=4 3298 B11R1.804 CCCC(NC(C)=O)C1CC1 Amb27674113 [0,0,0,1,0,1|1,0,0]=3 3299 B11R1.804 CCCC(NC(N)=O)C1CC1 Amb27674154 [0,0,0,1,0,1|1,0,0]=3 3300 B11R1.804 CCCC(NC(N)=S)C1CC1 Amb27674152 [0,0,0,1,0,1|1,1,0]=4 3301 B11R1.804 COCC(NC(N)=O)C1CC1 Amb27987440 [0,0,0,1,0,1|2,0,0]=4 3302 B11R1.804 NC(=O)NC(CCO)C1CC1 Amb27271879 [0,0,0,1,0,1|2,0,0]=4 3303 B11R1.49 CCC1CC(=O)CC1C(=O)O Amb27657710 [0,1,0,1,0,0|0,0,1]=3 3304 B11R1.49 CCC1CC(C)CN1C(=O)Cl Amb28319202 [0,1,0,1,0,0|2,0,0]=4 3305 B11R1.49 CCC1CC(C)CN1C(N)=O Amb27395521 [0,1,0,1,0,0|2,0,0]=4 3306 B11R1.49 CCC1NC(=O)CC1C(=O)O Amb18200025 [0,1,0,1,0,0|1,0,1]=4 3307 B11R1.49 CCN1CC(=O)CC1C(=O)O Amb25722959 [0,1,0,1,0,0|1,0,1]=4 3308 B11R1.49 CC[C@@H]1CC(=O)N[C@H]1C(=O)O Amb25179312 [0,1,0,1,0,0|1,0,1]=4 3309 B11R1.49 CC[C@@H]1NC(=O)C[C@H]1C(=O)O Amb27632492 [0,1,0,1,0,0|1,0,1]=4 3310 B11R1.49 CC[C@H]1CC(=O)C[C@H]1C(=O)O Amb28144970 [0,1,0,1,0,0|0,0,1]=3 3311 B11R1.49 CC[C@H]1CC(=O)N[C@@H]1C(=O)O Amb27421994 [0,1,0,1,0,0|1,0,1]=4 3312 B11R1.49 COC1CN(C)CC1C(=O)O Amb35592453 [0,1,0,1,0,0|2,0,0]=4 3313 B11R1.61 COC1C(C(=O)O)C1C(C)C Amb25775086 [0,1,0,1,0,0|1,0,0]=3 3314 B11R1.61 CO[C@@H]1[C@@H](C(=O)O)[C@@H]1C(C)C Amb25179292 [0,1,0,1,0,0|1,0,0]=3 3315 B11R1.74 C=C(C)[C@H]1C[C@@H](C)C[C@@H](O)C1 Amb27631946 [0,1,0,1,0,0|2,0,0]=4 3316 B11R1.74 CC(=O)C1CC(=O)CC(C)C1 Amb25937018 [0,1,0,1,0,0|1,0,1]=4 3317 B11R1.74 CC(=O)C1CC(C)=CC(C)C1 Amb26020975 [0,1,0,1,0,0|1,0,1]=4 3318 B11R1.74 CC(=O)C1CC(C)CC(C)C1 Amb22059594 [0,1,0,1,0,0|1,0,0]=3 3319 B11R1.74 CC(=O)C1CC(C)NC(C)C1 Amb28070498 [0,1,0,1,0,0|1,0,0]=3 3320 B11R1.74 CC(=O)N1CC(C)CC(Br)C1 Amb27845289 [0,1,0,1,0,0|2,0,0]=4 3321 B11R1.74 CC(=O)N1CC(C)CC(C)C1 Amb3358087 [0,1,0,1,0,0|2,0,0]=4 3322 B11R1.74 CC(=O)N1CC(C)CC(O)C1 Amb27594789 [0,1,0,1,0,0|2,0,0]=4 3323 B11R1.74 CC(=O)N1CC(C)NC(C)C1 Amb16192095 [0,1,0,1,0,0|2,0,0]=4 3324 B11R1.74 CC(=O)N1CC(C)OC(C)C1 Amb3886616 [0,1,0,1,0,0|2,0,0]=4 3325 B11R1.74 CC(=O)N1C[C@@H](O)C[C@@H](C)C1 Amb28344259 [0,1,0,1,0,0|2,0,0]=4 3326 B11R1.74 CC(=O)N1C[C@H](C)N[C@H](C)C1 Amb25933590 [0,1,0,1,0,0|2,0,0]=4 3327 B11R1.74 CC1=CC(C(=O)O)CC(C)C1 Amb26585310 [0,1,0,1,0,0|0,0,2]=4 3328 B11R1.74 CC1=C[C@H](C)O[C@@H](C(=O)O)C1 Amb27777992 [0,1,0,1,0,0|1,0,1]=4 3329 B11R1.74 CC1=C[C@H](C)O[C@H](C(=O)O)C1 Amb28137910 [0,1,0,1,0,0|1,0,1]=4 3330 B11R1.74 CC1C=C(C(=O)O)CC(C)O1 Amb27427563 [0,1,0,1,0,0|0,0,2]=4 3331 B11R1.74 CC1CC(=O)CC(C(=O)O)N1 Amb18200027 [0,1,0,1,0,0|1,0,1]=4 3332 B11R1.74 CC1CC(=O)NC(C(=O)O)C1 Amb26352891 [0,1,0,1,0,0|1,0,1]=4 3333 B11R1.74 CC1CC(C(=O)O)CC(=O)N1 Amb27628365 [0,1,0,1,0,0|1,0,1]=4 3334 B11R1.74 CC1CC(C(=O)O)CC(C)N1 Amb23535943 [0,1,0,1,0,0|0,0,0]=2 3335 B11R1.74 CC1CC(C(=O)O)CC(C)N1 Amb32670799 [0,1,0,1,0,0|0,0,0]=2 3336 B11R1.74 CC1CC(C(=O)O)CC(C)O1 Amb18830483 [0,1,0,1,0,0|0,0,0]=2 3337 B11R1.74 CC1CC(C(N)=O)CC(C)O1 Amb25892562 [0,1,0,1,0,0|1,0,0]=3 3338 B11R1.74 CC1CC(C)CC(B(O)O)C1 Amb27803529 [0,1,0,1,0,0|1,0,1]=4 3339 B11R1.74 CC1CC(C)CC(C(=O)O)C1 Amb28314873 [0,1,0,1,0,0|0,0,0]=2 3340 B11R1.74 CC1CC(C)CC(C(N)=O)C1 Amb26361085 [0,1,0,1,0,0|1,0,0]=3 3341 B11R1.74 CC1CC(C)CC([N+](=O)[O-])C1 Amb33298443 [0,1,0,1,0,0|1,0,1]=4 3342 B11R1.74 CC1CC(C)CN(C(=O)Cl)C1 Amb17563071 [0,1,0,1,0,0|2,0,0]=4 3343 B11R1.74 CC1CC(C)NC(C(=O)O)C1 Amb24588101 [0,1,0,1,0,0|1,0,0]=3 3344 B11R1.74 CC1CC(C)NC(C(N)=O)C1 Amb27750832 [0,1,0,1,0,0|2,0,0]=4 3345 B11R1.74 CC1CC(C)OC(C(=O)O)C1 Amb18830486 [0,1,0,1,0,0|1,0,0]=3 3346 B11R1.74 CC1CC(N)CC(C(=O)O)C1 Amb27212274 [0,1,0,1,0,0|0,0,0]=2 3347 B11R1.74 CC1CN(C(=O)Cl)CC(C)O1 Amb17563088 [0,1,0,1,0,0|2,0,0]=4 3348 B11R1.74 CC1CN(C(=O)Cl)CC(C)S1 Amb28423237 [0,1,0,1,0,0|2,0,0]=4 3349 B11R1.74 CC1CN(C(N)=O)CC(C)N1 Amb27823083 [0,1,0,1,0,0|2,0,0]=4 3350 B11R1.74 CC1CN(C)CC(C(=O)O)O1 Amb27428986 [0,1,0,1,0,0|2,0,0]=4 3351 B11R1.74 CC1CN(C)CC(C(=O)O)O1 Amb28920052 [0,1,0,1,0,0|2,0,0]=4 3352 B11R1.74 CC1CS(=O)C[C@@H](C(=O)O)N1 Amb28244788 [0,1,0,1,0,0|2,0,0]=4 3353 B11R1.74 CC1C[C@@H](O)C[C@H](C(=O)O)C1 Amb28195097 [0,1,0,1,0,0|0,0,0]=2 3354 B11R1.74 CN1CC(O)CC(C(=O)O)C1 Amb35687162 [0,1,0,1,0,0|1,0,0]=3 3355 B11R1.74 C[C@@H]1CC(=O)N[C@H](C(=O)O)C1 Amb28134065 [0,1,0,1,0,0|1,0,1]=4 3356 B11R1.74 C[C@@H]1CN(C)C[C@H](C(=O)O)O1 Amb28904325 [0,1,0,1,0,0|2,0,0]=4 3357 B11R1.74 C[C@@H]1C[C@H](C(=O)O)C[C@H](C)C1 Amb24487888 [0,1,0,1,0,0|0,0,0]=2 3358 B11R1.74 C[C@@H]1C[C@H](C(N)=O)C[C@H](C)C1 Amb27394295 [0,1,0,1,0,0|1,0,0]=3 3359 B11R1.74 C[C@@H]1C[C@H](O)C[C@H](C(=O)O)C1 Amb28384451 [0,1,0,1,0,0|0,0,0]=2 3360 B11R1.74 C[C@H]1CC(=O)N[C@@H](C(=O)O)C1 Amb28284476 [0,1,0,1,0,0|1,0,1]=4 3361 B11R1.74 C[C@H]1CC(C(=O)O)C[C@@H](C)N1 Amb34915526 [0,1,0,1,0,0|0,0,0]=2 3362 B11R1.74 C[C@H]1CC(C(=O)O)C[C@@H](C)O1 Amb32680762 [0,1,0,1,0,0|0,0,0]=2 3363 B11R1.74 C[C@H]1CN(C(=O)Cl)C[C@@H](C)O1 Amb25244633 [0,1,0,1,0,0|2,0,0]=4 3364 B11R1.74 C[C@H]1C[C@@H](C(=O)O)C[C@@H](C)N1 Amb28723478 [0,1,0,1,0,0|0,0,0]=2 3365 B11R1.74 C[C@H]1C[C@@H](C(=O)O)C[C@@H](C)N1 Amb32670819 [0,1,0,1,0,0|0,0,0]=2 3366 B11R1.74 C[C@H]1C[C@@H](C(=O)O)C[C@@H](C)O1 Amb32695424 [0,1,0,1,0,0|0,0,0]=2 3367 B11R1.74 C[C@H]1C[C@@H](C(N)=O)C[C@@H](C)N1 Amb28255430 [0,1,0,1,0,0|1,0,0]=3 3368 B11R1.74 C[C@H]1C[C@@H](C(N)=O)C[C@@H](C)O1 Amb32993102 [0,1,0,1,0,0|1,0,0]=3 3369 B11R1.74 C[C@H]1C[C@@H](C)N[C@@H](C(=O)O)C1 Amb28132155 [0,1,0,1,0,0|1,0,0]=3 3370 B11R1.74 C[C@H]1C[C@H](O)C[C@H](C(=O)O)C1 Amb28051869 [0,1,0,1,0,0|0,0,0]=2 3371 B11R1.74 NC1CC(N)CC(C(=O)O)C1 Amb26941963 [0,1,0,1,0,0|1,0,0]=3 3372 B11R1.74 NC1CC(O)CC(C(=O)O)C1 Amb28285635 [0,1,0,1,0,0|1,0,0]=3 3373 B11R1.74 N[C@@H]1C[C@H](O)C[C@H](C(=O)O)C1 Amb27650583 [0,1,0,1,0,0|1,0,0]=3 3374 B11R1.74 N[C@H]1CC(C(=O)O)C[C@H](N)C1 Amb27776579 [0,1,0,1,0,0|1,0,0]=3 3375 B11R1.74 O=C(O)C1CC(O)CC(O)C1 Amb26351388 [0,1,0,1,0,0|1,0,0]=3 3376 B11R1.86 CC(=O)CC1CCCCC1=O Amb17593853 [0,1,0,1,0,0|1,0,1]=4 3377 B11R1.86 CC(C)CC1CCCCC1=O Amb18177374 [0,1,0,1,0,0|1,0,0]=3 3378 B11R1.86 CC(C)CC1CCCCC1O Amb10809767 [0,1,0,1,0,0|1,0,1]=4 3379 B11R1.86 CC(C)CC1CCCOC1O Amb27829975 [0,1,0,1,0,0|0,0,2]=4 3380 B11R1.86 CC(C)CC1CNCCC1=O Amb18200324 [0,1,0,1,0,0|2,0,0]=4 3381 B11R1.86 CC(C)CC1COCCC1=O Amb25282295 [0,1,0,1,0,0|2,0,0]=4 3382 B11R1.86 CC(C)CC1NCCNC1=O Amb18960334 [0,1,0,1,0,0|2,0,0]=4 3383 B11R1.86 CC(C)CN1CCCCC1=O Amb22394918 [0,1,0,1,0,0|2,0,0]=4 3384 B11R1.86 CC(C)C[C@@H]1CCCC[C@H]1O Amb33212896 [0,1,0,1,0,0|1,0,1]=4 3385 B11R1.86 CC(C)C[C@@H]1NCCNC1=O Amb18200171 [0,1,0,1,0,0|2,0,0]=4 3386 B11R1.86 CC(C)C[C@H]1CCCNC1=O Amb28058359 [0,1,0,1,0,0|1,0,0]=3 3387 B11R1.86 CC(C)NC1CCCNC1=O Amb18284472 [0,1,0,1,0,0|2,0,0]=4 3388 B11R1.86 CC(C)OC1CCCNC1=O Amb27469761 [0,1,0,1,0,0|2,0,0]=4 3389 B11R1.86 CC(N)CN1CCCNC1=O Amb28384442 [0,1,0,1,0,0|2,0,0]=4 3390 B11R1.86 CC(O)CC1CCCNC1=O Amb25677218 [0,1,0,1,0,0|1,0,0]=3 3391 B11R1.86 CC(O)CC1CNCCC1=O Amb27982435 [0,1,0,1,0,0|2,0,0]=4 3392 B11R1.86 CC(O)CN1CCCCC1=O Amb18791807 [0,1,0,1,0,0|2,0,0]=4 3393 B11R1.86 CC(O)CN1CCCNC1=O Amb27839949 [0,1,0,1,0,0|2,0,0]=4 3394 B11R1.86 CN(C)CC1CCCCC1=O Amb1146042 [0,1,0,1,0,0|2,0,0]=4 3395 B11R1.86 CN(C)CC1CCCCC1=O Amb2731500 [0,1,0,1,0,0|2,0,0]=4 3396 B11R1.86 O=C1CCCCC1CC(F)F Amb27642022 [0,1,0,1,0,0|2,0,0]=4 3397 B11R1.108 CC1CC(C(=O)O)C1C(=O)O Amb26595927 [0,1,0,1,0,0|1,0,1]=4 3398 B11R1.178 C=C(C)C1OCCC1C(=O)O Amb25149367 [0,1,0,1,0,0|1,0,1]=4 3399 B11R1.178 C=C(C)N1CCCC1C(=O)O Amb27176559 [0,1,0,1,0,0|1,0,1]=4 3400 B11R1.178 C=C(C)[C@@H]1OCC[C@@H]1C(=O)O Amb26585795 [0,1,0,1,0,0|1,0,1]=4 3401 B11R1.178 C=C(C)[C@H]1OCC[C@H]1C(=O)O Amb25176580 [0,1,0,1,0,0|1,0,1]=4 3402 B11R1.178 CC(=O)C1CCCC1C(=O)O Amb28120981 [0,1,0,1,0,0|0,0,1]=3 3403 B11R1.178 CC(=O)C1CCCC1C(C)=O Amb25792934 [0,1,0,1,0,0|1,0,1]=4 3404 B11R1.178 CC(=O)C1CNCC1C(=O)O Amb2694843 [0,1,0,1,0,0|1,0,1]=4 3405 B11R1.178 CC(=O)C1COCC1C(C)C Amb29882924 [0,1,0,1,0,0|2,0,0]=4 3406 B11R1.178 CC(=O)N1CCCC1C(=O)O Amb9745654 [0,1,0,1,0,0|1,0,1]=4 3407 B11R1.178 CC(=O)N1CCCC1C(C)O Amb27971076 [0,1,0,1,0,0|2,0,0]=4 3408 B11R1.178 CC(=O)N1CCC[C@@H]1C(=O)O Amb10072246 [0,1,0,1,0,0|1,0,1]=4 3409 B11R1.178 CC(=O)N1CCC[C@H]1C(=O)O Amb1154281 [0,1,0,1,0,0|1,0,1]=4 3410 B11R1.178 CC(=O)[C@@H]1CCC[C@H]1C(C)=O Amb25270242 [0,1,0,1,0,0|1,0,1]=4 3411 B11R1.178 CC(C)C1=C(C(=O)O)CCC1 Amb27471127 [0,1,0,1,0,0|0,0,2]=4 3412 B11R1.178 CC(C)C1CCCC1C(=O)O Amb27878368 [0,1,0,1,0,0|0,0,0]=2 3413 B11R1.178 CC(C)C1CCCN1C(=O)Cl Amb28314059 [0,1,0,1,0,0|2,0,0]=4 3414 B11R1.178 CC(C)C1CCN[C@@H]1C(=O)O Amb25976372 [0,1,0,1,0,0|1,0,0]=3 3415 B11R1.178 CC(C)C1CCOC1C(=O)O Amb24370040 [0,1,0,1,0,0|1,0,0]=3 3416 B11R1.178 CC(C)C1CNCC1C(=O)O Amb18200000 [0,1,0,1,0,0|1,0,0]=3 3417 B11R1.178 CC(C)C1NCCC1C(=O)O Amb18118168 [0,1,0,1,0,0|1,0,0]=3 3418 B11R1.178 CC(C)C1NCCC1C(=O)O Amb28652978 [0,1,0,1,0,0|1,0,0]=3 3419 B11R1.178 CC(C)C1OCCC1C(=O)O Amb25060562 [0,1,0,1,0,0|1,0,0]=3 3420 B11R1.178 CC(C)C1OCCC1C(N)=O Amb27176904 [0,1,0,1,0,0|2,0,0]=4 3421 B11R1.178 CC(C)N1CCCC1C(=O)O Amb9300413 [0,1,0,1,0,0|1,0,0]=3 3422 B11R1.178 CC(C)N1CCCC1C(N)=O Amb19651361 [0,1,0,1,0,0|2,0,0]=4 3423 B11R1.178 CC(C)N1CCC[C@@H]1C(=O)O Amb22587572 [0,1,0,1,0,0|1,0,0]=3 3424 B11R1.178 CC(C)N1CCC[C@@H]1C(=O)O Amb23385291 [0,1,0,1,0,0|1,0,0]=3 3425 B11R1.178 CC(C)N1CCC[C@H]1C(=O)O Amb10608520 [0,1,0,1,0,0|1,0,0]=3 3426 B11R1.178 CC(C)N1CCC[C@H]1C(N)=O Amb24691601 [0,1,0,1,0,0|2,0,0]=4 3427 B11R1.178 CC(C)[C@@H]1CCC[C@H]1C(=O)O Amb25911911 [0,1,0,1,0,0|0,0,0]=2 3428 B11R1.178 CC(C)[C@@H]1CCN[C@H]1C(=O)O Amb27208705 [0,1,0,1,0,0|1,0,0]=3 3429 B11R1.178 CC(C)[C@@H]1CCO[C@@H]1C(=O)O Amb25249400 [0,1,0,1,0,0|1,0,0]=3 3430 B11R1.178 CC(C)[C@@H]1CNC[C@H]1C(=O)O Amb22757835 [0,1,0,1,0,0|1,0,0]=3 3431 B11R1.178 CC(C)[C@@H]1NCC[C@@H]1C(=O)O Amb25175850 [0,1,0,1,0,0|1,0,0]=3 3432 B11R1.178 CC(C)[C@@H]1NCC[C@@H]1C(=O)O Amb32664829 [0,1,0,1,0,0|1,0,0]=3 3433 B11R1.178 CC(C)[C@@H]1NCC[C@H]1C(=O)O Amb18199983 [0,1,0,1,0,0|1,0,0]=3 3434 B11R1.178 CC(C)[C@H]1CCC[C@@H]1C(=O)O Amb27845503 [0,1,0,1,0,0|0,0,0]=2 3435 B11R1.178 CC(C)[C@H]1CCN[C@@H]1C(=O)O Amb28346326 [0,1,0,1,0,0|1,0,0]=3 3436 B11R1.178 CC(C)[C@H]1CCO[C@H]1C(=O)O Amb24636009 [0,1,0,1,0,0|1,0,0]=3 3437 B11R1.178 CC(C)[C@H]1CNC[C@@H]1C(=O)O Amb26603698 [0,1,0,1,0,0|1,0,0]=3 3438 B11R1.178 CC(C)[C@H]1CNC[C@H]1C(=O)O Amb34915029 [0,1,0,1,0,0|1,0,0]=3 3439 B11R1.178 CC(C)[C@H]1CNC[C@H]1C(=O)O Amb34916313 [0,1,0,1,0,0|1,0,0]=3 3440 B11R1.178 CC(C)[C@H]1NCC[C@@H]1C(=O)O Amb27204455 [0,1,0,1,0,0|1,0,0]=3 3441 B11R1.178 CC(C)[C@H]1OCC[C@@H]1C(=O)O Amb27980406 [0,1,0,1,0,0|1,0,0]=3 3442 B11R1.178 CC(N)C1CCCN1C(N)=O Amb27186287 [0,1,0,1,0,0|2,0,0]=4 3443 B11R1.178 CC(N)C1CNCC1C(=O)O Amb33495715 [0,1,0,1,0,0|1,0,0]=3 3444 B11R1.178 CN(C)C1CCOC1C(=O)O Amb32864314 [0,1,0,1,0,0|2,0,0]=4 3445 B11R1.178 CN(C)C1COCC1C(=O)O Amb27603592 [0,1,0,1,0,0|2,0,0]=4 3446 B11R1.178 CN(C)[C@@H]1CCC[C@@H]1C(=O)O Amb30040263 [0,1,0,1,0,0|1,0,0]=3 3447 B11R1.178 CS(=O)N1CCCC1C(=O)O Amb28195242 [0,1,0,1,0,0|2,0,0]=4 3448 B11R1.178 CS(=O)N1CCC[C@H]1C(=O)O Amb27777985 [0,1,0,1,0,0|2,0,0]=4 3449 B11R1.178 C[C@@H](Cl)N1CCC[C@H]1C(=O)O Amb24564235 [0,1,0,1,0,0|1,0,0]=3 3450 B11R1.178 C[C@H](Cl)N1CCC[C@H]1C(=O)O Amb26929670 [0,1,0,1,0,0|1,0,0]=3 3451 B11R1.178 NC(=O)C1CCCC1C(=O)O Amb25714211 [0,1,0,1,0,0|1,0,1]=4 3452 B11R1.178 NC(=O)[C@H]1CCC[C@@H]1C(Cl)Cl Amb27488784 [0,1,0,1,0,0|2,0,0]=4 3453 B11R1.178 NC(=O)[C@H]1CCC[C@H]1C(=O)O Amb28142020 [0,1,0,1,0,0|1,0,1]=4 3454 B11R1.178 O=C(O)C1CCCC1C(=O)Cl Amb27876458 [0,1,0,1,0,0|1,0,1]=4 3455 B11R1.178 O=C(O)C1CCCC1C(=O)O Amb2732979 [0,1,0,1,0,0|1,0,1]=4 3456 B11R1.178 O=C(O)C1CCCC1C(F)F Amb20668096 [0,1,0,1,0,0|1,0,0]=3 3457 B11R1.178 O=C(O)C1CCCC1[N+](=O)[O-] Amb27211214 [0,1,0,1,0,0|2,0,0]=4 3458 B11R1.178 O=C(O)C1CCOC1C(F)F Amb23560268 [0,1,0,1,0,0|2,0,0]=4 3459 B11R1.178 O=C(O)C1CNCC1C(F)F Amb25032500 [0,1,0,1,0,0|2,0,0]=4 3460 B11R1.178 O=C(O)C1CNCC1C(F)F Amb32665486 [0,1,0,1,0,0|2,0,0]=4 3461 B11R1.178 O=C(O)C1CNCC1C(O)O Amb28281392 [0,1,0,1,0,0|2,0,0]=4 3462 B11R1.178 O=C(O)[C@@H]1CCC[C@H]1C(=O)O Amb6299712 [0,1,0,1,0,0|1,0,1]=4 3463 B11R1.178 O=C(O)[C@@H]1CNC[C@H]1C(F)F Amb19375066 [0,1,0,1,0,0|2,0,0]=4 3464 B11R1.178 O=C(O)[C@@H]1CNC[C@H]1C(F)F Amb28709526 [0,1,0,1,0,0|2,0,0]=4 3465 B11R1.178 O=C(O)[C@H]1CCC[C@H]1C(=O)O Amb13890829 [0,1,0,1,0,0|1,0,1]=4 3466 B11R1.182 CC1CCC(=O)C(CCN)C1 Amb18200343 [0,1,0,1,0,0|2,0,0]=4 3467 B11R1.182 CC1CCC(=O)C(CCO)C1 Amb28365503 [0,1,0,1,0,0|2,0,0]=4 3468 B11R1.182 CCCC1CN(C)CCC1=O Amb24360265 [0,1,0,1,0,0|2,0,0]=4 3469 B11R1.182 CCCN1CC(C)NCC1=O Amb26000093 [0,1,0,1,0,0|2,0,0]=4 3470 B11R1.182 CCCN1CC(N)CCC1=O Amb19515734 [0,1,0,1,0,0|2,0,0]=4 3471 B11R1.182 CCCN1CC(N)CNC1=O Amb27242227 [0,1,0,1,0,0|2,0,0]=4 3472 B11R1.182 CCCN1CC(O)CNC1=O Amb28125572 [0,1,0,1,0,0|2,0,0]=4 3473 B11R1.184 CC1(C)CC(CCBr)C(=O)N1 Amb33330268 [0,1,0,1,0,0|2,0,0]=4 3474 B11R1.184 CC1(C)CC(CCN)C(=O)N1 Amb33482806 [0,1,0,1,0,0|2,0,0]=4 3475 B11R1.184 CC1(C)CC(CCN)C(=O)N1 Amb33482807 [0,1,0,1,0,0|2,0,0]=4 3476 B11R1.184 CC1(C)OC(=O)C(CCO)O1 Amb24447742 [0,1,0,1,0,0|2,0,0]=4 3477 B11R1.184 CC1(C)OC(=O)[C@H](CCO)O1 Amb22746098 [0,1,0,1,0,0|2,0,0]=4 3478 B11R1.234 CC(N)CC1CCCS1(=O)=O Amb35673535 [0,1,0,1,0,0|1,0,1]=4 3479 B11R1.497 CC(=O)C1CCCCN(C)C1 Amb27638717 [0,1,0,1,0,0|2,0,0]=4 3480 B11R1.497 CC(=O)N1CCCCC(N)C1 Amb27159512 [0,1,0,1,0,0|2,0,0]=4 3481 B11R1.497 CC(=O)N1CCNCC(C)C1 Amb26356798 [0,1,0,1,0,0|2,0,0]=4 3482 B11R1.497 CC(=O)N1CCSCC(C)C1 Amb28400630 [0,1,0,1,0,0|2,0,0]=4 3483 B11R1.497 CC1=NC(C(=O)O)CCCN1 Amb25807925 [0,1,0,1,0,0|1,0,1]=4 3484 B11R1.497 CC1=NCCC[C@H](C(=O)O)N1 Amb27231815 [0,1,0,1,0,0|1,0,1]=4 3485 B11R1.497 CC1=N[C@H](C(=O)O)CCCN1 Amb25060168 [0,1,0,1,0,0|1,0,1]=4 3486 B11R1.497 CC1CN(C(=O)Cl)CCCO1 Amb25960662 [0,1,0,1,0,0|2,0,0]=4 3487 B11R1.497 CC1COCCN(C(=O)Cl)C1 Amb24624434 [0,1,0,1,0,0|2,0,0]=4 3488 B11R1.497 CN1CCCCC(C(=O)O)C1 Amb32668486 [0,1,0,1,0,0|1,0,0]=3 3489 B11R1.497 CN1CCCCC(C(=O)O)C1 Amb8010549 [0,1,0,1,0,0|1,0,0]=3 3490 B11R1.497 CN1CCNCC(C(N)=O)C1 Amb20062219 [0,1,0,1,0,0|2,0,0]=4 3491 B11R1.497 CN1CCOCC(C(=O)O)C1 Amb27802817 [0,1,0,1,0,0|1,0,0]=3 3492 B11R1.497 NC(=O)N1CCCCC(F)C1 Amb27467024 [0,1,0,1,0,0|2,0,0]=4 3493 B11R1.497 O=C1CCCCC(C(=O)O)C1 Amb10603800 [0,1,0,1,0,0|0,0,1]=3 3494 B11R1.497 O=C1CCCCC(C(=O)O)N1 Amb19515429 [0,1,0,1,0,0|1,0,1]=4 3495 B11R1.497 O=C1CCOCC(C(=O)O)C1 Amb27414004 [0,1,0,1,0,0|1,0,1]=4 3496 B11R1.596 CCCC1C(=O)OC1C(=O)O Amb27793087 [0,1,0,1,0,0|1,0,1]=4 3497 B11R1.596 CCCN1C(=O)CC1C(=O)O Amb21959290 [0,1,0,1,0,0|1,0,1]=4 3498 B11R1.596 CCCN1C(=O)C[C@@H]1C(=O)O Amb28365473 [0,1,0,1,0,0|1,0,1]=4 3499 B11R1.596 CCC[C@H]1C(=O)O[C@@H]1C(=O)O Amb27657741 [0,1,0,1,0,0|1,0,1]=4 3500 B11R1.644 CN1CC(C(=O)O)CC1(C)C Amb35586335 [0,1,0,1,0,0|1,0,0]=3 3501 B11R1.644 N[C@H]1C[C@@H](C(=O)O)CC1(F)F Amb26388985 [0,1,0,1,0,0|2,0,0]=4 3502 B11R1.645 CC(=O)NC1CC(C)OC1=O Amb27597010 [0,1,0,1,0,0|1,0,1]=4 3503 B11R1.645 CC(=O)N[C@H]1C[C@@H](C)OC1=O Amb28052689 [0,1,0,1,0,0|1,0,1]=4 3504 B11R1.645 CC(C)CC1CC(=O)OC1=O Amb27641108 [0,1,0,1,0,0|1,0,1]=4 3505 B11R1.645 CC(C)NC1CC(C)OC1=O Amb27840174 [0,1,0,1,0,0|1,0,0]=3 3506 B11R1.645 CC(Cl)\C=C1\CC(C)OC1=O Amb27862929 [0,1,0,1,0,0|0,0,2]=4 3507 B11R1.645 CC(O)CN1CC(C)OC1=O Amb10808129 [0,1,0,1,0,0|1,0,0]=3 3508 B11R1.645 CC1=CC(=O)C(CC(C)C)C1 Amb27861201 [0,1,0,1,0,0|1,0,1]=4 3509 B11R1.645 CC1CC(=O)N(C[C@H](C)O)C1 Amb27965197 [0,1,0,1,0,0|2,0,0]=4 3510 B11R1.645 CC1CC(CN(C)C)C(=O)O1 Amb27875590 [0,1,0,1,0,0|1,0,0]=3 3511 B11R1.730 CC(=O)C1CCCC(C)(C)C1 Amb22168369 [0,1,0,1,0,0|1,0,0]=3 3512 B11R1.730 CC(=O)[C@H]1CCCC(C)(C)C1 Amb27945683 [0,1,0,1,0,0|1,0,0]=3 3513 B11R1.730 CC(O)C1CCCC(C)(C)C1 Amb27257154 [0,1,0,1,0,0|1,0,1]=4 3514 B11R1.730 CC1(C)C=C(C(=O)O)CCC1 Amb27232928 [0,1,0,1,0,0|0,0,2]=4 3515 B11R1.730 CC1(C)CC(C(=O)Cl)CCO1 Amb8496663 [0,1,0,1,0,0|2,0,0]=4 3516 B11R1.730 CC1(C)CC(C(=O)O)CCN1 Amb23590785 [0,1,0,1,0,0|1,0,0]=3 3517 B11R1.730 CC1(C)CC(C(=O)O)CCO1 Amb33545187 [0,1,0,1,0,0|1,0,0]=3 3518 B11R1.730 CC1(C)CC(C(=O)O)CCS1 Amb17594418 [0,1,0,1,0,0|1,0,0]=3 3519 B11R1.730 CC1(C)CC(C(N)=O)CCN1 Amb27186163 [0,1,0,1,0,0|2,0,0]=4 3520 B11R1.730 CC1(C)CCC=C(C(=O)O)C1 Amb26880179 [0,1,0,1,0,0|0,0,2]=4 3521 B11R1.730 CC1(C)CCCC(C(=N)N)C1 Amb32732291 [0,1,0,1,0,0|2,0,0]=4 3522 B11R1.730 CC1(C)CCCC(C(=O)Cl)C1 Amb25073230 [0,1,0,1,0,0|1,0,0]=3 3523 B11R1.730 CC1(C)CCCC(C(=O)O)C1 Amb22059548 [0,1,0,1,0,0|0,0,0]=2 3524 B11R1.730 CC1(C)CCCC(C(=O)O)O1 Amb26317586 [0,1,0,1,0,0|1,0,0]=3 3525 B11R1.730 CC1(C)CCCC(C(N)=S)C1 Amb32732293 [0,1,0,1,0,0|1,1,0]=4 3526 B11R1.730 CC1(C)CCCC([N+](=O)[O-])C1 Amb33299035 [0,1,0,1,0,0|1,0,1]=4 3527 B11R1.730 CC1(C)CCCN(C(=O)Cl)C1 Amb26371093 [0,1,0,1,0,0|2,0,0]=4 3528 B11R1.730 CC1(C)CCNC(C(=O)O)C1 Amb23589292 [0,1,0,1,0,0|1,0,0]=3 3529 B11R1.730 CC1(C)CCNC(C(=O)O)C1 Amb28872326 [0,1,0,1,0,0|1,0,0]=3 3530 B11R1.730 CC1(C)CCNC(C(=O)O)O1 Amb33194422 [0,1,0,1,0,0|2,0,0]=4 3531 B11R1.730 CC1(C)CCNC(C(N)=O)C1 Amb27625202 [0,1,0,1,0,0|2,0,0]=4 3532 B11R1.730 CC1(C)CNCC(C(=O)O)C1 Amb35789444 [0,1,0,1,0,0|1,0,0]=3 3533 B11R1.730 CC1(C)CNCC(C(=O)O)C1 Amb35789724 [0,1,0,1,0,0|1,0,0]=3 3534 B11R1.730 CC1(C)CNCC(C(=O)O)O1 Amb24509651 [0,1,0,1,0,0|2,0,0]=4 3535 B11R1.730 CC1(C)CNCC(C(=O)O)O1 Amb33743425 [0,1,0,1,0,0|2,0,0]=4 3536 B11R1.730 CC1(C)COCC(C(=O)O)N1 Amb28653017 [0,1,0,1,0,0|2,0,0]=4 3537 B11R1.730 CC1(C)COCC(C(=O)O)O1 Amb30623505 [0,1,0,1,0,0|2,0,0]=4 3538 B11R1.730 CC1(C)CSC[C@@H](C(=O)O)N1 Amb28142682 [0,1,0,1,0,0|2,0,0]=4 3539 B11R1.730 CC1(Cl)CCCC(C(=O)Cl)C1 Amb26074487 [0,1,0,1,0,0|1,0,0]=3 3540 B11R1.730 CC1(Cl)CCCC(C(=O)O)C1 Amb18648012 [0,1,0,1,0,0|0,0,0]=2 3541 B11R1.730 CC1(F)CCCC(C(=O)O)C1 Amb27872745 [0,1,0,1,0,0|0,0,0]=2 3542 B11R1.730 C[C@@H](O)C1CCCC(C)(C)C1 Amb26614756 [0,1,0,1,0,0|1,0,1]=4 3543 B11R1.730 C[C@@H](O)[C@H]1CCCC(C)(C)C1 Amb28318854 [0,1,0,1,0,0|1,0,1]=4 3544 B11R1.730 C[C@H](O)C1CCCC(C)(C)C1 Amb24466278 [0,1,0,1,0,0|1,0,1]=4 3545 B11R1.730 C[Si]1(C)CCCC(C(=O)O)C1 Amb27835538 [0,1,0,1,0,0|0,1,0]=3 3546 B11R1.730 NC(=O)C1CCCC(F)(F)C1 Amb25858343 [0,1,0,1,0,0|2,0,0]=4 3547 B11R1.730 O=C(Cl)C1CCCC(F)(F)C1 Amb27408072 [0,1,0,1,0,0|2,0,0]=4 3548 B11R1.730 O=C(O)C1CC(F)(F)CCN1 Amb26964474 [0,1,0,1,0,0|2,0,0]=4 3549 B11R1.730 O=C(O)C1CC(F)(F)CCN1 Amb33484267 [0,1,0,1,0,0|2,0,0]=4 3550 B11R1.730 O=C(O)C1CCCC(F)(F)C1 Amb22738663 [0,1,0,1,0,0|1,0,0]=3 3551 B11R1.730 O=C(O)C1CCCS(=O)(=O)C1 Amb15701364 [0,1,0,1,0,0|2,0,0]=4 3552 B11R1.730 O=C(O)C1CNCC(F)(F)C1 Amb22411162 [0,1,0,1,0,0|2,0,0]=4 3553 B11R1.730 O=C(O)C1CNCC(F)(F)C1 Amb25259159 [0,1,0,1,0,0|2,0,0]=4 3554 B11R1.730 O=C(O)[C@@H]1CC(F)(F)CCN1 Amb27598022 [0,1,0,1,0,0|2,0,0]=4 3555 B11R1.730 O=C(O)[C@@H]1CC(O)(O)CCN1 Amb27632354 [0,1,0,1,0,0|2,0,0]=4 3556 B11R1.730 O=C(O)[C@@H]1CCCS(=O)(=O)C1 Amb27607684 [0,1,0,1,0,0|2,0,0]=4 3557 B11R1.730 O=C(O)[C@H]1CCCS(=O)(=O)C1 Amb27945434 [0,1,0,1,0,0|2,0,0]=4 3558 B11R1.782 C#CCC1(C(=O)O)CC(C)C1 Amb23449224 [0,1,0,1,0,0|0,0,2]=4 3559 B11R1.782 C=CCC1(C(=O)O)CC(C)C1 Amb35651459 [0,1,0,1,0,0|0,0,2]=4 3560 B11R1.782 CC1CC(CC#N)(C(=O)O)C1 Amb29887168 [0,1,0,1,0,0|1,0,1]=4 3561 B11R1.782 CC1CC(CCF)(C(=O)O)C1 Amb32946555 [0,1,0,1,0,0|1,0,0]=3 3562 B11R1.782 CC1CC(CCO)(C(=O)O)C1 Amb32946253 [0,1,0,1,0,0|1,0,0]=3 3563 B11R1.782 CCCC1(C(=O)O)CC(=O)C1 Amb33374800 [0,1,0,1,0,0|0,0,1]=3 3564 B11R1.782 CCCC1(C(=O)O)CC(C)C1 Amb23449209 [0,1,0,1,0,0|0,0,0]=2 3565 B11R1.782 CCCC1(C(=O)O)CC(N)C1 Amb33374784 [0,1,0,1,0,0|0,0,0]=2 3566 B11R1.782 CCCC1(C(=O)O)CC(O)C1 Amb33374799 [0,1,0,1,0,0|0,0,0]=2 3567 B11R1.782 CCSC1(C(=O)O)CC(=O)C1 Amb27470440 [0,1,0,1,0,0|1,0,1]=4 3568 B11R1.782 CCSC1(C(=O)O)CC(C)C1 Amb26590380 [0,1,0,1,0,0|1,0,0]=3 3569 B11R1.782 CCSC1(C(=O)O)CC(O)C1 Amb24683401 [0,1,0,1,0,0|1,0,0]=3 3570 B11R1.782 COCC1(C(=O)O)CC(=O)C1 Amb33429411 [0,1,0,1,0,0|1,0,1]=4 3571 B11R1.782 COCC1(C(=O)O)CC(C)C1 Amb30666540 [0,1,0,1,0,0|1,0,0]=3 3572 B11R1.782 COCC1(C(=O)O)CC(N)C1 Amb33429409 [0,1,0,1,0,0|1,0,0]=3 3573 B11R1.782 COCC1(C(=O)O)CC(O)C1 Amb33429410 [0,1,0,1,0,0|1,0,0]=3 3574 B11R1.782 CSCC1(C(=O)O)CC(=O)C1 Amb33269654 [0,1,0,1,0,0|1,0,1]=4 3575 B11R1.782 CSCC1(C(=O)O)CC(N)C1 Amb33269652 [0,1,0,1,0,0|1,0,0]=3 3576 B11R1.782 CSCC1(C(=O)O)CC(O)C1 Amb33269653 [0,1,0,1,0,0|1,0,0]=3 3577 B11R1.782 NC1CC(CCF)(C(=O)O)C1 Amb33195737 [0,1,0,1,0,0|1,0,0]=3 3578 B11R1.782 O=C(O)C1(CCF)CC(O)C1 Amb33195738 [0,1,0,1,0,0|1,0,0]=3 3579 B11R1.782 O=C(O)C1(CCO)CC(F)C1 Amb32946257 [0,1,0,1,0,0|1,0,0]=3 3580 B11R1.782 O=C1CC(CCF)(C(=O)O)C1 Amb33195740 [0,1,0,1,0,0|1,0,1]=4 3581 B11R1.793 CC1(C)CC1(CCF)C(=O)O Amb32954251 [0,1,0,1,0,0|1,0,0]=3 3582 B11R1.793 CCCC1(C(=O)O)CC1(C)C Amb24423445 [0,1,0,1,0,0|0,0,0]=2 3583 B11R1.793 CCCC1(C(=O)O)CC1(F)F Amb32813264 [0,1,0,1,0,0|1,0,0]=3 3584 B11R1.793 COCC1(C(=O)O)CC1(C)C Amb23541311 [0,1,0,1,0,0|1,0,0]=3 3585 B11R1.793 COCC1(C(=O)O)CC1(F)F Amb33337746 [0,1,0,1,0,0|2,0,0]=4 3586 B11R1.793 CSCC1(C(=O)O)CC1(C)C Amb33271712 [0,1,0,1,0,0|1,0,0]=3 3587 B11R1.793 CSCC1(C(=O)O)CC1(F)F Amb33413053 [0,1,0,1,0,0|2,0,0]=4 3588 B11R1.793 O=C(O)C1(CCF)CC1(F)F Amb33399977 [0,1,0,1,0,0|2,0,0]=4 3589 B11R1.806 CCN[C@H](CC1CC1)C(=O)O Amb33347503 [0,1,0,1,0,0|1,0,0]=3 3590 B11R1.806 COCC(NC1CC1)C(=O)O Amb28652825 [0,1,0,1,0,0|1,0,0]=3 3591 B11R1.925 CC(=O)NC(C(=O)O)C1CC1 Amb18300436 [0,1,0,1,0,0|1,0,1]=4 3592 B11R1.925 CC(C)CN(C(N)=O)C1CC1 Amb18179669 [0,1,0,1,0,0|2,0,0]=4 3593 B11R1.925 CN(C)CC(C(=O)O)C1CC1 Amb28080548 [0,1,0,1,0,0|1,0,0]=3 3594 B11R1.925 CS(=O)NC(C(=O)O)C1CC1 Amb27272518 [0,1,0,1,0,0|2,0,0]=4 3595 B11R1.925 O=C(O)CC(C(=O)O)C1CC1 Amb27990116 [0,1,0,1,0,0|1,0,1]=4 3596 B11R1.929 CC(=O)CC1(C(=O)O)CCC1 Amb25893452 [0,1,0,1,0,0|0,0,1]=3 3597 B11R1.929 CC(=O)CC1(C(N)=O)CCC1 Amb27853639 [0,1,0,1,0,0|1,0,1]=4 3598 B11R1.929 CC(C)CC1(C(=O)O)CCC1 Amb20668017 [0,1,0,1,0,0|0,0,0]=2 3599 B11R1.929 CC(C)CC1(C(=O)O)CNC1 Amb27850062 [0,1,0,1,0,0|1,0,0]=3 3600 B11R1.929 CC(C)CC1(C(=O)O)COC1 Amb32645649 [0,1,0,1,0,0|1,0,0]=3 3601 B11R1.929 CC(C)OC1(C(=O)O)CCC1 Amb24742328 [0,1,0,1,0,0|1,0,0]=3 3602 B11R1.929 CC(C)OC1(C(=O)O)CNC1 Amb23439881 [0,1,0,1,0,0|2,0,0]=4 3603 B11R1.929 CC(C)OC1(C(=O)O)COC1 Amb35585380 [0,1,0,1,0,0|2,0,0]=4 3604 B11R1.929 CC(C)OC1(C(=O)O)CSC1 Amb27879931 [0,1,0,1,0,0|2,0,0]=4 3605 B11R1.929 CC(C)SC1(C(=O)O)CCC1 Amb24486645 [0,1,0,1,0,0|1,0,0]=3 3606 B11R1.929 CC(O)CC1(C(=O)O)CNC1 Amb27811179 [0,1,0,1,0,0|1,0,0]=3 3607 B11R1.929 NC(=O)CC1(C(=O)O)CCC1 Amb28367169 [0,1,0,1,0,0|1,0,1]=4 3608 B11R1.929 O=C(O)C1(CC(F)F)CCC1 Amb24513881 [0,1,0,1,0,0|1,0,0]=3 3609 B11R1.929 O=C(O)C1(CC(F)F)CNC1 Amb27784583 [0,1,0,1,0,0|2,0,0]=4 3610 B11R1.53 C#CC1CCCCC1C(=O)O Amb27478096 [0,1,0,1,0,0|0,0,2]=4 3611 B11R1.53 C=CC1CCCCC1C(=O)O Amb18644639 [0,1,0,1,0,0|0,0,2]=4 3612 B11R1.53 C=CC1OCCCC1C(=O)O Amb25175776 [0,1,0,1,0,0|0,0,2]=4 3613 B11R1.53 C=C[C@@H]1CCCC[C@@H]1C(=O)O Amb27865534 [0,1,0,1,0,0|0,0,2]=4 3614 B11R1.53 C=C[C@@H]1CCCC[C@H]1C(=O)O Amb26552392 [0,1,0,1,0,0|0,0,2]=4 3615 B11R1.53 C=C[C@@H]1OCCC[C@H]1C(=O)O Amb25228867 [0,1,0,1,0,0|0,0,2]=4 3616 B11R1.53 CC(=O)C1CCCCC1CN Amb24488210 [0,1,0,1,0,0|2,0,0]=4 3617 B11R1.53 CC(=O)C1CCCCC1CO Amb28144180 [0,1,0,1,0,0|2,0,0]=4 3618 B11R1.53 CC(=O)[C@@H]1CCCC[C@@H]1CN Amb33132917 [0,1,0,1,0,0|2,0,0]=4 3619 B11R1.53 CC(=O)[C@H]1CCCC[C@@H]1CBr Amb27252188 [0,1,0,1,0,0|2,0,0]=4 3620 B11R1.53 CC(=O)[C@H]1CCCC[C@@H]1CCl Amb27634843 [0,1,0,1,0,0|2,0,0]=4 3621 B11R1.53 CCC1=C(C(=O)O)CCCO1 Amb24528967 [0,1,0,1,0,0|0,0,2]=4 3622 B11R1.53 CCC1C=CCCC1C(=O)O Amb28384133 [0,1,0,1,0,0|0,0,1]=3 3623 B11R1.53 CCC1CC=CCC1C(C)=O Amb25699945 [0,1,0,1,0,0|1,0,1]=4 3624 B11R1.53 CCC1CCCCC1B(O)O Amb21927861 [0,1,0,1,0,0|1,0,1]=4 3625 B11R1.53 CCC1CCCCC1C(=O)O Amb27606678 [0,1,0,1,0,0|0,0,0]=2 3626 B11R1.53 CCC1CCCCC1C(N)=O Amb27989232 [0,1,0,1,0,0|1,0,0]=3 3627 B11R1.53 CCC1CCCCC1[N+](=O)[O-] Amb33299040 [0,1,0,1,0,0|1,0,1]=4 3628 B11R1.53 CCC1CCCCN1C(N)=O Amb8873523 [0,1,0,1,0,0|2,0,0]=4 3629 B11R1.53 CCC1CCCNC1C(=O)O Amb26014486 [0,1,0,1,0,0|0,0,0]=2 3630 B11R1.53 CCC1CCNCC1C(=O)O Amb18199964 [0,1,0,1,0,0|0,0,0]=2 3631 B11R1.53 CCC1CCNCC1C(N)=O Amb28286755 [0,1,0,1,0,0|1,0,0]=3 3632 B11R1.53 CCC1CNCCC1C(=O)O Amb33275584 [0,1,0,1,0,0|0,0,0]=2 3633 B11R1.53 CCC1CNCCC1C(C)=O Amb32676965 [0,1,0,1,0,0|1,0,0]=3 3634 B11R1.53 CCC1CNCCC1C(N)=O Amb27186164 [0,1,0,1,0,0|1,0,0]=3 3635 B11R1.53 CCC1COCCC1C(=O)O Amb27791043 [0,1,0,1,0,0|0,0,0]=2 3636 B11R1.53 CCC1COCCN1C(=O)Cl Amb25063966 [0,1,0,1,0,0|2,0,0]=4 3637 B11R1.53 CCC1NCCCC1C(=O)O Amb27858957 [0,1,0,1,0,0|0,0,0]=2 3638 B11R1.53 CCC1OCCCC1C(=O)O Amb26441727 [0,1,0,1,0,0|0,0,0]=2 3639 B11R1.53 CCC1OCCCC1C(N)=O Amb27752806 [0,1,0,1,0,0|1,0,0]=3 3640 B11R1.53 CCN1CCCCC1C(=O)O Amb10603421 [0,1,0,1,0,0|1,0,0]=3 3641 B11R1.53 CCN1CCCCC1C(=O)O Amb9299667 [0,1,0,1,0,0|1,0,0]=3 3642 B11R1.53 CCN1CCCC[C@@H]1C(=O)O Amb27400269 [0,1,0,1,0,0|1,0,0]=3 3643 B11R1.53 CCN1CCCC[C@H]1C(=O)O Amb28244690 [0,1,0,1,0,0|1,0,0]=3 3644 B11R1.53 CCN1CCNCC1C(=O)O Amb18199893 [0,1,0,1,0,0|1,0,0]=3 3645 B11R1.53 CCN1CCOCC1C(=O)O Amb28652958 [0,1,0,1,0,0|1,0,0]=3 3646 B11R1.53 CCN1CCOCC1C(N)=O Amb23585603 [0,1,0,1,0,0|2,0,0]=4 3647 B11R1.53 CCN1CCSCC1C(N)=O Amb27766367 [0,1,0,1,0,0|2,0,0]=4 3648 B11R1.53 CC[C@@H]1CCCC[C@H]1C(C)=O Amb25232533 [0,1,0,1,0,0|1,0,0]=3 3649 B11R1.53 CC[C@@H]1CCCN[C@@H]1C(=O)O Amb28200831 [0,1,0,1,0,0|0,0,0]=2 3650 B11R1.53 CC[C@@H]1NCCC[C@H]1C(=O)O Amb18199984 [0,1,0,1,0,0|0,0,0]=2 3651 B11R1.53 CC[C@@H]1OCCC[C@@H]1C(=O)O Amb27858544 [0,1,0,1,0,0|0,0,0]=2 3652 B11R1.53 CC[C@H]1CC=CC[C@@H]1C(=O)O Amb27252233 [0,1,0,1,0,0|0,0,1]=3 3653 B11R1.53 CC[C@H]1CCCN[C@@H]1C(=O)O Amb27620290 [0,1,0,1,0,0|0,0,0]=2 3654 B11R1.53 CNC1CCCC=C1C(=O)O Amb27411507 [0,1,0,1,0,0|1,0,1]=4 3655 B11R1.53 CNC1CCCCC1C(=O)O Amb26595951 [0,1,0,1,0,0|1,0,0]=3 3656 B11R1.53 CNC1CCCCC1C(N)=O Amb25255322 [0,1,0,1,0,0|2,0,0]=4 3657 B11R1.53 CNC1CCOCC1C(N)=O Amb27637346 [0,1,0,1,0,0|2,0,0]=4 3658 B11R1.53 CN[C@@H]1CCCC[C@@H]1C(N)=O Amb27631439 [0,1,0,1,0,0|2,0,0]=4 3659 B11R1.53 COC1CCCCC1C(=O)Cl Amb25124892 [0,1,0,1,0,0|2,0,0]=4 3660 B11R1.53 COC1CCCCC1C(=O)O Amb18967398 [0,1,0,1,0,0|1,0,0]=3 3661 B11R1.53 COC1CCCCC1C(C)=O Amb27762537 [0,1,0,1,0,0|2,0,0]=4 3662 B11R1.53 COC1CCCCC1C(N)=O Amb27152949 [0,1,0,1,0,0|2,0,0]=4 3663 B11R1.53 COC1CCNCC1C(=O)O Amb27427525 [0,1,0,1,0,0|1,0,0]=3 3664 B11R1.53 COC1CCOCC1C(=O)O Amb27813521 [0,1,0,1,0,0|1,0,0]=3 3665 B11R1.53 COC1CNCCC1C(=O)O Amb26427777 [0,1,0,1,0,0|1,0,0]=3 3666 B11R1.53 COC1COCCC1C(=O)O Amb27399112 [0,1,0,1,0,0|1,0,0]=3 3667 B11R1.53 COC1OCCCC1C(=O)O Amb28245261 [0,1,0,1,0,0|1,0,0]=3 3668 B11R1.53 CO[C@@H]1C=CCC[C@@H]1C(=O)O Amb27983665 [0,1,0,1,0,0|1,0,1]=4 3669 B11R1.53 CO[C@H]1CCCC[C@@H]1C(=O)O Amb27845470 [0,1,0,1,0,0|1,0,0]=3 3670 B11R1.53 N#CC1CCCCC1C(=O)O Amb18125545 [0,1,0,1,0,0|1,0,1]=4 3671 B11R1.53 N#CC1OCCCC1C(=O)O Amb26422773 [0,1,0,1,0,0|1,0,1]=4 3672 B11R1.53 NC(=O)C1CCCCC1CO Amb28365379 [0,1,0,1,0,0|2,0,0]=4 3673 B11R1.53 NC(=O)[C@@H]1CCCC[C@@H]1CO Amb26884904 [0,1,0,1,0,0|2,0,0]=4 3674 B11R1.53 NC(=O)[C@@H]1CCCC[C@H]1CO Amb16233807 [0,1,0,1,0,0|2,0,0]=4 3675 B11R1.53 NC(=O)[C@H]1CCCC[C@H]1CO Amb25362020 [0,1,0,1,0,0|2,0,0]=4 3676 B11R1.53 NCC1CCCCC1C(=O)O Amb18126060 [0,1,0,1,0,0|1,0,0]=3 3677 B11R1.53 NC[C@@H]1CCCC[C@@H]1C(=O)O Amb22901093 [0,1,0,1,0,0|1,0,0]=3 3678 B11R1.53 NC[C@@H]1CCCC[C@@H]1C(=O)O Amb24602383 [0,1,0,1,0,0|1,0,0]=3 3679 B11R1.53 O=C(O)C1=CCCCC1CO Amb27401800 [0,1,0,1,0,0|1,0,1]=4 3680 B11R1.53 O=C(O)C1CC=CCC1CO Amb28397357 [0,1,0,1,0,0|1,0,1]=4 3681 B11R1.53 O=C(O)C1CCCCC1CCl Amb28121870 [0,1,0,1,0,0|1,0,0]=3 3682 B11R1.53 O=C(O)C1CCCCC1CF Amb20668097 [0,1,0,1,0,0|1,0,0]=3 3683 B11R1.53 O=C(O)C1CCCCC1CO Amb24484407 [0,1,0,1,0,0|1,0,0]=3 3684 B11R1.53 O=C(O)C1CCNCC1CO Amb28053243 [0,1,0,1,0,0|1,0,0]=3 3685 B11R1.53 O=C(O)C1CNCCC1CO Amb27215492 [0,1,0,1,0,0|1,0,0]=3 3686 B11R1.53 O=C(O)C1NCCOC1CO Amb27423296 [0,1,0,1,0,0|2,0,0]=4 3687 B11R1.53 O=C(O)[C@@H]1CCCN[C@H]1CO Amb18199870 [0,1,0,1,0,0|1,0,0]=3 3688 B11R1.53 O=C(O)[C@H]1CCCC[C@H]1CO Amb24615220 [0,1,0,1,0,0|1,0,0]=3 3689 B11R1.53 O=C(O)[C@H]1CCCN[C@@H]1CO Amb27420244 [0,1,0,1,0,0|1,0,0]=3 3690 B11R1.143 C=C(C)C1CCCCCC1O Amb25788203 [0,1,0,1,0,0|2,0,0]=4 3691 B11R1.143 C=C(C)[C@@H]1CCCCC[C@H]1O Amb32944787 [0,1,0,1,0,0|2,0,0]=4 3692 B11R1.143 CC(=O)C1CCCCCC1=O Amb18796759 [0,1,0,1,0,0|1,0,1]=4 3693 B11R1.143 CC(=O)C1CCCCCC1C Amb35725700 [0,1,0,1,0,0|1,0,0]=3 3694 B11R1.143 CC(=O)C1CCCCCC1N Amb26968176 [0,1,0,1,0,0|1,0,0]=3 3695 B11R1.143 CC(=O)C1CCCCCC1O Amb32945460 [0,1,0,1,0,0|1,0,0]=3 3696 B11R1.143 CC(=O)C1CCCCCN1C Amb27963187 [0,1,0,1,0,0|2,0,0]=4 3697 B11R1.143 CC(=O)[C@@H]1CCCCC[C@@H]1N Amb33307461 [0,1,0,1,0,0|1,0,0]=3 3698 B11R1.143 CC(=O)[C@@H]1CCCCC[C@H]1O Amb32945317 [0,1,0,1,0,0|1,0,0]=3 3699 B11R1.143 CC(O)C1CCCCCC1C Amb35672756 [0,1,0,1,0,0|1,0,1]=4 3700 B11R1.143 CC(O)C1CCCCCC1N Amb35587050 [0,1,0,1,0,0|1,0,1]=4 3701 B11R1.143 CC1CCNCCC1C(=O)O Amb27445777 [0,1,0,1,0,0|1,0,0]=3 3702 B11R1.143 CC1CCOCCC1C(=O)O Amb27861013 [0,1,0,1,0,0|1,0,0]=3 3703 B11R1.143 CC1NCCCCC1C(=O)O Amb27597000 [0,1,0,1,0,0|1,0,0]=3 3704 B11R1.143 CN1CCCCCC1C(=O)O Amb3941310 [0,1,0,1,0,0|1,0,0]=3 3705 B11R1.143 CN1CCCCCC1C(=O)O Amb8503498 [0,1,0,1,0,0|1,0,0]=3 3706 B11R1.143 CN1CCCCCC1C(N)=O Amb27607657 [0,1,0,1,0,0|2,0,0]=4 3707 B11R1.143 CN1CCCOCC1C(=O)O Amb27842358 [0,1,0,1,0,0|2,0,0]=4 3708 B11R1.143 C[C@@H]1NCCCC[C@H]1C(=O)O Amb18199981 [0,1,0,1,0,0|1,0,0]=3 3709 B11R1.143 C[C@H]1NCCCC[C@@H]1C(=O)O Amb27420245 [0,1,0,1,0,0|1,0,0]=3 3710 B11R1.143 NC(=O)C1CCCCCC1N Amb20668797 [0,1,0,1,0,0|1,0,0]=3 3711 B11R1.143 NC(=O)C1CCCCCC1N Amb22059737 [0,1,0,1,0,0|1,0,0]=3 3712 B11R1.143 NC(=O)C1CCCCCC1O Amb25760752 [0,1,0,1,0,0|1,0,0]=3 3713 B11R1.143 NC(=O)C1CCNCCC1F Amb27636642 [0,1,0,1,0,0|2,0,0]=4 3714 B11R1.143 NC(=O)C1CCNCCC1O Amb27843740 [0,1,0,1,0,0|2,0,0]=4 3715 B11R1.143 NC(=O)C1CNCCCC1O Amb27814437 [0,1,0,1,0,0|2,0,0]=4 3716 B11R1.143 NC(=O)[C@@H]1CCCCC[C@H]1O Amb28137536 [0,1,0,1,0,0|1,0,0]=3 3717 B11R1.143 NC1CCCCCC1C(=O)O Amb2694961 [0,1,0,1,0,0|0,0,0]=2 3718 B11R1.143 NC1CCCCCC1C(=O)O Amb8630073 [0,1,0,1,0,0|0,0,0]=2 3719 B11R1.143 NC1CCNCCC1C(=O)O Amb26917458 [0,1,0,1,0,0|1,0,0]=3 3720 B11R1.143 NC1CCOCCC1C(=O)O Amb28051653 [0,1,0,1,0,0|1,0,0]=3 3721 B11R1.143 NC1CCSCCC1C(=O)O Amb28051654 [0,1,0,1,0,0|1,0,0]=3 3722 B11R1.143 NS(=O)C1CCCCCC1F Amb32720762 [0,1,0,1,0,0|2,0,0]=4 3723 B11R1.143 N[C@@H]1CCCCC[C@@H]1C(=O)O Amb1993851 [0,1,0,1,0,0|0,0,0]=2 3724 B11R1.143 N[C@@H]1CCCCC[C@@H]1C(=O)O Amb1994004 [0,1,0,1,0,0|0,0,0]=2 3725 B11R1.143 N[C@@H]1CCCCC[C@H]1C(=O)O Amb27635591 [0,1,0,1,0,0|0,0,0]=2 3726 B11R1.143 N[C@H]1CCCCC[C@@H]1C(=O)O Amb28411250 [0,1,0,1,0,0|0,0,0]=2 3727 B11R1.143 N[C@H]1CCCCC[C@H]1C(=O)O Amb1993850 [0,1,0,1,0,0|0,0,0]=2 3728 B11R1.143 N[C@H]1CCCCC[C@H]1C(=O)O Amb1994003 [0,1,0,1,0,0|0,0,0]=2 3729 B11R1.143 O=C(O)C1=C(Cl)CCCCC1 Amb27858604 [0,1,0,1,0,0|0,0,2]=4 3730 B11R1.143 O=C(O)C1CCCCCC1O Amb18280963 [0,1,0,1,0,0|0,0,0]=2 3731 B11R1.143 O=C(O)C1CCCCCC1S Amb18949212 [0,1,0,1,0,0|0,0,0]=2 3732 B11R1.143 O=C(O)C1CCCCNC1=O Amb33803563 [0,1,0,1,0,0|1,0,1]=4 3733 B11R1.143 O=C(O)C1CCOCCC1O Amb27613245 [0,1,0,1,0,0|1,0,0]=3 3734 B11R1.143 O=C(O)[C@@H]1CCCCC[C@@H]1O Amb27848050 [0,1,0,1,0,0|0,0,0]=2 3735 B11R1.143 O=C(O)[C@H]1CCCCC[C@@H]1O Amb27848051 [0,1,0,1,0,0|0,0,0]=2 3736 B11R1.143 O=S(Cl)C1CCCCCC1F Amb32720756 [0,1,0,1,0,0|2,0,0]=4 3737 B11R1.143 O=S([O-])C1CCCCCC1F Amb32755065 [0,1,0,1,0,0|1,0,1]=4 3738 B11R1.143 O=[N+]([O-])C1CCCCCC1O Amb18199867 [0,1,0,1,0,0|1,0,1]=4 3739 B11R1.159 CC(=O)C1CCCC(O)C1O Amb27599413 [0,1,0,1,0,0|2,0,0]=4 3740 B11R1.159 CC(=O)C1CCCN(C)C1C Amb26496854 [0,1,0,1,0,0|2,0,0]=4 3741 B11R1.159 CC1=CCCC(C(=O)O)C1C Amb27864075 [0,1,0,1,0,0|0,0,2]=4 3742 B11R1.159 CC1C(Cl)CCCC1C(=O)Cl Amb27872344 [0,1,0,1,0,0|2,0,0]=4 3743 B11R1.159 CC1C(N)CCCC1C(N)=O Amb18182134 [0,1,0,1,0,0|2,0,0]=4 3744 B11R1.159 CC1CCCC(C(=O)O)=C1Cl Amb27985826 [0,1,0,1,0,0|0,0,2]=4 3745 B11R1.159 CC1CCCC(C(=O)O)C1N Amb28132204 [0,1,0,1,0,0|0,0,0]=2 3746 B11R1.159 CC1CCCC(C(=O)[Na])C1=O Amb27945682 [0,1,0,1,0,0|1,0,1]=4 3747 B11R1.159 CC1CCCC(C(N)=O)C1C Amb25100897 [0,1,0,1,0,0|1,0,0]=3 3748 B11R1.159 CC1CCCN(C(=O)Cl)C1C Amb27760181 [0,1,0,1,0,0|2,0,0]=4 3749 B11R1.159 CC1NCCC(C(=O)O)C1C Amb28136882 [0,1,0,1,0,0|1,0,0]=3 3750 B11R1.159 CN1CCCC(C(=O)O)C1=O Amb23571786 [0,1,0,1,0,0|1,0,1]=4 3751 B11R1.159 C[C@@H]1CNC[C@H](C(=O)O)[C@@H]1O Amb27233628 [0,1,0,1,0,0|1,0,0]=3 3752 B11R1.159 C[C@@H]1[C@@H](C(=O)O)CCCN1C Amb18199985 [0,1,0,1,0,0|1,0,0]=3 3753 B11R1.159 C[C@H]1COC[C@@H](C(=O)O)N1C Amb27883227 [0,1,0,1,0,0|2,0,0]=4 3754 B11R1.159 C[C@H]1[C@@H](O)CCC[C@H]1C(=O)O Amb28051870 [0,1,0,1,0,0|1,0,0]=3 3755 B11R1.159 NC1CCCC(C(=O)O)C1O Amb27237633 [0,1,0,1,0,0|1,0,0]=3 3756 B11R1.159 N[C@H]1CCC[C@H](C(=O)O)[C@@H]1O Amb24557744 [0,1,0,1,0,0|1,0,0]=3 3757 B11R1.159 N[C@H]1[C@@H](C(=O)O)CCC[C@H]1O Amb27640678 [0,1,0,1,0,0|1,0,0]=3 3758 B11R1.159 O=C(O)C1CCCC(Br)C1=O Amb32409892 [0,1,0,1,0,0|1,0,1]=4 3759 B11R1.159 O=C(O)[C@H]1NCC[C@@H](O)[C@@H]1O Amb28457421 [0,1,0,1,0,0|2,0,0]=4 3760 B11R1.159 O=C(O)[C@H]1NCC[C@@H](O)[C@H]1O Amb27860415 [0,1,0,1,0,0|2,0,0]=4 3761 B11R1.167 C=C1CCC(C)C(C(=O)O)C1 Amb28119008 [0,1,0,1,0,0|0,0,2]=4 3762 B11R1.167 CC(=O)C1CC(C)CCC1=O Amb18796760 [0,1,0,1,0,0|1,0,1]=4 3763 B11R1.167 CC(=O)C1CC(C)CCC1=S Amb27823420 [0,1,0,1,0,0|1,0,1]=4 3764 B11R1.167 CC(=O)C1CN(C)CCC1C Amb26041036 [0,1,0,1,0,0|2,0,0]=4 3765 B11R1.167 CC(=O)N1CC(C)CCC1C Amb25857858 [0,1,0,1,0,0|2,0,0]=4 3766 B11R1.167 CC(=O)N1C[C@H](C)CC[C@H]1C Amb24441069 [0,1,0,1,0,0|2,0,0]=4 3767 B11R1.167 CC1=CC[C@H](N)[C@H](C(=O)O)C1 Amb27645344 [0,1,0,1,0,0|0,0,2]=4 3768 B11R1.167 CC1C=CC(C)C(C(=O)O)C1 Amb27176585 [0,1,0,1,0,0|0,0,2]=4 3769 B11R1.167 CC1C=CC(N)C(C(=O)O)C1 Amb24422921 [0,1,0,1,0,0|0,0,2]=4 3770 B11R1.167 CC1CC(C(=O)O)C(C)CN1 Amb32757575 [0,1,0,1,0,0|1,0,0]=3 3771 B11R1.167 CC1CC(C(=O)O)C(C)CN1 Amb32830931 [0,1,0,1,0,0|1,0,0]=3 3772 B11R1.167 CC1CCC(=O)C(C(=O)O)C1 Amb33194615 [0,1,0,1,0,0|0,0,1]=3 3773 B11R1.167 CC1CCC(=O)CC1C(=O)O Amb32867785 [0,1,0,1,0,0|1,0,1]=4 3774 B11R1.167 CC1CCC(C)C(C(=O)O)C1 Amb27870887 [0,1,0,1,0,0|0,0,0]=2 3775 B11R1.167 CC1CCC(C)C(C(=O)O)N1 Amb33072383 [0,1,0,1,0,0|1,0,0]=3 3776 B11R1.167 CC1CCC(C)C(C(N)=O)C1 Amb26866314 [0,1,0,1,0,0|1,0,0]=3 3777 B11R1.167 CC1CCC(C)C([N+](=O)[O-])C1 Amb33297743 [0,1,0,1,0,0|1,0,1]=4 3778 B11R1.167 CC1CCC(C)N(C(=O)Cl)C1 Amb25111378 [0,1,0,1,0,0|2,0,0]=4 3779 B11R1.167 CC1CCC(Cl)=C(C(=O)O)C1 Amb8844856 [0,1,0,1,0,0|0,0,2]=4 3780 B11R1.167 CC1CCC(Cl)CC1C(=O)Cl Amb25796255 [0,1,0,1,0,0|2,0,0]=4 3781 B11R1.167 CC1CCC(Cl)CC1C(=O)O Amb25260877 [0,1,0,1,0,0|1,0,0]=3 3782 B11R1.167 CC1CCC(F)CC1C(=O)O Amb28050842 [0,1,0,1,0,0|1,0,0]=3 3783 B11R1.167 CC1CCC(N)C(C(=O)O)C1 Amb18200001 [0,1,0,1,0,0|0,0,0]=2 3784 B11R1.167 CC1CCC(N)C(C(N)=O)C1 Amb27603847 [0,1,0,1,0,0|1,0,0]=3 3785 B11R1.167 CC1CCC(N)CC1C(=O)O Amb26073941 [0,1,0,1,0,0|1,0,0]=3 3786 B11R1.167 CC1CCC(O)CC1C(=O)O Amb24392245 [0,1,0,1,0,0|1,0,0]=3 3787 B11R1.167 CC1CC[C@H](O)C[C@H]1C(=O)O Amb28195098 [0,1,0,1,0,0|1,0,0]=3 3788 B11R1.167 CC1CNC(=O)C(C(=O)O)C1 Amb26570606 [0,1,0,1,0,0|1,0,1]=4 3789 B11R1.167 CC1OC[C@H](O)[C@H](C(=O)O)O1 Amb27204839 [0,1,0,1,0,0|2,0,0]=4 3790 B11R1.167 CN1CCC(F)CC1C(=O)O Amb25864461 [0,1,0,1,0,0|2,0,0]=4 3791 B11R1.167 CN1CCC(O)C(C(=O)O)C1 Amb18830394 [0,1,0,1,0,0|1,0,0]=3 3792 B11R1.167 CN1CCN(C)C(C(=O)O)C1 Amb10982458 [0,1,0,1,0,0|2,0,0]=4 3793 B11R1.167 CN1CCN(C)C(C(=O)O)C1 Amb25760074 [0,1,0,1,0,0|2,0,0]=4 3794 B11R1.167 CN1CC[C@@H](O)[C@@H](C(=O)O)C1 Amb22757828 [0,1,0,1,0,0|1,0,0]=3 3795 B11R1.167 CN1CC[C@@H](O)[C@H](C(=O)O)C1 Amb15701227 [0,1,0,1,0,0|1,0,0]=3 3796 B11R1.167 CN1CC[C@@H](O)[C@H](C(=O)O)C1 Amb22757827 [0,1,0,1,0,0|1,0,0]=3 3797 B11R1.167 CN1CC[C@H](O)[C@H](C(=O)O)C1 Amb27421984 [0,1,0,1,0,0|1,0,0]=3 3798 B11R1.167 C[C@H]1C=C[C@@H](C)[C@H](C(=O)O)C1 Amb27845462 [0,1,0,1,0,0|0,0,2]=4 3799 B11R1.167 C[C@H]1CC[C@@H](C)[C@@H](C(=O)O)C1 Amb26927968 [0,1,0,1,0,0|0,0,0]=2 3800 B11R1.167 C[C@H]1CC[C@@H](Cl)C[C@@H]1C(=O)Cl Amb27434402 [0,1,0,1,0,0|2,0,0]=4 3801 B11R1.167 C[C@H]1CC[C@H](Cl)C[C@@H]1C(=O)Cl Amb28054821 [0,1,0,1,0,0|2,0,0]=4 3802 B11R1.167 NC1CCC(O)CC1C(=O)O Amb25139597 [0,1,0,1,0,0|1,0,0]=3 3803 B11R1.167 N[C@@H]1CC[C@@H](O)C[C@H]1C(=O)O Amb27231807 [0,1,0,1,0,0|1,0,0]=3 3804 B11R1.167 N[C@@H]1CC[C@H](O)C[C@@H]1C(=O)O Amb27444612 [0,1,0,1,0,0|1,0,0]=3 3805 B11R1.167 N[C@@H]1CC[C@H](O)C[C@H]1C(=O)O Amb27878771 [0,1,0,1,0,0|1,0,0]=3 3806 B11R1.167 N[C@H]1CC[C@@H](O)C[C@H]1C(=O)O Amb28193740 [0,1,0,1,0,0|1,0,0]=3 3807 B11R1.167 O=C(O)C1CC(O)CCC1O Amb25809422 [0,1,0,1,0,0|1,0,0]=3 3808 B11R1.222 CC(CO)C1CCCNC1=O Amb25712328 [0,1,0,1,0,0|2,0,0]=4 3809 B11R1.222 CC(CO)N1CCCOC1=O Amb27641712 [0,1,0,1,0,0|2,0,0]=4 3810 B11R1.222 CCC(=O)C1CCCCC1=O Amb9786088 [0,1,0,1,0,0|1,0,1]=4 3811 B11R1.222 CCC(C)C1CCCCC1=O Amb4013148 [0,1,0,1,0,0|1,0,0]=3 3812 B11R1.222 CCC(C)C1CCCCC1O Amb24353784 [0,1,0,1,0,0|1,0,1]=4 3813 B11R1.222 CCC(C)C1CNCCC1=O Amb18200325 [0,1,0,1,0,0|2,0,0]=4 3814 B11R1.222 CCC(C)[C@@H]1CCCC[C@H]1O Amb32945397 [0,1,0,1,0,0|1,0,1]=4 3815 B11R1.222 CCC(N)C1CCCCC1O Amb9776222 [0,1,0,1,0,0|1,0,1]=4 3816 B11R1.222 CCC(N)C1CCCNC1=O Amb27634312 [0,1,0,1,0,0|1,0,0]=3 3817 B11R1.222 CCC(O)C1CCCNC1=O Amb27625220 [0,1,0,1,0,0|1,0,0]=3 3818 B11R1.222 CC[C@H](O)[C@H]1CSCCC1=O Amb28054410 [0,1,0,1,0,0|2,0,0]=4 3819 B11R1.222 C[C@@H](CO)N1CCCOC1=O Amb27812425 [0,1,0,1,0,0|2,0,0]=4 3820 B11R1.225 CCC(Br)C1CC(C)OC1C Amb28410192 [0,1,0,1,0,0|1,0,1]=4 3821 B11R1.225 CCC(C)C1CC(=O)OC1=O Amb33318445 [0,1,0,1,0,0|1,0,1]=4 3822 B11R1.225 CCC(Cl)C1CC(C)OC1C Amb27422805 [0,1,0,1,0,0|1,0,1]=4 3823 B11R1.225 CCC(N)C1CC(C)OC1C Amb27422691 [0,1,0,1,0,0|1,0,1]=4 3824 B11R1.225 CCN(C)C1CC(C)OC1=O Amb27762894 [0,1,0,1,0,0|1,0,0]=3 3825 B11R1.225 COC(=O)[C@@H]1CC(C)OC1=O Amb27470822 [0,1,0,1,0,0|1,0,1]=4 3826 B11R1.227 CCC(N)C1CCCC1(C)O Amb35592890 [0,1,0,1,0,0|1,0,1]=4 3827 B11R1.227 CCC(N)C1CCCS1(=O)=O Amb35639629 [0,1,0,1,0,0|1,0,1]=4 3828 B11R1.227 CCC(O)C1CCCS1(=O)=O Amb35649997 [0,1,0,1,0,0|1,0,1]=4 3829 B11R1.303 CCCC1=C(CC)ONC1=O Amb27402981 [0,1,0,1,0,0|0,0,2]=4 3830 B11R1.303 CCCN1C(=O)OCC1CCl Amb27983805 [0,1,0,1,0,0|2,0,0]=4 3831 B11R1.303 CCC[C@@H]1C(=O)CC[C@H]1CC Amb27434309 [0,1,0,1,0,0|1,0,0]=3 3832 B11R1.395 CC1(CF)CCCC1C(=O)O Amb27967383 [0,1,0,1,0,0|1,0,0]=3 3833 B11R1.395 CCC1(C)CNCC1C(=O)O Amb27800393 [0,1,0,1,0,0|1,0,0]=3 3834 B11R1.395 CCC1(C)NCCC1C(=O)O Amb28130093 [0,1,0,1,0,0|1,0,0]=3 3835 B11R1.395 CCC1(C)NCCC1C(N)=O Amb27240189 [0,1,0,1,0,0|2,0,0]=4 3836 B11R1.471 CCC1CCC(C)N1C(=O)Cl Amb24412494 [0,1,0,1,0,0|2,0,0]=4 3837 B11R1.471 CCC1CCC(C)N1C(C)=O Amb27806730 [0,1,0,1,0,0|2,0,0]=4 3838 B11R1.471 CCC1COC(=O)C1C(=O)O Amb27658991 [0,1,0,1,0,0|1,0,1]=4 3839 B11R1.471 CC[C@@H]1CCC(=O)[C@H]1C(C)=O Amb27640617 [0,1,0,1,0,0|1,0,1]=4 3840 B11R1.471 CN1CC[C@@H](CN)[C@@H]1C(=O)O Amb18199895 [0,1,0,1,0,0|2,0,0]=4 3841 B11R1.471 CN1CC[C@H](CN)[C@H]1C(=O)O Amb27624410 [0,1,0,1,0,0|2,0,0]=4 3842 B11R1.471 O=CC1CCC(O)C1C(=O)O Amb28343067 [0,1,0,1,0,0|1,0,1]=4 3843 B11R1.527 C#CC(=O)C(OCC)C1CC1 Amb27269711 [0,1,0,1,0,0|2,0,0]=4 3844 B11R1.527 CCCN(C(=O)NC)C1CC1 Amb28387546 [0,1,0,1,0,0|2,0,0]=4 3845 B11R1.527 CCCN(C(=O)NN)C1CC1 Amb8898434 [0,1,0,1,0,0|2,0,0]=4 3846 B11R1.527 CCOC(\C(N)=N\O)C1CC1 Amb28387591 [0,1,0,1,0,0|2,0,0]=4 3847 B11R1.527 CNCC(\C(N)=N\O)C1CC1 Amb28080550 [0,1,0,1,0,0|2,0,0]=4 3848 B11R1.527 CSCC(\C(N)=N\O)C1CC1 Amb28080545 [0,1,0,1,0,0|2,0,0]=4 3849 B11R1.605 C=CCC1C(=O)OCCC1O Amb27662382 [0,1,0,1,0,0|0,0,2]=4 3850 B11R1.605 CCCC1C(=O)CCCC1=O Amb27648609 [0,1,0,1,0,0|1,0,1]=4 3851 B11R1.605 CCC[C@H]1C(=N)NCC[C@H]1C Amb27194144 [0,1,0,1,0,0|2,0,0]=4 3852 B11R1.672 CC(=O)[C@@H]1C[C@H](O)[C@@H](C)[C@@H]1C Amb28253721 [0,1,0,1,0,0|2,0,0]=4 3853 B11R1.672 CC1CC(C(=O)O)C(C)C1C Amb27607747 [0,1,0,1,0,0|0,0,0]=2 3854 B11R1.672 CC1C[C@@H](C(=O)O)C(C)C1C Amb27590210 [0,1,0,1,0,0|0,0,0]=2 3855 B11R1.672 CC1C[C@@H](C(=O)O)N(C)C1C Amb25881057 [0,1,0,1,0,0|1,0,0]=3 3856 B11R1.672 CC1OC(C(=O)O)C(O)C1O Amb27793297 [0,1,0,1,0,0|2,0,0]=4 3857 B11R1.672 C[C@@H]1N[C@H](C(=O)O)[C@H](O)[C@@H]1O Amb27634870 [0,1,0,1,0,0|2,0,0]=4 3858 B11R1.672 C[C@@H]1O[C@H](C(=O)O)[C@H](O)[C@H]1O Amb28325640 [0,1,0,1,0,0|2,0,0]=4 3859 B11R1.672 NC1C(Br)CC(C(=O)O)C1O Amb28365510 [0,1,0,1,0,0|2,0,0]=4 3860 B11R1.672 N[C@@H]1C[C@H](C(=O)O)[C@@H](O)[C@H]1O Amb27984686 [0,1,0,1,0,0|2,0,0]=4 3861 B11R1.672 N[C@@H]1[C@@H](Br)C[C@H](C(=O)O)[C@H]1O Amb27451655 [0,1,0,1,0,0|2,0,0]=4 3862 B11R1.760 CCCC(C(=O)O)C1CCC1 Amb23590263 [0,1,0,1,0,0|0,0,0]=2 3863 B11R1.760 CSCC(C(=O)O)C1CCC1 Amb28079649 [0,1,0,1,0,0|1,0,0]=3 3864 B11R1.767 CCCC1(C(N)=O)OC1CC Amb25386376 [0,1,0,1,0,0|1,0,0]=3 3865 B11R1.767 COCC1(C(=O)O)CC1CO Amb32947213 [0,1,0,1,0,0|1,0,0]=3 3866 B11R1.773 CCNC1(C(N)=O)CCC1C Amb27167267 [0,1,0,1,0,0|2,0,0]=4 3867 B11R1.773 CCSC1(C(=O)O)CCC1C Amb25739212 [0,1,0,1,0,0|1,0,0]=3 3868 B11R1.863 C#CC(C)C(C(=O)O)C1CC1 Amb28137948 [0,1,0,1,0,0|0,0,2]=4 3869 B11R1.863 CCC(C)C(C(=O)O)C1CC1 Amb27674278 [0,1,0,1,0,0|0,0,0]=2 3870 B11R1.863 CCC(N)C(C(=O)O)C1CC1 Amb28388127 [0,1,0,1,0,0|0,0,0]=2 3871 B11R1.863 CCS(=O)C(C(=O)O)C1CC1 Amb27266607 [0,1,0,1,0,0|1,0,0]=3 3872 B11R1.863 COC(=O)C(C(=O)O)C1CC1 Amb27671555 [0,1,0,1,0,0|1,0,1]=4 3873 B11R1.879 CC(C#N)C1(C(=O)O)CCC1 Amb35719052 [0,1,0,1,0,0|1,0,1]=4 3874 B11R1.879 CCC(C)C1(C(=O)O)CCC1 Amb25298731 [0,1,0,1,0,0|0,0,0]=2 3875 B11R1.879 CCC(C)C1(C(=O)O)CNC1 Amb27874252 [0,1,0,1,0,0|1,0,0]=3 3876 B11R1.879 CNC(=O)C1(C(=O)O)CCC1 Amb18958362 [0,1,0,1,0,0|1,0,1]=4 3877 B11R1.879 COC(=O)C1(C(=O)O)CCC1 Amb24331000 [0,1,0,1,0,0|1,0,1]=4 3878 B11R1.891 COC(=O)C1(C(=O)O)CC1C Amb27403447 [0,1,0,1,0,0|1,0,1]=4 3879 B11R1.891 COC(=O)[C@@]1(C(=O)O)C[C@H]1C Amb27966835 [0,1,0,1,0,0|1,0,1]=4 3880 B11R1.981 CCC(C)C1C(=O)OC1CO Amb27206436 [0,1,0,1,0,0|1,0,0]=3 3881 B11R1.5 C=CCC1NCCCOC1=O Amb28251286 [0,1,0,1,0,0|0,0,2]=4 3882 B11R1.5 CCCC1CCCCCC1O Amb18799751 [0,1,0,1,0,0|1,0,1]=4 3883 B11R1.5 CCCC1CSCCNC1=O Amb28284783 [0,1,0,1,0,0|1,0,0]=3 3884 B11R1.5 CCCC1NCCCNC1=O Amb32719912 [0,1,0,1,0,0|1,0,0]=3 3885 B11R1.5 CCCN1CCCNCC1=O Amb22549346 [0,1,0,1,0,0|2,0,0]=4 3886 B11R1.5 CCCN1CCNCCC1=O Amb22498695 [0,1,0,1,0,0|2,0,0]=4 3887 B11R1.5 CCC[C@@H]1CCCCC[C@H]1O Amb24675468 [0,1,0,1,0,0|1,0,1]=4 3888 B11R1.5 CCC[C@H]1NCCCNC1=O Amb32719924 [0,1,0,1,0,0|1,0,0]=3 3889 B11R1.5 CNCC1OCCCNC1=O Amb28254825 [0,1,0,1,0,0|2,0,0]=4 3890 B11R1.5 COCC1CCCCNC1=O Amb25093894 [0,1,0,1,0,0|2,0,0]=4 3891 B11R1.5 CSCC1NCCCNC1=O Amb32719915 [0,1,0,1,0,0|2,0,0]=4 3892 B11R1.5 NCCC1CCCCCC1=O Amb18200342 [0,1,0,1,0,0|2,0,0]=4 3893 B11R1.5 O=C1CCCCCC1CCO Amb27395084 [0,1,0,1,0,0|2,0,0]=4 3894 B11R1.5 O=C1NCCCCC1CCO Amb26456499 [0,1,0,1,0,0|2,0,0]=4 3895 B11R1.5 O=C1NCCCNC1CCF Amb32719944 [0,1,0,1,0,0|2,0,0]=4 3896 B11R1.13 CCCC1=C(O)C(=O)CCC1 Amb27434207 [0,1,0,1,0,0|0,0,1]=3 3897 B11R1.13 CCCC1CCCC(O)C1O Amb27829634 [0,1,0,1,0,0|0,0,2]=4 3898 B11R1.13 CCCC1NCCN(C)C1=O Amb25316042 [0,1,0,1,0,0|2,0,0]=4 3899 B11R1.13 CCCC1OCCC(O)C1=O Amb28074644 [0,1,0,1,0,0|1,0,0]=3 3900 B11R1.13 CCCN1CCCC(O)C1=O Amb32697329 [0,1,0,1,0,0|1,0,0]=3 3901 B11R1.13 CCCN1CCCN(N)C1=O Amb28128302 [0,1,0,1,0,0|2,0,0]=4 3902 B11R1.13 CCC[C@@H]1OCC[C@@H](O)C1=O Amb27212038 [0,1,0,1,0,0|1,0,0]=3 3903 B11R1.13 CCNC1CCCN(C)C1=O Amb28286165 [0,1,0,1,0,0|2,0,0]=4 3904 B11R1.13 CCSC1CCCN(C)C1=O Amb27660620 [0,1,0,1,0,0|2,0,0]=4 3905 B11R1.13 CN1CCCC(CCN)C1=O Amb28325161 [0,1,0,1,0,0|2,0,0]=4 3906 B11R1.23 C#CC(=O)C1CCCC(C)C1 Amb27960261 [0,1,0,1,0,0|1,0,0]=3 3907 B11R1.23 C#CC(=O)C1CCCC(N)C1 Amb27173391 [0,1,0,1,0,0|2,0,0]=4 3908 B11R1.23 C#CC(=O)C1CCNC(C)C1 Amb33307711 [0,1,0,1,0,0|2,0,0]=4 3909 B11R1.23 C#CC(=O)C1CNCC(C)C1 Amb24599646 [0,1,0,1,0,0|2,0,0]=4 3910 B11R1.23 C#CC(=O)[C@@H]1CCC[C@@H](N)C1 Amb33307839 [0,1,0,1,0,0|2,0,0]=4 3911 B11R1.23 C#CC(=O)[C@@H]1CCC[C@H](N)C1 Amb33132812 [0,1,0,1,0,0|2,0,0]=4 3912 B11R1.23 C#CC(=O)[C@@H]1CCN[C@H](C)C1 Amb33307716 [0,1,0,1,0,0|2,0,0]=4 3913 B11R1.23 C#CC(O)C1CCCC(C)C1 Amb27667891 [0,1,0,1,0,0|1,0,1]=4 3914 B11R1.23 C=CC(=O)C1CCCC(C)C1 Amb28040761 [0,1,0,1,0,0|1,0,0]=3 3915 B11R1.23 C=CC(=O)C1CCCC(N)C1 Amb27404448 [0,1,0,1,0,0|2,0,0]=4 3916 B11R1.23 C=CC(=O)C1CCNC(C)C1 Amb33307712 [0,1,0,1,0,0|2,0,0]=4 3917 B11R1.23 C=CC(=O)C1CNCC(C)C1 Amb24542993 [0,1,0,1,0,0|2,0,0]=4 3918 B11R1.23 C=CC(=O)[C@@H]1CCC[C@@H](N)C1 Amb33307840 [0,1,0,1,0,0|2,0,0]=4 3919 B11R1.23 C=CC(=O)[C@@H]1CCC[C@H](N)C1 Amb33132813 [0,1,0,1,0,0|2,0,0]=4 3920 B11R1.23 C=CC(=O)[C@@H]1CCN[C@H](C)C1 Amb33307717 [0,1,0,1,0,0|2,0,0]=4 3921 B11R1.23 CC1CC(C(=O)CCl)CCO1 Amb27872758 [0,1,0,1,0,0|2,0,0]=4 3922 B11R1.23 CC1CC(C(=O)NO)CCO1 Amb27757128 [0,1,0,1,0,0|1,0,0]=3 3923 B11R1.23 CC1CC(C(=O)ON)CCO1 Amb25313398 [0,1,0,1,0,0|1,0,0]=3 3924 B11R1.23 CC1CCCC(C(=O)CN)C1 Amb26589759 [0,1,0,1,0,0|1,0,0]=3 3925 B11R1.23 CC1CCCC(C(C)CO)C1 Amb27761516 [0,1,0,1,0,0|1,0,1]=4 3926 B11R1.23 CC1CCCC(C(N)CO)C1 Amb28365423 [0,1,0,1,0,0|1,0,1]=4 3927 B11R1.23 CC1CCCC(\C(N)=N\O)C1 Amb18799706 [0,1,0,1,0,0|1,0,0]=3 3928 B11R1.23 CC1CCCN(C(=N)CO)C1 Amb23515003 [0,1,0,1,0,0|2,0,0]=4 3929 B11R1.23 CC1CCCN(C(=O)CBr)C1 Amb17324536 [0,1,0,1,0,0|2,0,0]=4 3930 B11R1.23 CC1CCCN(C(=O)CCl)C1 Amb366389 [0,1,0,1,0,0|2,0,0]=4 3931 B11R1.23 CC1CCCN(C(=O)CN)C1 Amb6274354 [0,1,0,1,0,0|2,0,0]=4 3932 B11R1.23 CC1CCCN(C(=O)CO)C1 Amb1110195 [0,1,0,1,0,0|1,0,0]=3 3933 B11R1.23 CC1CCCN(C(=O)CS)C1 Amb26878052 [0,1,0,1,0,0|1,1,0]=4 3934 B11R1.23 CC1CCCN(\C(N)=N\O)C1 Amb18799811 [0,1,0,1,0,0|2,0,0]=4 3935 B11R1.23 CC1CN(C(=O)CO)CCS1 Amb27752866 [0,1,0,1,0,0|2,0,0]=4 3936 B11R1.23 CC1CNCC(C(=O)NN)C1 Amb27776008 [0,1,0,1,0,0|2,0,0]=4 3937 B11R1.23 CCC(=O)C1CCCC(N)C1 Amb25188889 [0,1,0,1,0,0|2,0,0]=4 3938 B11R1.23 CCC(=O)C1CCNC(C)C1 Amb33307713 [0,1,0,1,0,0|2,0,0]=4 3939 B11R1.23 CCC(=O)C1CNCC(C)C1 Amb27630973 [0,1,0,1,0,0|2,0,0]=4 3940 B11R1.23 CCC(=O)N1CCCC(C)C1 Amb3886609 [0,1,0,1,0,0|2,0,0]=4 3941 B11R1.23 CCC(=O)N1CCC[C@H](C)C1 Amb27763373 [0,1,0,1,0,0|2,0,0]=4 3942 B11R1.23 CCC(=O)[C@@H]1CCC[C@@H](N)C1 Amb33307841 [0,1,0,1,0,0|2,0,0]=4 3943 B11R1.23 CCC(=O)[C@@H]1CCC[C@H](N)C1 Amb33132814 [0,1,0,1,0,0|2,0,0]=4 3944 B11R1.23 CCC(=O)[C@@H]1CCC[C@H](O)C1 Amb28349328 [0,1,0,1,0,0|2,0,0]=4 3945 B11R1.23 CCC(=O)[C@@H]1CCN[C@H](C)C1 Amb33307718 [0,1,0,1,0,0|2,0,0]=4 3946 B11R1.23 CC[C@@H](O)C1CCCC(C)C1 Amb28064212 [0,1,0,1,0,0|1,0,1]=4 3947 B11R1.23 CN1CCCC(C(=O)NN)C1 Amb595157 [0,1,0,1,0,0|2,0,0]=4 3948 B11R1.23 CN1CCCC(\C(N)=N\O)C1 Amb22059545 [0,1,0,1,0,0|2,0,0]=4 3949 B11R1.23 CNC(=O)C1CC(C)CCN1 Amb28059101 [0,1,0,1,0,0|2,0,0]=4 3950 B11R1.23 CNC(=O)C1CCCC(C)C1 Amb24544631 [0,1,0,1,0,0|1,0,0]=3 3951 B11R1.23 CNC(=O)C1CCCC(N)C1 Amb33164159 [0,1,0,1,0,0|2,0,0]=4 3952 B11R1.23 CNC(=O)C1CCCC(N)C1 Amb6252711 [0,1,0,1,0,0|2,0,0]=4 3953 B11R1.23 CNC(=O)C1CCCC(O)C1 Amb25792016 [0,1,0,1,0,0|2,0,0]=4 3954 B11R1.23 CNC(=O)C1CNCC(C)C1 Amb26938436 [0,1,0,1,0,0|2,0,0]=4 3955 B11R1.23 CNC(=O)[C@@H]1CCN[C@H](C)C1 Amb25959603 [0,1,0,1,0,0|2,0,0]=4 3956 B11R1.23 CNC(=O)[C@@H]1C[C@@H](C)CCO1 Amb27199463 [0,1,0,1,0,0|2,0,0]=4 3957 B11R1.23 COC(=O)C1CC(C)CCN1 Amb13886431 [0,1,0,1,0,0|1,0,0]=3 3958 B11R1.23 COC(=O)C1CC(C)CCN1 Amb30584728 [0,1,0,1,0,0|1,0,0]=3 3959 B11R1.23 COC(=O)C1CC(F)CCN1 Amb25270013 [0,1,0,1,0,0|2,0,0]=4 3960 B11R1.23 COC(=O)C1CC(O)CCN1 Amb21856404 [0,1,0,1,0,0|2,0,0]=4 3961 B11R1.23 COC(=O)C1CC(O)CCN1 Amb21963536 [0,1,0,1,0,0|2,0,0]=4 3962 B11R1.23 COC(=O)C1CCCC(=O)C1 Amb33543758 [0,1,0,1,0,0|1,0,1]=4 3963 B11R1.23 COC(=O)C1CCCC(C)C1 Amb27607963 [0,1,0,1,0,0|0,0,0]=2 3964 B11R1.23 COC(=O)C1CCCC(C)N1 Amb18644928 [0,1,0,1,0,0|1,0,0]=3 3965 B11R1.23 COC(=O)C1CCCC(Cl)C1 Amb24390370 [0,1,0,1,0,0|1,0,0]=3 3966 B11R1.23 COC(=O)C1CCCC(N)C1 Amb18288448 [0,1,0,1,0,0|1,0,0]=3 3967 B11R1.23 COC(=O)C1CCCC(N)C1 Amb20668217 [0,1,0,1,0,0|1,0,0]=3 3968 B11R1.23 COC(=O)C1CCCC(O)C1 Amb19516181 [0,1,0,1,0,0|1,0,0]=3 3969 B11R1.23 COC(=O)C1CCCC(S)C1 Amb32788133 [0,1,0,1,0,0|1,0,0]=3 3970 B11R1.23 COC(=O)C1CCCN(C)C1 Amb15691747 [0,1,0,1,0,0|1,0,0]=3 3971 B11R1.23 COC(=O)C1CCNC(C)C1 Amb25104902 [0,1,0,1,0,0|1,0,0]=3 3972 B11R1.23 COC(=O)C1CCNC(C)C1 Amb33071704 [0,1,0,1,0,0|1,0,0]=3 3973 B11R1.23 COC(=O)C1CCOC(C)C1 Amb25730422 [0,1,0,1,0,0|1,0,0]=3 3974 B11R1.23 COC(=O)C1CN(C)CCN1 Amb15692177 [0,1,0,1,0,0|2,0,0]=4 3975 B11R1.23 COC(=O)C1CN(C)CCO1 Amb26038261 [0,1,0,1,0,0|2,0,0]=4 3976 B11R1.23 COC(=O)C1CNCC(C)C1 Amb22728513 [0,1,0,1,0,0|1,0,0]=3 3977 B11R1.23 COC(=O)C1CNCC(C)C1 Amb28144998 [0,1,0,1,0,0|1,0,0]=3 3978 B11R1.23 COC(=O)C1CNCC(C)O1 Amb24761259 [0,1,0,1,0,0|2,0,0]=4 3979 B11R1.23 COC(=O)C1CNCC(C)O1 Amb32652650 [0,1,0,1,0,0|2,0,0]=4 3980 B11R1.23 COC(=O)C1CNCC(O)C1 Amb13885763 [0,1,0,1,0,0|2,0,0]=4 3981 B11R1.23 COC(=O)C1CNCC(O)C1 Amb17739877 [0,1,0,1,0,0|2,0,0]=4 3982 B11R1.23 COC(=O)C1CNC[C@@H](C)C1 Amb27250592 [0,1,0,1,0,0|1,0,0]=3 3983 B11R1.23 COC(=O)C1CNC[C@@H](C)O1 Amb25684325 [0,1,0,1,0,0|2,0,0]=4 3984 B11R1.23 COC(=O)C1CNC[C@@H](C)O1 Amb32652686 [0,1,0,1,0,0|2,0,0]=4 3985 B11R1.23 COC(=O)C1COCC(N)C1 Amb27783317 [0,1,0,1,0,0|2,0,0]=4 3986 B11R1.23 COC(=O)C1COCC(O)C1 Amb27408385 [0,1,0,1,0,0|2,0,0]=4 3987 B11R1.23 COC(=O)C1CSCC(C)N1 Amb22304714 [0,1,0,1,0,0|2,0,0]=4 3988 B11R1.23 COC(=O)N1CCCC(Cl)C1 Amb28285374 [0,1,0,1,0,0|2,0,0]=4 3989 B11R1.23 COC(=O)N1CCCC(F)C1 Amb35591724 [0,1,0,1,0,0|2,0,0]=4 3990 B11R1.23 COC(=O)N1CCCC(N)C1 Amb13951817 [0,1,0,1,0,0|2,0,0]=4 3991 B11R1.23 COC(=O)N1CCCC(O)C1 Amb9173673 [0,1,0,1,0,0|2,0,0]=4 3992 B11R1.23 COC(=O)N1CCNC(C)C1 Amb25359886 [0,1,0,1,0,0|2,0,0]=4 3993 B11R1.23 COC(=O)N1CCN[C@H](C)C1 Amb27162565 [0,1,0,1,0,0|2,0,0]=4 3994 B11R1.23 COC(=O)N1CCOC(C)C1 Amb25051514 [0,1,0,1,0,0|2,0,0]=4 3995 B11R1.23 COC(=O)[C@@H]1CCCC(=O)C1 Amb24486283 [0,1,0,1,0,0|1,0,1]=4 3996 B11R1.23 COC(=O)[C@@H]1CCC[C@@H](Cl)C1 Amb28244806 [0,1,0,1,0,0|1,0,0]=3 3997 B11R1.23 COC(=O)[C@@H]1CCC[C@@H](N)C1 Amb10873181 [0,1,0,1,0,0|1,0,0]=3 3998 B11R1.23 COC(=O)[C@@H]1CCC[C@@H](N)C1 Amb24563866 [0,1,0,1,0,0|1,0,0]=3 3999 B11R1.23 COC(=O)[C@@H]1CCC[C@@H](O)C1 Amb22899456 [0,1,0,1,0,0|1,0,0]=3 4000 B11R1.23 COC(=O)[C@@H]1CCC[C@H](N)C1 Amb22747531 [0,1,0,1,0,0|1,0,0]=3 4001 B11R1.23 COC(=O)[C@@H]1CCC[C@H](N)C1 Amb23438867 [0,1,0,1,0,0|1,0,0]=3 4002 B11R1.23 COC(=O)[C@@H]1CCC[C@H](O)C1 Amb27844007 [0,1,0,1,0,0|1,0,0]=3 4003 B11R1.23 COC(=O)[C@@H]1CCN[C@H](C)C1 Amb22406179 [0,1,0,1,0,0|1,0,0]=3 4004 B11R1.23 COC(=O)[C@@H]1CCN[C@H](C)C1 Amb23440187 [0,1,0,1,0,0|1,0,0]=3 4005 B11R1.23 COC(=O)[C@@H]1CN(C)CCN1 Amb28042519 [0,1,0,1,0,0|2,0,0]=4 4006 B11R1.23 COC(=O)[C@@H]1CNC[C@@H](C)C1 Amb24062238 [0,1,0,1,0,0|1,0,0]=3 4007 B11R1.23 COC(=O)[C@@H]1CNC[C@@H](C)C1 Amb32414717 [0,1,0,1,0,0|1,0,0]=3 4008 B11R1.23 COC(=O)[C@@H]1CNC[C@@H](C)O1 Amb32668808 [0,1,0,1,0,0|2,0,0]=4 4009 B11R1.23 COC(=O)[C@@H]1CNC[C@@H](C)O1 Amb32668809 [0,1,0,1,0,0|2,0,0]=4 4010 B11R1.23 COC(=O)[C@@H]1CNC[C@@H](O)C1 Amb33620324 [0,1,0,1,0,0|2,0,0]=4 4011 B11R1.23 COC(=O)[C@@H]1CNC[C@@H](O)C1 Amb33738361 [0,1,0,1,0,0|2,0,0]=4 4012 B11R1.23 COC(=O)[C@@H]1CNC[C@H](C)C1 Amb24062237 [0,1,0,1,0,0|1,0,0]=3 4013 B11R1.23 COC(=O)[C@@H]1CNC[C@H](C)O1 Amb34914989 [0,1,0,1,0,0|2,0,0]=4 4014 B11R1.23 COC(=O)[C@@H]1CNC[C@H](C)O1 Amb35745789 [0,1,0,1,0,0|2,0,0]=4 4015 B11R1.23 COC(=O)[C@@H]1COC[C@H](O)C1 Amb27974537 [0,1,0,1,0,0|2,0,0]=4 4016 B11R1.23 COC(=O)[C@@H]1CSC[C@H](N)C1 Amb27870756 [0,1,0,1,0,0|2,0,0]=4 4017 B11R1.23 COC(=O)[C@@H]1C[C@@H](N)CCO1 Amb33039930 [0,1,0,1,0,0|2,0,0]=4 4018 B11R1.23 COC(=O)[C@@H]1C[C@@H](O)CCN1 Amb22748265 [0,1,0,1,0,0|2,0,0]=4 4019 B11R1.23 COC(=O)[C@@H]1C[C@@H](O)CCN1 Amb30628604 [0,1,0,1,0,0|2,0,0]=4 4020 B11R1.23 COC(=O)[C@@H]1C[C@H](C)CCN1 Amb26433028 [0,1,0,1,0,0|1,0,0]=3 4021 B11R1.23 COC(=O)[C@@H]1C[C@H](O)CCN1 Amb10606654 [0,1,0,1,0,0|2,0,0]=4 4022 B11R1.23 COC(=O)[C@H]1CCCC(=O)C1 Amb25084961 [0,1,0,1,0,0|1,0,1]=4 4023 B11R1.23 COC(=O)[C@H]1CCC[C@@H](C)N1 Amb33456356 [0,1,0,1,0,0|1,0,0]=3 4024 B11R1.23 COC(=O)[C@H]1CCC[C@@H](C)N1 Amb33482785 [0,1,0,1,0,0|1,0,0]=3 4025 B11R1.23 COC(=O)[C@H]1CCC[C@@H](N)C1 Amb26618546 [0,1,0,1,0,0|1,0,0]=3 4026 B11R1.23 COC(=O)[C@H]1CCC[C@@H](O)C1 Amb25198846 [0,1,0,1,0,0|1,0,0]=3 4027 B11R1.23 COC(=O)[C@H]1CCC[C@H](N)C1 Amb33871486 [0,1,0,1,0,0|1,0,0]=3 4028 B11R1.23 COC(=O)[C@H]1CCC[C@H](O)C1 Amb25225913 [0,1,0,1,0,0|1,0,0]=3 4029 B11R1.23 COC(=O)[C@H]1CCN[C@@H](C)C1 Amb28132483 [0,1,0,1,0,0|1,0,0]=3 4030 B11R1.23 COC(=O)[C@H]1CNC[C@@H](C)C1 Amb24062236 [0,1,0,1,0,0|1,0,0]=3 4031 B11R1.23 COC(=O)[C@H]1CNC[C@@H](C)C1 Amb30869454 [0,1,0,1,0,0|1,0,0]=3 4032 B11R1.23 COC(=O)[C@H]1CNC[C@@H](C)O1 Amb24555590 [0,1,0,1,0,0|2,0,0]=4 4033 B11R1.23 COC(=O)[C@H]1CNC[C@@H](C)O1 Amb32652224 [0,1,0,1,0,0|2,0,0]=4 4034 B11R1.23 COC(=O)[C@H]1COC[C@@H](C)N1 Amb33035910 [0,1,0,1,0,0|2,0,0]=4 4035 B11R1.23 COC(=O)[C@H]1C[C@@H](F)CCO1 Amb27421936 [0,1,0,1,0,0|2,0,0]=4 4036 B11R1.23 COC(=O)[C@H]1C[C@@H](O)CCN1 Amb26573656 [0,1,0,1,0,0|2,0,0]=4 4037 B11R1.23 COC(=O)[C@H]1C[C@H](F)CCO1 Amb24620300 [0,1,0,1,0,0|2,0,0]=4 4038 B11R1.23 C[C@@H]1CCC[C@H](C(=O)CN)C1 Amb35788782 [0,1,0,1,0,0|1,0,0]=3 4039 B11R1.23 C[C@@H]1CCC[C@H](C(=O)CN)C1 Amb35788783 [0,1,0,1,0,0|1,0,0]=3 4040 B11R1.23 C[C@H]1CCCN(C(=O)CCl)C1 Amb27836588 [0,1,0,1,0,0|2,0,0]=4 4041 B11R1.23 C\C(=C/Cl)C1CCCC(C)C1 Amb27477867 [0,1,0,1,0,0|2,0,0]=4 4042 B11R1.23 C\C(=N/O)C1CCCC(C)C1 Amb28253993 [0,1,0,1,0,0|1,0,0]=3 4043 B11R1.23 C\C(CO)=C1\CCC[C@@H](C)C1 Amb28138349 [0,1,0,1,0,0|1,0,1]=4 4044 B11R1.23 NCC(=O)C1CCCC(O)C1 Amb25315833 [0,1,0,1,0,0|2,0,0]=4 4045 B11R1.23 NCC(=O)[C@H]1CCC[C@H](O)C1 Amb27205210 [0,1,0,1,0,0|2,0,0]=4 4046 B11R1.23 NNC(=O)C1CCCC(O)C1 Amb25381484 [0,1,0,1,0,0|2,0,0]=4 4047 B11R1.23 N\C(=N/O)C1CCCC(O)C1 Amb33328436 [0,1,0,1,0,0|2,0,0]=4 4048 B11R1.23 O=C(CBr)C1CCCC(O)C1 Amb25880065 [0,1,0,1,0,0|2,0,0]=4 4049 B11R1.23 O=C(CBr)[C@@H]1CCC[C@@H](O)C1 Amb25694930 [0,1,0,1,0,0|2,0,0]=4 4050 B11R1.23 O=C(CBr)[C@@H]1CCC[C@H](O)C1 Amb28200648 [0,1,0,1,0,0|2,0,0]=4 4051 B11R1.41 CCCC1CCCCN1C=O Amb24523123 [0,1,0,1,0,0|2,0,0]=4 4052 B11R1.41 CCCC1CCCC\C1=N/O Amb25992585 [0,1,0,1,0,0|1,0,0]=3 4053 B11R1.59 C#CC(=O)C1CCCC1CN Amb24715607 [0,1,0,1,0,0|2,0,0]=4 4054 B11R1.59 C#CC(=O)C1CCNC1CC Amb33131418 [0,1,0,1,0,0|2,0,0]=4 4055 B11R1.59 C#CC(=O)C1CCOC1CC Amb27823514 [0,1,0,1,0,0|2,0,0]=4 4056 B11R1.59 C#CC(=O)N1CCCC1CC Amb27176760 [0,1,0,1,0,0|2,0,0]=4 4057 B11R1.59 C#CC(=O)[C@@H]1CCC[C@@H]1CN Amb33307064 [0,1,0,1,0,0|2,0,0]=4 4058 B11R1.59 C=CC(=O)C1CCCC1CN Amb24488182 [0,1,0,1,0,0|2,0,0]=4 4059 B11R1.59 C=CC(=O)C1CCNC1CC Amb33131419 [0,1,0,1,0,0|2,0,0]=4 4060 B11R1.59 C=CC(=O)C1CCOC1CC Amb28284843 [0,1,0,1,0,0|2,0,0]=4 4061 B11R1.59 C=CC(=O)[C@@H]1CCC[C@@H]1CN Amb33307267 [0,1,0,1,0,0|2,0,0]=4 4062 B11R1.59 C=CC(=O)[C@H]1CCC[C@H]1CN Amb27212326 [0,1,0,1,0,0|2,0,0]=4 4063 B11R1.59 CCC(=O)C1CCCC1CN Amb27404757 [0,1,0,1,0,0|2,0,0]=4 4064 B11R1.59 CCC(=O)C1CCNC1CC Amb33131420 [0,1,0,1,0,0|2,0,0]=4 4065 B11R1.59 CCC(=O)C1COCC1CC Amb29882929 [0,1,0,1,0,0|2,0,0]=4 4066 B11R1.59 CCC(=O)[C@@H]1CCC[C@@H]1CN Amb25878569 [0,1,0,1,0,0|2,0,0]=4 4067 B11R1.59 CCC1CCCN1C(=O)CCl Amb18180553 [0,1,0,1,0,0|2,0,0]=4 4068 B11R1.59 CCC1CCCN1C(=O)NC Amb27431430 [0,1,0,1,0,0|2,0,0]=4 4069 B11R1.59 CCC1CCNC1C(=O)OC Amb18126064 [0,1,0,1,0,0|1,0,0]=3 4070 B11R1.59 CCC1NCCC1C(=O)NC Amb30009650 [0,1,0,1,0,0|2,0,0]=4 4071 B11R1.59 CCC1NCCC1C(=O)NN Amb30017233 [0,1,0,1,0,0|2,0,0]=4 4072 B11R1.59 CCC1NCCC1C(=O)NO Amb35615232 [0,1,0,1,0,0|1,0,0]=3 4073 B11R1.59 CCC1NCCC1C(=O)OC Amb24486989 [0,1,0,1,0,0|1,0,0]=3 4074 B11R1.59 CCC1OCCC1C(=O)CCl Amb27477487 [0,1,0,1,0,0|2,0,0]=4 4075 B11R1.59 CCC1OCCC1C(=O)NC Amb28123261 [0,1,0,1,0,0|2,0,0]=4 4076 B11R1.59 CCC1OCCC1C(=O)NN Amb27863017 [0,1,0,1,0,0|2,0,0]=4 4077 B11R1.59 CCC1OCCC1C(=O)OC Amb27233144 [0,1,0,1,0,0|1,0,0]=3 4078 B11R1.59 CCN1CCCC1C(=O)OC Amb5492756 [0,1,0,1,0,0|1,0,0]=3 4079 B11R1.59 CCN1CCC[C@H]1C(=O)NC Amb16191890 [0,1,0,1,0,0|2,0,0]=4 4080 B11R1.59 CC[C@H]1CCN[C@@H]1C(=O)OC Amb24562884 [0,1,0,1,0,0|1,0,0]=3 4081 B11R1.59 CC[C@H]1CCN[C@H]1C(=O)OC Amb27649195 [0,1,0,1,0,0|1,0,0]=3 4082 B11R1.59 CNC(=O)C1CCCC1CN Amb28398657 [0,1,0,1,0,0|2,0,0]=4 4083 B11R1.59 CNC(=O)C1CCCC1NC Amb27484570 [0,1,0,1,0,0|2,0,0]=4 4084 B11R1.59 CNC(=O)C1CCCC1SC Amb27397499 [0,1,0,1,0,0|2,0,0]=4 4085 B11R1.59 CNC(=O)[C@@H]1CCC[C@@H]1CN Amb27964165 [0,1,0,1,0,0|2,0,0]=4 4086 B11R1.59 CNC1COCC1C(=O)NO Amb27454675 [0,1,0,1,0,0|2,0,0]=4 4087 B11R1.59 COC(=O)C1CCCC1C=O Amb25874888 [0,1,0,1,0,0|1,0,1]=4 4088 B11R1.59 COC(=O)C1CCCC1CN Amb26507675 [0,1,0,1,0,0|1,0,0]=3 4089 B11R1.59 COC(=O)C1CCCC1CO Amb25137259 [0,1,0,1,0,0|1,0,0]=3 4090 B11R1.59 COC(=O)C1CCC[C@H]1CO Amb28065856 [0,1,0,1,0,0|1,0,0]=3 4091 B11R1.59 COC(=O)C1CCOC1CN Amb33726908 [0,1,0,1,0,0|2,0,0]=4 4092 B11R1.59 COC(=O)C1CNCC1OC Amb27777415 [0,1,0,1,0,0|2,0,0]=4 4093 B11R1.59 COC(=O)C1OCCC1CN Amb27958460 [0,1,0,1,0,0|2,0,0]=4 4094 B11R1.59 COC(=O)C1OCCC1CN Amb32753188 [0,1,0,1,0,0|2,0,0]=4 4095 B11R1.59 COC(=O)N1CCCC1CO Amb18787836 [0,1,0,1,0,0|2,0,0]=4 4096 B11R1.59 COC(=O)N1CCCC1OC Amb19890180 [0,1,0,1,0,0|2,0,0]=4 4097 B11R1.59 COC(=O)N1CCC[C@@H]1CN Amb28367092 [0,1,0,1,0,0|2,0,0]=4 4098 B11R1.59 COC(=O)N1CCC[C@H]1CO Amb27457824 [0,1,0,1,0,0|2,0,0]=4 4099 B11R1.59 COC(=O)[C@@H]1CCCN1CBr Amb27163981 [0,1,0,1,0,0|2,0,0]=4 4100 B11R1.59 COC(=O)[C@@H]1CCC[C@@H]1CN Amb27191022 [0,1,0,1,0,0|1,0,0]=3 4101 B11R1.59 COC(=O)[C@@H]1CCC[C@H]1CO Amb6299836 [0,1,0,1,0,0|1,0,0]=3 4102 B11R1.59 COC(=O)[C@@H]1OCC[C@@H]1CN Amb32671489 [0,1,0,1,0,0|2,0,0]=4 4103 B11R1.59 COC(=O)[C@@H]1OCC[C@@H]1CN Amb32671491 [0,1,0,1,0,0|2,0,0]=4 4104 B11R1.59 COC(=O)[C@H]1CCC[C@H]1C=O Amb24588894 [0,1,0,1,0,0|1,0,1]=4 4105 B11R1.59 COC1CNCC1C(=O)NO Amb35592674 [0,1,0,1,0,0|2,0,0]=4 4106 B11R1.59 C\C=C1/CCCC1C(=O)OC Amb26552660 [0,1,0,1,0,0|0,0,2]=4 4107 B11R1.59 NC[C@@H]1CCC[C@@H]1C(=O)NO Amb28070896 [0,1,0,1,0,0|1,0,0]=3 4108 B11R1.59 NNC(=O)C1CCCC1CO Amb27952323 [0,1,0,1,0,0|2,0,0]=4 4109 B11R1.59 O=C(CO)N1CCCC1CO Amb28184816 [0,1,0,1,0,0|2,0,0]=4 4110 B11R1.59 O=C(CO)N1CCC[C@@H]1CO Amb28318327 [0,1,0,1,0,0|2,0,0]=4 4111 B11R1.59 O=C(CO)N1CCC[C@H]1CO Amb28366998 [0,1,0,1,0,0|2,0,0]=4 4112 B11R1.59 O=C(NO)C1CCCC1CO Amb27759318 [0,1,0,1,0,0|1,0,0]=3 4113 B11R1.59 O=C(NO)N1CCCC1CO Amb27408641 [0,1,0,1,0,0|2,0,0]=4 4114 B11R1.59 O=C(NO)[C@H]1CCC[C@H]1CO Amb27966679 [0,1,0,1,0,0|1,0,0]=3 4115 B11R1.186 CCCC1=C(O)C(=O)C(C)C1 Amb27164674 [0,1,0,1,0,0|0,0,1]=3 4116 B11R1.186 CCCC1=C(O)C(=O)C(C)O1 Amb27432562 [0,1,0,1,0,0|1,0,1]=4 4117 B11R1.186 CCCC1CC(C)=C(O)C1=O Amb27599474 [0,1,0,1,0,0|0,0,1]=3 4118 B11R1.186 CCCC1OC(C)=C(O)C1=O Amb26020806 [0,1,0,1,0,0|1,0,1]=4 4119 B11R1.186 CCNC1=C(O)C(=O)C(C)C1 Amb27606488 [0,1,0,1,0,0|1,0,1]=4 4120 B11R1.186 CCNC1CC(C)=C(O)C1=O Amb27223923 [0,1,0,1,0,0|1,0,1]=4 4121 B11R1.194 CCCC1CCCC1(O)C#N Amb27176558 [0,1,0,1,0,0|1,0,1]=4 4122 B11R1.194 CCC[C@@H]1CCC[C@@]1(O)C#N Amb25268979 [0,1,0,1,0,0|1,0,1]=4 4123 B11R1.194 CCC[C@@H]1CCC[C@]1(O)C#N Amb24374156 [0,1,0,1,0,0|1,0,1]=4 4124 B11R1.194 CCC[C@H]1CCC[C@]1(O)C#N Amb27420040 [0,1,0,1,0,0|1,0,1]=4 4125 B11R1.226 C#CC(=O)N1CC(C)C(C)C1 Amb27833536 [0,1,0,1,0,0|2,0,0]=4 4126 B11R1.226 C=CC(=O)N1CC(C)C(C)C1 Amb27648473 [0,1,0,1,0,0|2,0,0]=4 4127 B11R1.226 CC1CN(C(=O)CBr)CC1C Amb27235486 [0,1,0,1,0,0|2,0,0]=4 4128 B11R1.226 CC1CN(C(=O)CCl)CC1C Amb27450304 [0,1,0,1,0,0|2,0,0]=4 4129 B11R1.226 CC1CN(C(=O)CN)CC1C Amb28067310 [0,1,0,1,0,0|2,0,0]=4 4130 B11R1.226 CNC(=O)N1CC(C)C(C)C1 Amb27981687 [0,1,0,1,0,0|2,0,0]=4 4131 B11R1.226 COC(=O)C1CC(C)=C(C)C1 Amb27590223 [0,1,0,1,0,0|0,0,2]=4 4132 B11R1.226 COC(=O)C1CC(C)C(O)C1 Amb27206047 [0,1,0,1,0,0|1,0,0]=3 4133 B11R1.226 COC(=O)C1CC(N)C(O)C1 Amb25228978 [0,1,0,1,0,0|2,0,0]=4 4134 B11R1.226 COC(=O)C1CC(O)C(F)C1 Amb22898817 [0,1,0,1,0,0|2,0,0]=4 4135 B11R1.226 COC(=O)C1CC(O)C(O)C1 Amb25686051 [0,1,0,1,0,0|2,0,0]=4 4136 B11R1.226 COC(=O)C1C[C@@H](O)[C@H](Br)C1 Amb24112913 [0,1,0,1,0,0|2,0,0]=4 4137 B11R1.226 COC(=O)C1C[C@H](N)[C@@H](O)C1 Amb27457656 [0,1,0,1,0,0|2,0,0]=4 4138 B11R1.226 COC(=O)C1C[C@H](O)[C@H](O)C1 Amb25357463 [0,1,0,1,0,0|2,0,0]=4 4139 B11R1.226 COC(=O)C1OC(C)C(C)O1 Amb27633579 [0,1,0,1,0,0|2,0,0]=4 4140 B11R1.226 COC(=O)[C@@H]1C[C@@H](O)[C@H](C)O1 Amb28194278 [0,1,0,1,0,0|2,0,0]=4 4141 B11R1.226 COC(=O)[C@@H]1C[C@H](N)[C@@H](O)C1 Amb27419877 [0,1,0,1,0,0|2,0,0]=4 4142 B11R1.226 COC(=O)[C@@H]1C[C@H](O)[C@@H](F)C1 Amb28186085 [0,1,0,1,0,0|2,0,0]=4 4143 B11R1.226 COC(=O)[C@@H]1C[C@H](O)[C@H](O)C1 Amb28065366 [0,1,0,1,0,0|2,0,0]=4 4144 B11R1.226 COC(=O)[C@H]1C[C@@H](N)[C@H](O)C1 Amb25263789 [0,1,0,1,0,0|2,0,0]=4 4145 B11R1.226 COC(=O)[C@H]1C[C@@H](O)[C@H](C)O1 Amb28194255 [0,1,0,1,0,0|2,0,0]=4 4146 B11R1.226 COC(=O)[C@H]1C[C@H](O)[C@@H](F)C1 Amb24630860 [0,1,0,1,0,0|2,0,0]=4 4147 B11R1.226 COC(=O)[C@H]1C[C@H](O)[C@H](O)C1 Amb28065833 [0,1,0,1,0,0|2,0,0]=4 4148 B11R1.429 C\C=C1/C(CC)C1C(=O)OC Amb25938036 [0,1,0,1,0,0|0,0,2]=4 4149 B11R1.429 C\C=C1\C(CC)C1C(=O)OC Amb27598049 [0,1,0,1,0,0|0,0,2]=4 4150 B11R1.768 C#CC(O)C1(CCC)CCC1 Amb28284972 [0,1,0,1,0,0|1,0,1]=4 4151 B11R1.768 C#CCC1(C(=O)OC)CCC1 Amb27854427 [0,1,0,1,0,0|0,0,2]=4 4152 B11R1.768 C=CCC1(C(=O)NO)CCC1 Amb27664766 [0,1,0,1,0,0|0,0,2]=4 4153 B11R1.768 CCCC1(C(=O)NC)CCC1 Amb27840004 [0,1,0,1,0,0|1,0,0]=3 4154 B11R1.768 CCCC1(C(=O)OC)CCC1 Amb27266502 [0,1,0,1,0,0|0,0,0]=2 4155 B11R1.768 CCNC1(C(=O)OC)COC1 Amb27491918 [0,1,0,1,0,0|2,0,0]=4 4156 B11R1.768 CCNC1(C(=O)OC)CSC1 Amb28079804 [0,1,0,1,0,0|2,0,0]=4 4157 B11R1.768 CCOC1(C(=O)OC)CCC1 Amb32667465 [0,1,0,1,0,0|1,0,0]=3 4158 B11R1.768 CNCC1(C(=O)OC)CCC1 Amb27989299 [0,1,0,1,0,0|1,0,0]=3 4159 B11R1.768 COC(=O)C1(CCO)CCC1 Amb33716000 [0,1,0,1,0,0|1,0,0]=3 4160 B11R1.768 COCC1(C(=O)NN)CCC1 Amb30666393 [0,1,0,1,0,0|2,0,0]=4 4161 B11R1.768 COCC1(C(=O)OC)CNC1 Amb32946005 [0,1,0,1,0,0|2,0,0]=4 4162 B11R1.798 CCCC(CCC)C1(C)CO1 Amb33273438 [0,1,0,1,0,0|1,0,1]=4 4163 B11R1.798 CCCC(CCC)C1(O)CC1 Amb33448758 [0,1,0,1,0,0|1,0,1]=4 4164 B11R1.852 C#CC(=O)C1CCCCCN1 Amb24584920 [0,1,0,1,0,0|2,0,0]=4 4165 B11R1.852 C#CC(=O)C1CCCSCC1 Amb35632132 [0,1,0,1,0,0|2,0,0]=4 4166 B11R1.852 C#CC(=O)N1CCCCCC1 Amb28076256 [0,1,0,1,0,0|2,0,0]=4 4167 B11R1.852 C#C[C@@H](O)C1CCCCCC1 Amb28201461 [0,1,0,1,0,0|1,0,1]=4 4168 B11R1.852 C=C(C#N)C1CCCCCC1 Amb32649129 [0,1,0,1,0,0|2,0,0]=4 4169 B11R1.852 C=C(CBr)C1CCCCCC1 Amb33432966 [0,1,0,1,0,0|2,0,0]=4 4170 B11R1.852 C=C(CCl)C1CCCCCC1 Amb33222618 [0,1,0,1,0,0|2,0,0]=4 4171 B11R1.852 C=C(CN)C1CCCCCC1 Amb33267272 [0,1,0,1,0,0|2,0,0]=4 4172 B11R1.852 C=CC(=O)C1CCCCCC1 Amb27814911 [0,1,0,1,0,0|1,0,0]=3 4173 B11R1.852 C=CC(=O)C1CCCCCN1 Amb27760184 [0,1,0,1,0,0|2,0,0]=4 4174 B11R1.852 C=CC(=O)C1CCCSCC1 Amb30031060 [0,1,0,1,0,0|2,0,0]=4 4175 B11R1.852 C=CC(O)C1CCCCCC1 Amb25251758 [0,1,0,1,0,0|1,0,1]=4 4176 B11R1.852 CC(C=O)C1CCCCCC1 Amb26572856 [0,1,0,1,0,0|1,0,1]=4 4177 B11R1.852 CC(CO)C1CCCCCC1 Amb27172053 [0,1,0,1,0,0|1,0,1]=4 4178 B11R1.852 CC(ON)C1CCCCCC1 Amb33267297 [0,1,0,1,0,0|1,0,1]=4 4179 B11R1.852 CCC(=O)C1CCCCCC1 Amb27455372 [0,1,0,1,0,0|1,0,0]=3 4180 B11R1.852 CCC(=O)C1CCCCCN1 Amb27173385 [0,1,0,1,0,0|2,0,0]=4 4181 B11R1.852 CCC(=O)C1CCCCCO1 Amb27843627 [0,1,0,1,0,0|2,0,0]=4 4182 B11R1.852 CCC(=O)C1CCCSCC1 Amb30031065 [0,1,0,1,0,0|2,0,0]=4 4183 B11R1.852 CCC(=O)N1CCCCCC1 Amb5797491 [0,1,0,1,0,0|2,0,0]=4 4184 B11R1.852 CC[C@H](O)C1CCCCCC1 Amb27465124 [0,1,0,1,0,0|1,0,1]=4 4185 B11R1.852 CNC(=O)C1CCCSCC1 Amb30031371 [0,1,0,1,0,0|2,0,0]=4 4186 B11R1.852 COC(=N)C1CCCSCC1 Amb30030953 [0,1,0,1,0,0|2,0,0]=4 4187 B11R1.852 COC(=O)C1=CCCCCC1 Amb26060569 [0,1,0,1,0,0|0,0,2]=4 4188 B11R1.852 COC(=O)C1CCC=CCC1 Amb33456483 [0,1,0,1,0,0|0,0,2]=4 4189 B11R1.852 COC(=O)C1CCCCCC1 Amb18182101 [0,1,0,1,0,0|0,0,0]=2 4190 B11R1.852 COC(=O)C1CCCCCN1 Amb21963566 [0,1,0,1,0,0|1,0,0]=3 4191 B11R1.852 COC(=O)C1CCCCCN1 Amb33548478 [0,1,0,1,0,0|1,0,0]=3 4192 B11R1.852 COC(=O)C1CCCCNC1 Amb21963336 [0,1,0,1,0,0|1,0,0]=3 4193 B11R1.852 COC(=O)C1CCCCNC1 Amb22490910 [0,1,0,1,0,0|1,0,0]=3 4194 B11R1.852 COC(=O)C1CCCNCC1 Amb22170283 [0,1,0,1,0,0|1,0,0]=3 4195 B11R1.852 COC(=O)C1CCCNCC1 Amb22230921 [0,1,0,1,0,0|1,0,0]=3 4196 B11R1.852 COC(=O)C1CCCSCC1 Amb30030973 [0,1,0,1,0,0|1,0,0]=3 4197 B11R1.852 COC(=O)C1CCNCCO1 Amb27441830 [0,1,0,1,0,0|2,0,0]=4 4198 B11R1.852 COC(=O)C1CCSCCN1 Amb27191806 [0,1,0,1,0,0|2,0,0]=4 4199 B11R1.852 COC(=O)C1CNCCCN1 Amb22406405 [0,1,0,1,0,0|2,0,0]=4 4200 B11R1.852 COC(=O)C1CNCCOC1 Amb27782567 [0,1,0,1,0,0|2,0,0]=4 4201 B11R1.852 COC(=O)C1CNCCOC1 Amb32434762 [0,1,0,1,0,0|2,0,0]=4 4202 B11R1.852 COC(=O)C1CNCCSC1 Amb25988488 [0,1,0,1,0,0|2,0,0]=4 4203 B11R1.852 COC(=O)N1CCCCCC1 Amb17789384 [0,1,0,1,0,0|1,0,0]=3 4204 B11R1.852 COC(=O)N1CCCCCO1 Amb27207557 [0,1,0,1,0,0|2,0,0]=4 4205 B11R1.852 COC(=O)N1CCCNCC1 Amb22886449 [0,1,0,1,0,0|2,0,0]=4 4206 B11R1.852 COC(=O)N1CCCNCC1 Amb6668674 [0,1,0,1,0,0|2,0,0]=4 4207 B11R1.852 COC(=O)[C@@H]1CCOCCN1 Amb35825220 [0,1,0,1,0,0|2,0,0]=4 4208 B11R1.852 COC(=O)[C@@H]1COCCCN1 Amb27210558 [0,1,0,1,0,0|2,0,0]=4 4209 B11R1.852 COC(=O)[C@H]1CCOCCN1 Amb35825221 [0,1,0,1,0,0|2,0,0]=4 4210 B11R1.852 COC(=O)[C@H]1COCCCN1 Amb27214865 [0,1,0,1,0,0|2,0,0]=4 4211 B11R1.852 C[C@@H](CO)C1CCCCCC1 Amb33735550 [0,1,0,1,0,0|1,0,1]=4 4212 B11R1.852 C[C@H](CO)C1CCCCCC1 Amb33730453 [0,1,0,1,0,0|1,0,1]=4 4213 B11R1.852 C\C(=N/N)C1CCCCCC1 Amb27485431 [0,1,0,1,0,0|2,0,0]=4 4214 B11R1.852 N=C(NO)C1CCCOCC1 Amb33033653 [0,1,0,1,0,0|2,0,0]=4 4215 B11R1.852 NC(CO)C1CCCCCC1 Amb26557913 [0,1,0,1,0,0|1,0,1]=4 4216 B11R1.852 NCC(=O)C1CCCCCC1 Amb24402617 [0,1,0,1,0,0|1,0,0]=3 4217 B11R1.852 NCC(=O)N1CCCCCC1 Amb6260451 [0,1,0,1,0,0|2,0,0]=4 4218 B11R1.852 NCC(O)C1CCCCCC1 Amb27257834 [0,1,0,1,0,0|1,0,1]=4 4219 B11R1.852 NC[C@@H](O)C1CCCCCC1 Amb33267309 [0,1,0,1,0,0|1,0,1]=4 4220 B11R1.852 NC[C@H](O)C1CCCCCC1 Amb33267310 [0,1,0,1,0,0|1,0,1]=4 4221 B11R1.852 NNC(=O)C1CCCCCC1 Amb18797041 [0,1,0,1,0,0|1,0,0]=3 4222 B11R1.852 NNC(=O)C1CCCSCC1 Amb35649201 [0,1,0,1,0,0|2,0,0]=4 4223 B11R1.852 N[C@@H](CO)C1CCCCCC1 Amb33224818 [0,1,0,1,0,0|1,0,1]=4 4224 B11R1.852 N[C@H](CO)C1CCCCCC1 Amb33267308 [0,1,0,1,0,0|1,0,1]=4 4225 B11R1.852 N\C(=N/O)C1CCCCCC1 Amb20622914 [0,1,0,1,0,0|1,0,0]=3 4226 B11R1.852 N\C(=N/O)C1CCCSCC1 Amb30029721 [0,1,0,1,0,0|2,0,0]=4 4227 B11R1.852 N\C(=N/O)N1CCCCCC1 Amb18799812 [0,1,0,1,0,0|2,0,0]=4 4228 B11R1.852 N\N=C(/N)C1CCCCCC1 Amb2696473 [0,1,0,1,0,0|2,0,0]=4 4229 B11R1.852 O=C(CBr)C1CCCCCC1 Amb22001874 [0,1,0,1,0,0|1,0,0]=3 4230 B11R1.852 O=C(CBr)N1CCCCCC1 Amb17327121 [0,1,0,1,0,0|2,0,0]=4 4231 B11R1.852 O=C(CCl)C1CCCCCC1 Amb25991272 [0,1,0,1,0,0|1,0,0]=3 4232 B11R1.852 O=C(CCl)N1CCCCCC1 Amb1150075 [0,1,0,1,0,0|2,0,0]=4 4233 B11R1.852 O=C(CF)N1CCCCCC1 Amb26045665 [0,1,0,1,0,0|2,0,0]=4 4234 B11R1.852 O=C(CI)N1CCCCCC1 Amb27836314 [0,1,0,1,0,0|2,0,0]=4 4235 B11R1.852 O=C(CO)C1CCCCCN1 Amb28053242 [0,1,0,1,0,0|1,0,0]=3 4236 B11R1.852 O=C(CO)N1CCCCCC1 Amb1111379 [0,1,0,1,0,0|1,0,0]=3 4237 B11R1.852 O=C(NO)C1CCCCCC1 Amb18182216 [0,1,0,1,0,0|0,0,0]=2 4238 B11R1.852 O=C(NO)C1CCCOCC1 Amb27947213 [0,1,0,1,0,0|1,0,0]=3 4239 B11R1.852 O=C(NO)C1CCCSCC1 Amb35627029 [0,1,0,1,0,0|1,0,0]=3 4240 B11R1.852 O=C(NO)N1CCCCCC1 Amb27455505 [0,1,0,1,0,0|1,0,0]=3 4241 B11R1.852 OC(CBr)C1CCCCCC1 Amb33432625 [0,1,0,1,0,0|1,0,1]=4 4242 B11R1.852 OC(CCl)C1CCCCCC1 Amb33222609 [0,1,0,1,0,0|1,0,1]=4 4243 B11R1.852 OC(CF)C1CCCCCC1 Amb26566783 [0,1,0,1,0,0|1,0,1]=4 4244 B11R1.852 OCC(O)C1CCCCCC1 Amb24701975 [0,1,0,1,0,0|0,0,2]=4 4245 B11R1.852 O\N=C(/Cl)C1CCCCCC1 Amb28315230 [0,1,0,1,0,0|1,0,0]=3 4246 B11R1.1233 CCCC1(CCC)OC1C#N Amb26990770 [0,1,0,1,0,0|1,0,1]=4 4247 B11R1.17 C#CCCC1CCCNC1=O Amb27812760 [0,1,0,1,0,0|1,0,1]=4 4248 B11R1.17 C=C1CCCCC1CCCBr Amb27654983 [0,1,0,1,0,0|2,0,0]=4 4249 B11R1.17 CCCCC1CCCCC1=O Amb3940594 [0,1,0,1,0,0|1,0,0]=3 4250 B11R1.17 CCCCC1CCCCC1O Amb3354798 [0,1,0,1,0,0|1,0,1]=4 4251 B11R1.17 CCCCC1NCCNC1=O Amb18989085 [0,1,0,1,0,0|2,0,0]=4 4252 B11R1.17 CCCC[C@@H]1CCCC[C@@H]1O Amb25933579 [0,1,0,1,0,0|1,0,1]=4 4253 B11R1.17 CCCC[C@@H]1CCCC[C@H]1O Amb26614644 [0,1,0,1,0,0|1,0,1]=4 4254 B11R1.17 CCCNC1CCCCC1O Amb844924 [0,1,0,1,0,0|1,0,1]=4 4255 B11R1.17 CCCN[C@@H]1CCCC[C@@H]1O Amb23263413 [0,1,0,1,0,0|1,0,1]=4 4256 B11R1.17 CCCN[C@@H]1CCCC[C@H]1O Amb10608055 [0,1,0,1,0,0|1,0,1]=4 4257 B11R1.17 CCCOC1CCCCC1O Amb18183283 [0,1,0,1,0,0|1,0,1]=4 4258 B11R1.17 CCCO[C@@H]1CCCC[C@H]1O Amb28319930 [0,1,0,1,0,0|1,0,1]=4 4259 B11R1.17 CCCS[C@@H]1CCCC[C@H]1O Amb25699949 [0,1,0,1,0,0|1,0,1]=4 4260 B11R1.17 CCCS[C@H]1CCCC[C@@H]1O Amb27822957 [0,1,0,1,0,0|1,0,1]=4 4261 B11R1.17 CCC\C=C1/CCCCC1=O Amb3372069 [0,1,0,1,0,0|1,0,1]=4 4262 B11R1.17 CCNCC1CCCCC1O Amb18644960 [0,1,0,1,0,0|1,0,1]=4 4263 B11R1.17 CCNCC1CCCOC1C Amb28064514 [0,1,0,1,0,0|1,0,1]=4 4264 B11R1.17 CCOCC1CCCCC1=O Amb27399156 [0,1,0,1,0,0|1,0,0]=3 4265 B11R1.17 CCOCC1CCCCC1O Amb26996081 [0,1,0,1,0,0|1,0,1]=4 4266 B11R1.17 CCOC[C@@H]1CCCC[C@H]1O Amb26970539 [0,1,0,1,0,0|1,0,1]=4 4267 B11R1.17 CCOC[C@H]1NCCNC1=O Amb28245307 [0,1,0,1,0,0|2,0,0]=4 4268 B11R1.17 CNCCC1CCCCC1O Amb28077324 [0,1,0,1,0,0|1,0,1]=4 4269 B11R1.17 CNCCN1CCCCC1=O Amb10607655 [0,1,0,1,0,0|2,0,0]=4 4270 B11R1.17 CNCCN1CCCCC1=O Amb8503381 [0,1,0,1,0,0|2,0,0]=4 4271 B11R1.17 CNCCN1CCCNC1=O Amb18994359 [0,1,0,1,0,0|2,0,0]=4 4272 B11R1.17 CNCCN1CCCNC1=O Amb32676660 [0,1,0,1,0,0|2,0,0]=4 4273 B11R1.17 CNCCN1CCCOC1=O Amb18994355 [0,1,0,1,0,0|1,0,0]=3 4274 B11R1.17 COCCC1CCCNC1=O Amb28313285 [0,1,0,1,0,0|1,0,0]=3 4275 B11R1.17 COCCC1COCCC1=O Amb27628599 [0,1,0,1,0,0|2,0,0]=4 4276 B11R1.17 COCC[C@@H]1CCCC[C@@H]1O Amb27978371 [0,1,0,1,0,0|1,0,1]=4 4277 B11R1.17 COCC[C@@H]1CCCC[C@H]1O Amb27197114 [0,1,0,1,0,0|1,0,1]=4 4278 B11R1.17 COCC[C@H]1CCCCC1=O Amb27974073 [0,1,0,1,0,0|1,0,0]=3 4279 B11R1.17 COCOC1CCCCC1=O Amb27750289 [0,1,0,1,0,0|2,0,0]=4 4280 B11R1.17 CSCCC1CCCNC1=O Amb27949745 [0,1,0,1,0,0|1,0,0]=3 4281 B11R1.17 C\C=C\CC1CCCNC1=O Amb26658441 [0,1,0,1,0,0|1,0,1]=4 4282 B11R1.17 N#CCCC1CCCCC1=O Amb2720475 [0,1,0,1,0,0|1,0,1]=4 4283 B11R1.17 NCCCC1CCCCC1=O Amb18251486 [0,1,0,1,0,0|1,0,0]=3 4284 B11R1.17 NCCCC1CCCCC1O Amb9783182 [0,1,0,1,0,0|1,0,1]=4 4285 B11R1.17 NCCCC1CCCNC1=O Amb27863499 [0,1,0,1,0,0|1,0,0]=3 4286 B11R1.17 NCCCN1CCCCC1=O Amb6751261 [0,1,0,1,0,0|2,0,0]=4 4287 B11R1.17 NCCCN1CCCNC1=O Amb18987991 [0,1,0,1,0,0|2,0,0]=4 4288 B11R1.17 NCCC[C@@H]1CCCC[C@H]1O Amb27845404 [0,1,0,1,0,0|1,0,1]=4 4289 B11R1.17 O=C1CCCCC1CCCO Amb27481191 [0,1,0,1,0,0|1,0,0]=3 4290 B11R1.17 O=C1CCCCN1CCCCl Amb6751295 [0,1,0,1,0,0|2,0,0]=4 4291 B11R1.17 O=C1CCCCN1CCCO Amb9370460 [0,1,0,1,0,0|2,0,0]=4 4292 B11R1.17 O=C1CCOCC1CCCF Amb27640843 [0,1,0,1,0,0|2,0,0]=4 4293 B11R1.17 O=C1CCOCC1CCCO Amb28284744 [0,1,0,1,0,0|2,0,0]=4 4294 B11R1.17 O=C1NCCCC1CCCO Amb25978142 [0,1,0,1,0,0|1,0,0]=3 4295 B11R1.17 O=C1NCCCC1NCCF Amb28341468 [0,1,0,1,0,0|2,0,0]=4 4296 B11R1.17 O=C1NCCCC1SCCO Amb27980138 [0,1,0,1,0,0|2,0,0]=4 4297 B11R1.17 O=C1NCCCN1CCCF Amb27607289 [0,1,0,1,0,0|2,0,0]=4 4298 B11R1.17 O=C1NCCCN1CCCO Amb27254452 [0,1,0,1,0,0|2,0,0]=4 4299 B11R1.17 O=C1OCCCC1CCCI Amb27261546 [0,1,0,1,0,0|0,0,0]=2 4300 B11R1.17 O=C1OCCCN1CCCO Amb25130885 [0,1,0,1,0,0|1,0,0]=3 4301 B11R1.17 O=CCCC1CCCOC1=O Amb28320351 [0,1,0,1,0,0|0,0,1]=3 4302 B11R1.17 OCCCC1CCCCC1O Amb27170228 [0,1,0,1,0,0|1,0,1]=4 4303 B11R1.17 OCCCC1CCCOC1O Amb28190299 [0,1,0,1,0,0|0,0,2]=4 4304 B11R1.17 OCCC[C@@H]1CCCC[C@H]1O Amb27448760 [0,1,0,1,0,0|1,0,1]=4 4305 B11R1.21 C=C1CCC(C(=O)O)CC1N Amb27651677 [0,1,0,1,0,0|1,0,1]=4 4306 B11R1.21 C=C1CC[C@@H](C(=O)O)C[C@@H]1N Amb28142351 [0,1,0,1,0,0|1,0,1]=4 4307 B11R1.21 CC(=O)C1CCC(C)=C(C)C1 Amb25920982 [0,1,0,1,0,0|1,0,1]=4 4308 B11R1.21 CC(=O)C1CCC(C)C(O)C1 Amb27859372 [0,1,0,1,0,0|2,0,0]=4 4309 B11R1.21 CC(=O)C1CCC(O)C(O)C1 Amb26937963 [0,1,0,1,0,0|2,0,0]=4 4310 B11R1.21 CC(=O)N1CCC(Br)C(C)C1 Amb27863066 [0,1,0,1,0,0|2,0,0]=4 4311 B11R1.21 CC(=O)N1CCC(Cl)C(C)C1 Amb27754206 [0,1,0,1,0,0|2,0,0]=4 4312 B11R1.21 CC(=O)N1CCC(N)C(C)C1 Amb25272008 [0,1,0,1,0,0|2,0,0]=4 4313 B11R1.21 CC(=O)N1CCC(N)C(C)C1 Amb30584757 [0,1,0,1,0,0|2,0,0]=4 4314 B11R1.21 CC(=O)N1CCC(O)C(C)C1 Amb28123825 [0,1,0,1,0,0|2,0,0]=4 4315 B11R1.21 CC(=O)[C@@H]1CC[C@@H](C)C(O)C1 Amb28144088 [0,1,0,1,0,0|2,0,0]=4 4316 B11R1.21 CC(=O)[C@@H]1CC[C@@H](C)[C@H](O)C1 Amb28132327 [0,1,0,1,0,0|2,0,0]=4 4317 B11R1.21 CC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1 Amb27972973 [0,1,0,1,0,0|1,0,0]=3 4318 B11R1.21 CC1=C(C)CC(C(=O)Cl)CC1 Amb27251519 [0,1,0,1,0,0|1,0,1]=4 4319 B11R1.21 CC1=C(C)CC(C(=O)O)CC1 Amb7088978 [0,1,0,1,0,0|0,0,1]=3 4320 B11R1.21 CC1=C(C)CC(C(N)=O)CC1 Amb27858869 [0,1,0,1,0,0|1,0,1]=4 4321 B11R1.21 CC1=C(C)C[C@@H](C(=O)O)CC1 Amb24432806 [0,1,0,1,0,0|0,0,1]=3 4322 B11R1.21 CC1=CC(C(=O)O)CCC1Cl Amb18647872 [0,1,0,1,0,0|0,0,2]=4 4323 B11R1.21 CC1=C[C@H](C(=O)O)CC[C@@H]1Cl Amb27444963 [0,1,0,1,0,0|0,0,2]=4 4324 B11R1.21 CC1C=C(C(=O)O)OCC1C Amb27791813 [0,1,0,1,0,0|0,0,2]=4 4325 B11R1.21 CC1CC(C(=O)O)CCC1=O Amb25172803 [0,1,0,1,0,0|0,0,1]=3 4326 B11R1.21 CC1CC(C(=O)O)CCN1C Amb18830606 [0,1,0,1,0,0|0,0,0]=2 4327 B11R1.21 CC1CC(C(=O)O)CCN1C Amb33313501 [0,1,0,1,0,0|0,0,0]=2 4328 B11R1.21 CC1CC(C(=O)O)CNC1=O Amb28129105 [0,1,0,1,0,0|1,0,1]=4 4329 B11R1.21 CC1CC(C(N)=O)CCC1=O Amb27661682 [0,1,0,1,0,0|1,0,1]=4 4330 B11R1.21 CC1CCC(C(=O)Cl)CC1Cl Amb28285389 [0,1,0,1,0,0|2,0,0]=4 4331 B11R1.21 CC1CCC(C(=O)O)CC1C Amb26037213 [0,1,0,1,0,0|0,0,0]=2 4332 B11R1.21 CC1CCC(C(=O)O)CC1N Amb25065260 [0,1,0,1,0,0|1,0,0]=3 4333 B11R1.21 CC1CCC(C(=O)O)NC1C Amb27862874 [0,1,0,1,0,0|1,0,0]=3 4334 B11R1.21 CC1CCC(C(=O)O)NC1C Amb28594270 [0,1,0,1,0,0|1,0,0]=3 4335 B11R1.21 CC1CCC(C(N)=O)CC1C Amb26420059 [0,1,0,1,0,0|1,0,0]=3 4336 B11R1.21 CC1CCC(C(N)=O)CN1C Amb27594294 [0,1,0,1,0,0|2,0,0]=4 4337 B11R1.21 CC1CCC(C(N)=O)NC1C Amb27875309 [0,1,0,1,0,0|2,0,0]=4 4338 B11R1.21 CC1CCN(C(=O)Cl)CC1C Amb24392060 [0,1,0,1,0,0|2,0,0]=4 4339 B11R1.21 CC1CN(C(=O)Cl)CCN1C Amb26603558 [0,1,0,1,0,0|2,0,0]=4 4340 B11R1.21 CC1CN(C(N)=O)CCC1N Amb28460764 [0,1,0,1,0,0|2,0,0]=4 4341 B11R1.21 CC1NC(C(=O)O)CCC1O Amb28344643 [0,1,0,1,0,0|1,0,0]=3 4342 B11R1.21 CC1NC(C(=O)O)COC1C Amb28248835 [0,1,0,1,0,0|1,0,0]=3 4343 B11R1.21 CC1NC(C(=O)O)COC1C Amb32663609 [0,1,0,1,0,0|1,0,0]=3 4344 B11R1.21 CN1CC(C(=O)O)CCC1=O Amb22799390 [0,1,0,1,0,0|1,0,1]=4 4345 B11R1.21 CN1CC(C(=O)O)CCC1=O Amb6890404 [0,1,0,1,0,0|1,0,1]=4 4346 B11R1.21 CN1CCC(C(=O)O)CC1=O Amb6892357 [0,1,0,1,0,0|1,0,1]=4 4347 B11R1.21 C[C@@H]1C[C@@H](C(=O)O)CCN1C Amb34916530 [0,1,0,1,0,0|0,0,0]=2 4348 B11R1.21 C[C@@H]1C[C@H](C(=O)O)CCC1=O Amb27863430 [0,1,0,1,0,0|0,0,1]=3 4349 B11R1.21 C[C@@H]1C[C@H](C(=O)O)CCN1C Amb26887865 [0,1,0,1,0,0|0,0,0]=2 4350 B11R1.21 C[C@@H]1C[C@H](C(=O)O)CCN1C Amb33313523 [0,1,0,1,0,0|0,0,0]=2 4351 B11R1.21 C[C@H]1C[C@@H](C(=O)O)CCN1C Amb27852375 [0,1,0,1,0,0|0,0,0]=2 4352 B11R1.21 C[C@H]1C[C@@H](C(=O)O)NC[C@H]1O Amb28056092 [0,1,0,1,0,0|1,0,0]=3 4353 B11R1.21 C[C@H]1C[C@H](C(=O)O)CC[C@H]1Cl Amb28245232 [0,1,0,1,0,0|0,0,0]=2 4354 B11R1.21 NC(=O)[C@@H]1CC[C@@H](N)[C@H](O)C1 Amb24631873 [0,1,0,1,0,0|2,0,0]=4 4355 B11R1.21 NC(=O)[C@H]1CC[C@H](N)[C@@H](O)C1 Amb28062962 [0,1,0,1,0,0|2,0,0]=4 4356 B11R1.21 NC1CC(C(=O)O)CCC1O Amb28251132 [0,1,0,1,0,0|1,0,0]=3 4357 B11R1.21 N[C@@H]1C[C@H](C(=O)O)CC[C@@H]1O Amb26636622 [0,1,0,1,0,0|1,0,0]=3 4358 B11R1.21 O=C(O)C1CCC(Cl)C(Cl)C1 Amb28076627 [0,1,0,1,0,0|1,0,0]=3 4359 B11R1.21 O=C(O)C1C[C@H](O)[C@@H](O)CN1 Amb27875087 [0,1,0,1,0,0|2,0,0]=4 4360 B11R1.21 O=C(O)[C@@H]1CC[C@@H](F)[C@@H](F)C1 Amb27226178 [0,1,0,1,0,0|1,0,0]=3 4361 B11R1.21 O=C(O)[C@@H]1CC[C@@H](O)[C@H](O)C1 Amb28320743 [0,1,0,1,0,0|1,0,0]=3 4362 B11R1.21 O=C(O)[C@@H]1CC[C@H](O)[C@@H](O)C1 Amb28245268 [0,1,0,1,0,0|1,0,0]=3 4363 B11R1.21 O=C(O)[C@@H]1C[C@H](O)[C@@H](O)CN1 Amb27460469 [0,1,0,1,0,0|2,0,0]=4 4364 B11R1.21 O=C(O)[C@@H]1C[C@H](O)[C@H](O)CN1 Amb27635007 [0,1,0,1,0,0|2,0,0]=4 4365 B11R1.21 O=C(O)[C@@H]1C[C@H](O)[C@H](O)CO1 Amb35750828 [0,1,0,1,0,0|2,0,0]=4 4366 B11R1.21 O=C(O)[C@H]1C[C@@H](O)[C@@H](O)CN1 Amb27818197 [0,1,0,1,0,0|2,0,0]=4 4367 B11R1.21 O=C(O)[C@H]1C[C@@H](O)[C@H](O)CN1 Amb28320503 [0,1,0,1,0,0|2,0,0]=4 4368 B11R1.21 O=C(O)[C@H]1C[C@H](O)[C@H](O)CO1 Amb35750235 [0,1,0,1,0,0|2,0,0]=4 4369 B11R1.21 O=C1CC(C(=O)O)CCC1O Amb27176349 [0,1,0,1,0,0|1,0,1]=4 4370 B11R1.48 CC(=O)C1C[C@@H](C)[C@H](CO)C1 Amb27432691 [0,1,0,1,0,0|1,0,0]=3 4371 B11R1.48 CC(=O)C1C[C@H](C)[C@@H](CO)C1 Amb27471957 [0,1,0,1,0,0|1,0,0]=3 4372 B11R1.48 CC(=O)N1CC(C)C(CBr)C1 Amb26586579 [0,1,0,1,0,0|2,0,0]=4 4373 B11R1.48 CC(=O)N1CC(C)C(CCl)C1 Amb24546171 [0,1,0,1,0,0|2,0,0]=4 4374 B11R1.48 CC(=O)N1CC(C)C(CN)C1 Amb25336659 [0,1,0,1,0,0|2,0,0]=4 4375 B11R1.48 CC(=O)N1CC(C)C(CO)C1 Amb26893821 [0,1,0,1,0,0|2,0,0]=4 4376 B11R1.48 CC(=O)N1CC(C)C(CS)C1 Amb27428498 [0,1,0,1,0,0|2,0,0]=4 4377 B11R1.48 CC1CC(C(=O)O)C\C1=N/O Amb27407107 [0,1,0,1,0,0|1,0,1]=4 4378 B11R1.48 CCC1NC(C(=O)O)CC1C Amb18200003 [0,1,0,1,0,0|0,0,0]=2 4379 B11R1.48 CCN1CC(C(=O)O)CC1=O Amb9707072 [0,1,0,1,0,0|1,0,1]=4 4380 B11R1.48 CCN1O[C@@H](C(C)=O)C[C@H]1C Amb27420185 [0,1,0,1,0,0|2,0,0]=4 4381 B11R1.48 CCN1O[C@H](C(C)=O)C[C@@H]1C Amb25371125 [0,1,0,1,0,0|2,0,0]=4 4382 B11R1.48 C[C@@H]1CN(C(N)=O)C[C@H]1CO Amb27421021 [0,1,0,1,0,0|2,0,0]=4 4383 B11R1.48 C[C@@H]1C[C@@H](C(=O)O)N[C@@H]1CO Amb25918100 [0,1,0,1,0,0|1,0,0]=3 4384 B11R1.48 NC(=O)C1CC(O)C(CO)C1 Amb28325884 [0,1,0,1,0,0|2,0,0]=4 4385 B11R1.48 NC(=O)[C@@H]1C[C@H](O)[C@H](CO)C1 Amb27660977 [0,1,0,1,0,0|2,0,0]=4 4386 B11R1.48 NCC1OC(C(=O)O)CC1O Amb27596958 [0,1,0,1,0,0|2,0,0]=4 4387 B11R1.48 NC[C@H]1CC(C(=O)O)C[C@H]1O Amb27879994 [0,1,0,1,0,0|1,0,0]=3 4388 B11R1.48 NC[C@H]1O[C@@H](C(=O)O)C[C@@H]1O Amb10066959 [0,1,0,1,0,0|2,0,0]=4 4389 B11R1.48 O=C(O)C1CC(O)C(CO)O1 Amb27596869 [0,1,0,1,0,0|2,0,0]=4 4390 B11R1.48 O=C(O)[C@@H]1C[C@H](O)[C@@H](CO)N1 Amb27658923 [0,1,0,1,0,0|2,0,0]=4 4391 B11R1.48 O=C(O)[C@@H]1C[C@H](O)[C@H](CO)N1 Amb25273969 [0,1,0,1,0,0|2,0,0]=4 4392 B11R1.48 O=C(O)[C@@H]1C[C@H](O)[C@H](CO)O1 Amb28325693 [0,1,0,1,0,0|2,0,0]=4 4393 B11R1.48 O=C(O)[C@H]1C[C@@H](O)[C@H](CO)N1 Amb26456314 [0,1,0,1,0,0|2,0,0]=4 4394 B11R1.48 O=C(O)[C@H]1C[C@H](O)[C@@H](CO)N1 Amb28193760 [0,1,0,1,0,0|2,0,0]=4 4395 B11R1.48 O=C(O)[C@H]1C[C@H](O)[C@@H](CO)O1 Amb27216302 [0,1,0,1,0,0|2,0,0]=4 4396 B11R1.64 CC1CCC(C(=O)O)C1CN Amb20623956 [0,1,0,1,0,0|1,0,0]=3 4397 B11R1.64 CCC1C(=O)CC[C@H]1C(=O)O Amb27865586 [0,1,0,1,0,0|0,0,1]=3 4398 B11R1.64 CCC1C(C(=O)O)CCN1C Amb27863902 [0,1,0,1,0,0|0,0,0]=2 4399 B11R1.64 CCC1C(C(=O)O)CCN1C Amb32665015 [0,1,0,1,0,0|0,0,0]=2 4400 B11R1.64 CCN1C(=O)CCC1C(=O)O Amb18288294 [0,1,0,1,0,0|1,0,1]=4 4401 B11R1.64 CCN1C(=O)CC[C@H]1C(=O)O Amb25108137 [0,1,0,1,0,0|1,0,1]=4 4402 B11R1.64 CC[C@@H]1C(=O)CC[C@H]1C(=O)O Amb27233378 [0,1,0,1,0,0|0,0,1]=3 4403 B11R1.64 CC[C@@H]1C(=O)NC[C@H]1C(=O)O Amb28319505 [0,1,0,1,0,0|1,0,1]=4 4404 B11R1.64 CC[C@@H]1[C@@H](C(=O)O)CCN1C Amb18199982 [0,1,0,1,0,0|0,0,0]=2 4405 B11R1.64 CC[C@@H]1[C@@H](C(=O)O)CCN1C Amb28722109 [0,1,0,1,0,0|0,0,0]=2 4406 B11R1.64 CC[C@H]1C(=O)CN[C@@H]1C(=O)O Amb18830650 [0,1,0,1,0,0|1,0,1]=4 4407 B11R1.64 CC[C@H]1C(=O)OC[C@H]1C(=O)O Amb27639476 [0,1,0,1,0,0|1,0,1]=4 4408 B11R1.64 CO[C@@H]1[C@@H](F)CN[C@@H]1C(=O)O Amb27660933 [0,1,0,1,0,0|2,0,0]=4 4409 B11R1.64 NCC1C(=O)CCC1C(=O)O Amb27495236 [0,1,0,1,0,0|1,0,1]=4 4410 B11R1.64 O=C(O)C1CCC(=O)C1CCl Amb28396682 [0,1,0,1,0,0|1,0,1]=4 4411 B11R1.81 CC1CNC(CCO)C(=O)O1 Amb27782077 [0,1,0,1,0,0|1,0,0]=3 4412 B11R1.81 CCCC1CCC(=O)CC1=O Amb24434577 [0,1,0,1,0,0|1,0,1]=4 4413 B11R1.81 CCCC1CCC(=O)NC1=O Amb20668024 [0,1,0,1,0,0|1,0,1]=4 4414 B11R1.81 CCCC1CCC(=O)OC1=O Amb25381158 [0,1,0,1,0,0|0,0,1]=3 4415 B11R1.81 CCCC1CCC(C)CC1O Amb579455 [0,1,0,1,0,0|1,0,1]=4 4416 B11R1.81 CCCC1NCC(C)N=C1C Amb27851413 [0,1,0,1,0,0|2,0,0]=4 4417 B11R1.81 CCCC1NCC(C)NC1=O Amb28129131 [0,1,0,1,0,0|1,0,0]=3 4418 B11R1.81 CCCN1CCC(N)CC1=O Amb27812176 [0,1,0,1,0,0|2,0,0]=4 4419 B11R1.81 CCC[C@@H]1CCN(C)C[C@H]1O Amb27775848 [0,1,0,1,0,0|1,0,1]=4 4420 B11R1.81 CCC[C@@H]1CC[C@@H](C)C[C@H]1O Amb27443260 [0,1,0,1,0,0|1,0,1]=4 4421 B11R1.81 CCC[C@@H]1CC[C@H](C)C[C@@H]1O Amb27853812 [0,1,0,1,0,0|1,0,1]=4 4422 B11R1.81 CN1CCC(CCN)C(=O)C1 Amb18200165 [0,1,0,1,0,0|2,0,0]=4 4423 B11R1.185 C=CCC1CC(CO)OC1=O Amb27665400 [0,1,0,1,0,0|0,0,2]=4 4424 B11R1.185 CCC1CN(CCN)C(=O)O1 Amb26050688 [0,1,0,1,0,0|2,0,0]=4 4425 B11R1.185 CCC1OC(=O)C(CCO)O1 Amb27972455 [0,1,0,1,0,0|1,0,0]=3 4426 B11R1.185 CCCN1CC(CBr)OC1=O Amb18763811 [0,1,0,1,0,0|1,0,0]=3 4427 B11R1.185 CCCN1CC(CCl)OC1=O Amb28246344 [0,1,0,1,0,0|1,0,0]=3 4428 B11R1.185 CCCN1CC(CN)CC1=O Amb32663720 [0,1,0,1,0,0|2,0,0]=4 4429 B11R1.185 CCCN1CC(CN)CC1=O Amb33544217 [0,1,0,1,0,0|2,0,0]=4 4430 B11R1.185 CCCN1CC(CN)OC1=O Amb17077244 [0,1,0,1,0,0|1,0,0]=3 4431 B11R1.185 CCCN1CC(CO)CC1=O Amb5755306 [0,1,0,1,0,0|2,0,0]=4 4432 B11R1.185 CCCN1CC(NC)CC1=O Amb25097676 [0,1,0,1,0,0|2,0,0]=4 4433 B11R1.185 CCCN1C[C@@H](CN)OC1=O Amb31161574 [0,1,0,1,0,0|1,0,0]=3 4434 B11R1.185 CC[C@@H]1OC(=O)[C@H](CCO)O1 Amb27218885 [0,1,0,1,0,0|1,0,0]=3 4435 B11R1.185 CC[C@H]1OC(=O)[C@H](CCO)O1 Amb28065369 [0,1,0,1,0,0|1,0,0]=3 4436 B11R1.191 CCCC1CCCCC1(C)O Amb32945232 [0,1,0,1,0,0|1,0,1]=4 4437 B11R1.191 CCCC1CCCNS1(=O)=O Amb33298924 [0,1,0,1,0,0|1,0,1]=4 4438 B11R1.191 CCC[C@@H]1CCCC[C@@]1(C)O Amb33213723 [0,1,0,1,0,0|1,0,1]=4 4439 B11R1.230 C=CCC[C@@H]1C[C@H](C)CC1=O Amb28285869 [0,1,0,1,0,0|1,0,1]=4 4440 B11R1.230 CC1CN(CCCN)C(=O)O1 Amb27776639 [0,1,0,1,0,0|1,0,0]=3 4441 B11R1.230 CCCCC1CC(=O)OC1=O Amb22230364 [0,1,0,1,0,0|1,0,1]=4 4442 B11R1.230 CCCCC1CC(C)=CC1=O Amb27256390 [0,1,0,1,0,0|1,0,1]=4 4443 B11R1.230 CCCCC1CC(C)OC1=O Amb4136407 [0,1,0,1,0,0|0,0,0]=2 4444 B11R1.230 CCCC[C@H]1CC(=O)OC1=O Amb27805036 [0,1,0,1,0,0|1,0,1]=4 4445 B11R1.230 CCCNC1CN(C)NC1=O Amb28434343 [0,1,0,1,0,0|2,0,0]=4 4446 B11R1.230 CCC\C=C1\CC(C)NC1=O Amb28428471 [0,1,0,1,0,0|1,0,1]=4 4447 B11R1.230 CCC\C=C1\CC(C)OC1=O Amb27400622 [0,1,0,1,0,0|0,0,1]=3 4448 B11R1.230 CCONC1CC(C)OC1=O Amb28366938 [0,1,0,1,0,0|1,0,0]=3 4449 B11R1.230 CCSCC1CC(=O)OC1=O Amb33323651 [0,1,0,1,0,0|1,0,1]=4 4450 B11R1.230 COCCC1CC(=O)OC1=O Amb33377346 [0,1,0,1,0,0|1,0,1]=4 4451 B11R1.230 CSCCC1CC(=O)OC1=O Amb33203368 [0,1,0,1,0,0|1,0,1]=4 4452 B11R1.233 CCCSC1CCCC1(C)O Amb28126056 [0,1,0,1,0,0|1,0,1]=4 4453 B11R1.233 CNCCC1CCCS1(=O)=O Amb35673547 [0,1,0,1,0,0|1,0,1]=4 4454 B11R1.233 NCCCC1CCCS1(=O)=O Amb17063304 [0,1,0,1,0,0|1,0,1]=4 4455 B11R1.233 O=S1(=O)CCCC1CCCBr Amb32690553 [0,1,0,1,0,0|1,0,1]=4 4456 B11R1.233 O=S1(=O)CCCC1CCCCl Amb32690552 [0,1,0,1,0,0|1,0,1]=4 4457 B11R1.233 O=S1(=O)CCCC1CCCO Amb35723305 [0,1,0,1,0,0|1,0,1]=4 4458 B11R1.254 O=C(O)C1CC(CO)C1CO Amb28240361 [0,1,0,1,0,0|1,0,0]=3 4459 B11R1.266 CC(=O)C1CCCC(CN)C1 Amb33132402 [0,1,0,1,0,0|1,0,0]=3 4460 B11R1.266 CC(=O)N1CCCC(CBr)C1 Amb17103817 [0,1,0,1,0,0|2,0,0]=4 4461 B11R1.266 CC(=O)N1CCCC(CCl)C1 Amb17103400 [0,1,0,1,0,0|2,0,0]=4 4462 B11R1.266 CC(=O)N1CCCC(CN)C1 Amb10607591 [0,1,0,1,0,0|2,0,0]=4 4463 B11R1.266 CC(=O)N1CCCC(CN)C1 Amb8503349 [0,1,0,1,0,0|2,0,0]=4 4464 B11R1.266 CC(=O)N1CCCC(CO)C1 Amb33531964 [0,1,0,1,0,0|2,0,0]=4 4465 B11R1.266 CCC1C=C(C(C)=O)CCC1 Amb28131958 [0,1,0,1,0,0|1,0,1]=4 4466 B11R1.266 CCC1C=CCC(C(=O)O)C1 Amb27845448 [0,1,0,1,0,0|0,0,2]=4 4467 B11R1.266 CCC1CC(C(=O)O)CCN1 Amb18199986 [0,1,0,1,0,0|1,0,0]=3 4468 B11R1.266 CCC1CC(C(=O)O)CCO1 Amb25679263 [0,1,0,1,0,0|1,0,0]=3 4469 B11R1.266 CCC1CC(C(N)=O)CCO1 Amb28398882 [0,1,0,1,0,0|2,0,0]=4 4470 B11R1.266 CCC1CCCC(B(O)O)C1 Amb27453465 [0,1,0,1,0,0|1,0,1]=4 4471 B11R1.266 CCC1CCCC(C(=O)O)N1 Amb25110486 [0,1,0,1,0,0|0,0,0]=2 4472 B11R1.266 CCC1CCCC([C@H](C)O)C1 Amb27403838 [0,1,0,1,0,0|1,0,1]=4 4473 B11R1.266 CCC1CCNC(C(=O)O)C1 Amb18830613 [0,1,0,1,0,0|1,0,0]=3 4474 B11R1.266 CCC1CCNC(C(=O)O)C1 Amb33338905 [0,1,0,1,0,0|1,0,0]=3 4475 B11R1.266 CCC1CCNC(C(=O)O)O1 Amb33193374 [0,1,0,1,0,0|1,0,0]=3 4476 B11R1.266 CCC1CNCC(C(=O)O)C1 Amb33275578 [0,1,0,1,0,0|1,0,0]=3 4477 B11R1.266 CCC1NC(C(=O)O)CCS1 Amb18950378 [0,1,0,1,0,0|1,0,0]=3 4478 B11R1.266 CCC1NC(C(=O)O)CCS1 Amb32990136 [0,1,0,1,0,0|1,0,0]=3 4479 B11R1.266 CCN1CCCC(B(O)O)C1 Amb27872949 [0,1,0,1,0,0|1,0,1]=4 4480 B11R1.266 CCN1CCCC(C(=O)O)C1 Amb10609659 [0,1,0,1,0,0|0,0,0]=2 4481 B11R1.266 CCN1CCCC(C(=O)O)C1 Amb9238837 [0,1,0,1,0,0|0,0,0]=2 4482 B11R1.266 CCN1CCNC(C(=O)O)C1 Amb26946426 [0,1,0,1,0,0|1,0,0]=3 4483 B11R1.266 CCN1CCOC(C(=O)Cl)C1 Amb24753216 [0,1,0,1,0,0|2,0,0]=4 4484 B11R1.266 CCN1CCOC(C(=O)O)C1 Amb19148863 [0,1,0,1,0,0|1,0,0]=3 4485 B11R1.266 CCN1CCOC(C(C)=O)C1 Amb27592628 [0,1,0,1,0,0|2,0,0]=4 4486 B11R1.266 CCN1CCOC(C(N)=O)C1 Amb27472938 [0,1,0,1,0,0|2,0,0]=4 4487 B11R1.266 CCN1CCSC(C(=O)O)C1 Amb29891909 [0,1,0,1,0,0|1,0,0]=3 4488 B11R1.266 CC[C@@H]1CCC[C@@H]([C@@H](C)O)O1 Amb27420638 [0,1,0,1,0,0|1,0,1]=4 4489 B11R1.266 CC[C@@H]1CCC[C@@H]([C@H](C)O)O1 Amb27420600 [0,1,0,1,0,0|1,0,1]=4 4490 B11R1.266 CC[C@@H]1CCC[C@H](C(=O)O)O1 Amb27233410 [0,1,0,1,0,0|0,0,0]=2 4491 B11R1.266 CC[C@@H]1CCN[C@H](C(=O)O)C1 Amb27421998 [0,1,0,1,0,0|1,0,0]=3 4492 B11R1.266 CC[C@@H]1CSC[C@@H](C(=O)O)N1 Amb27965031 [0,1,0,1,0,0|1,0,0]=3 4493 B11R1.266 CC[C@H]1CCN[C@@H](C(=O)O)C1 Amb25937982 [0,1,0,1,0,0|1,0,0]=3 4494 B11R1.266 CC[C@H]1CCN[C@@H](C(=O)O)C1 Amb33338984 [0,1,0,1,0,0|1,0,0]=3 4495 B11R1.266 CC[C@H]1CSC[C@@H](C(=O)O)N1 Amb27781560 [0,1,0,1,0,0|1,0,0]=3 4496 B11R1.266 CNC1CCCC(C(C)=O)C1 Amb25802837 [0,1,0,1,0,0|1,0,0]=3 4497 B11R1.266 CNC1CCCN(C(C)=O)C1 Amb18947688 [0,1,0,1,0,0|2,0,0]=4 4498 B11R1.266 CNC1CCOC(C(=O)O)C1 Amb27419779 [0,1,0,1,0,0|1,0,0]=3 4499 B11R1.266 CN[C@@H]1CCCN(C(C)=O)C1 Amb22227498 [0,1,0,1,0,0|2,0,0]=4 4500 B11R1.266 CN[C@H]1CCCN(C(C)=O)C1 Amb22227534 [0,1,0,1,0,0|2,0,0]=4 4501 B11R1.266 COC1=CCCC(C(=O)O)C1 Amb28244804 [0,1,0,1,0,0|0,0,2]=4 4502 B11R1.266 COC1=NCCC(C(=O)O)C1 Amb32668294 [0,1,0,1,0,0|1,0,1]=4 4503 B11R1.266 COC1CCCC(C(=N)N)C1 Amb27801477 [0,1,0,1,0,0|2,0,0]=4 4504 B11R1.266 COC1CCCC(C(=O)Cl)C1 Amb2689121 [0,1,0,1,0,0|1,0,0]=3 4505 B11R1.266 COC1CCCC(C(=O)O)C1 Amb3939936 [0,1,0,1,0,0|0,0,0]=2 4506 B11R1.266 COC1CCCC(C(=O)O)O1 Amb27483979 [0,1,0,1,0,0|1,0,0]=3 4507 B11R1.266 COC1CCCC(C(C)=O)C1 Amb28139124 [0,1,0,1,0,0|1,0,0]=3 4508 B11R1.266 COC1CCCC(C(C)O)C1 Amb27590755 [0,1,0,1,0,0|1,0,1]=4 4509 B11R1.266 COC1CCCC(C(N)=S)C1 Amb27617394 [0,1,0,1,0,0|1,1,0]=4 4510 B11R1.266 COC1CCCN(C(=O)Cl)C1 Amb33296704 [0,1,0,1,0,0|2,0,0]=4 4511 B11R1.266 COC1CCCN(C(C)=O)C1 Amb24181776 [0,1,0,1,0,0|2,0,0]=4 4512 B11R1.266 COC1CCCN(C(N)=O)C1 Amb28430331 [0,1,0,1,0,0|2,0,0]=4 4513 B11R1.266 COC1CCNC(C(N)=O)C1 Amb28284793 [0,1,0,1,0,0|2,0,0]=4 4514 B11R1.266 COC1CNCC(C(=O)O)C1 Amb28050836 [0,1,0,1,0,0|1,0,0]=3 4515 B11R1.266 CO[C@@H]1CCC[C@@H](C(N)=O)C1 Amb27489103 [0,1,0,1,0,0|1,0,0]=3 4516 B11R1.266 CO[C@H]1CCC[C@@H](C(=O)O)C1 Amb28411305 [0,1,0,1,0,0|0,0,0]=2 4517 B11R1.266 CO[C@H]1CCC[C@@H](C(N)=O)C1 Amb28051977 [0,1,0,1,0,0|1,0,0]=3 4518 B11R1.266 CO[C@H]1CCN[C@@H](C(=O)O)C1 Amb27984982 [0,1,0,1,0,0|1,0,0]=3 4519 B11R1.266 CSC1CCCC(C(=O)O)C1 Amb28322463 [0,1,0,1,0,0|0,0,0]=2 4520 B11R1.266 N#CN1CCCC(C(=O)O)C1 Amb30031704 [0,1,0,1,0,0|1,0,1]=4 4521 B11R1.266 N#CN1CCC[C@@H](C(=O)O)C1 Amb30031697 [0,1,0,1,0,0|1,0,1]=4 4522 B11R1.266 N#CN1CCC[C@H](C(=O)O)C1 Amb30031698 [0,1,0,1,0,0|1,0,1]=4 4523 B11R1.266 N=C(N)C1CCCC(CO)C1 Amb27843632 [0,1,0,1,0,0|2,0,0]=4 4524 B11R1.266 NCC1CCCC(C(=O)O)C1 Amb25684748 [0,1,0,1,0,0|0,0,0]=2 4525 B11R1.266 NCC1CCCC(C(=O)O)C1 Amb27777100 [0,1,0,1,0,0|0,0,0]=2 4526 B11R1.266 NCC1CCCN(C(N)=O)C1 Amb18946249 [0,1,0,1,0,0|2,0,0]=4 4527 B11R1.266 NCC1CCCN(C(N)=O)C1 Amb28974068 [0,1,0,1,0,0|2,0,0]=4 4528 B11R1.266 NCC1CNCC(C(=O)O)C1 Amb27984747 [0,1,0,1,0,0|1,0,0]=3 4529 B11R1.266 O=C(Cl)N1CCCC(CO)C1 Amb27974621 [0,1,0,1,0,0|2,0,0]=4 4530 B11R1.266 O=C(O)C1CCCC(CF)C1 Amb27958907 [0,1,0,1,0,0|0,0,0]=2 4531 B11R1.266 O=C(O)C1CCCC(CO)C1 Amb24488127 [0,1,0,1,0,0|0,0,0]=2 4532 B11R1.266 O=C(O)C1CCC\C(=N/O)C1 Amb23453123 [0,1,0,1,0,0|1,0,1]=4 4533 B11R1.266 O=C(O)C1CN(CF)CCN1 Amb27463603 [0,1,0,1,0,0|2,0,0]=4 4534 B11R1.266 O=C(O)C1CNCC(CO)C1 Amb28240330 [0,1,0,1,0,0|1,0,0]=3 4535 B11R1.266 O=C(O)[C@@H]1CCC[C@H](CF)C1 Amb35789416 [0,1,0,1,0,0|0,0,0]=2 4536 B11R1.266 O=C(O)[C@H]1CCC[C@@H](CO)N1 Amb25348501 [0,1,0,1,0,0|1,0,0]=3 4537 B11R1.266 O=C(O)[C@H]1CNC[C@@H](CO)C1 Amb27240274 [0,1,0,1,0,0|1,0,0]=3 4538 B11R1.266 O=NN1CCCC(C(=O)O)C1 Amb17618600 [0,1,0,1,0,0|2,0,0]=4 4539 B11R1.339 CCCC1=CC(=O)C1CCC Amb27672325 [0,1,0,1,0,0|1,0,0]=3 4540 B11R1.339 CCCC1C(=O)CC1OCC Amb27271728 [0,1,0,1,0,0|1,0,0]=3 4541 B11R1.339 CCCC1NC(=O)C1CCC Amb27673659 [0,1,0,1,0,0|1,0,0]=3 4542 B11R1.339 CCC[C@@H]1C(=O)C[C@H]1OCC Amb27672555 [0,1,0,1,0,0|1,0,0]=3 4543 B11R1.339 CCC[C@H]1C(=O)C[C@H]1OCC Amb27672556 [0,1,0,1,0,0|1,0,0]=3 4544 B11R1.339 CCO[C@@H]1CC(=O)[C@@H]1OCC Amb27673708 [0,1,0,1,0,0|2,0,0]=4 4545 B11R1.565 CC(=O)C1CCCC(C)CC1 Amb27459498 [0,1,0,1,0,0|1,0,0]=3 4546 B11R1.565 CC(=O)N1CCCC(C)CC1 Amb28320152 [0,1,0,1,0,0|2,0,0]=4 4547 B11R1.565 CC(=O)N1CCCC(O)CC1 Amb13783682 [0,1,0,1,0,0|2,0,0]=4 4548 B11R1.565 CC(=O)[C@H]1CCC[C@H](C)CC1 Amb28054029 [0,1,0,1,0,0|1,0,0]=3 4549 B11R1.565 CC1CCCC(C(=O)O)CC1 Amb24487583 [0,1,0,1,0,0|0,0,0]=2 4550 B11R1.565 CC1CCCC([N+](=O)[O-])CC1 Amb33299052 [0,1,0,1,0,0|1,0,1]=4 4551 B11R1.565 CC1CCCN(C(N)=O)CC1 Amb27859795 [0,1,0,1,0,0|2,0,0]=4 4552 B11R1.565 CC1CCNC(C(=O)O)CC1 Amb27441897 [0,1,0,1,0,0|1,0,0]=3 4553 B11R1.565 CC1CCNC(C(N)=O)CC1 Amb27962650 [0,1,0,1,0,0|2,0,0]=4 4554 B11R1.565 CN1CCCC(C(=O)O)CC1 Amb18199975 [0,1,0,1,0,0|0,0,0]=2 4555 B11R1.565 CN1CCCN(C(=O)Cl)CC1 Amb24538203 [0,1,0,1,0,0|2,0,0]=4 4556 B11R1.565 CN1CCCN(C(N)=O)CC1 Amb6740888 [0,1,0,1,0,0|2,0,0]=4 4557 B11R1.565 CN1CCNC(C(=O)O)CC1 Amb27246780 [0,1,0,1,0,0|1,0,0]=3 4558 B11R1.565 CN1CCNC(C(N)=O)CC1 Amb27636667 [0,1,0,1,0,0|2,0,0]=4 4559 B11R1.565 NC(=O)N1CCCC(N)CC1 Amb27660218 [0,1,0,1,0,0|2,0,0]=4 4560 B11R1.565 NC1CCCC(C(=O)O)CC1 Amb33743493 [0,1,0,1,0,0|0,0,0]=2 4561 B11R1.565 NC1CCCC(C(=O)O)CC1 Amb33743673 [0,1,0,1,0,0|0,0,0]=2 4562 B11R1.565 O=C1CCC(C(=O)O)CCN1 Amb24488196 [0,1,0,1,0,0|1,0,1]=4 4563 B11R1.565 O=C1CCC(C(=O)O)CCO1 Amb22001721 [0,1,0,1,0,0|1,0,1]=4 4564 B11R1.565 O=C1CCCC(C(=O)O)CC1 Amb23399610 [0,1,0,1,0,0|0,0,1]=3 4565 B11R1.706 CC(=O)C1=CCCCCCC1 Amb27473365 [0,1,0,1,0,0|1,0,1]=4 4566 B11R1.706 CC(=O)C1C=CCCCCC1 Amb22011813 [0,1,0,1,0,0|1,0,1]=4 4567 B11R1.706 CC(=O)C1CCCCCCC1 Amb25327542 [0,1,0,1,0,0|1,0,0]=3 4568 B11R1.706 O=C(Cl)C1CCC=CCCC1 Amb24465111 [0,1,0,1,0,0|1,0,1]=4 4569 B11R1.706 O=C(Cl)C1CCCCCCC1 Amb25760237 [0,1,0,1,0,0|1,0,0]=3 4570 B11R1.706 O=C(O)C1C=CCCCCC1 Amb27401809 [0,1,0,1,0,0|0,0,1]=3 4571 B11R1.706 O=C(O)C1CCC=CCCC1 Amb26853121 [0,1,0,1,0,0|0,0,1]=3 4572 B11R1.706 O=C(O)C1CCCCCCC1 Amb18278612 [0,1,0,1,0,0|0,0,0]=2 4573 B11R1.706 O=C(O)C1CCCCCCN1 Amb27760420 [0,1,0,1,0,0|0,0,0]=2 4574 B11R1.706 O=C(O)C1CCCCCCN1 Amb28652940 [0,1,0,1,0,0|0,0,0]=2 4575 B11R1.706 O=C(O)C1CCCSCCC1 Amb28239756 [0,1,0,1,0,0|0,0,0]=2 4576 B11R1.706 O=[N+]([O-])C1CCCCCCC1 Amb33299000 [0,1,0,1,0,0|1,0,1]=4 4577 B11R1.706 OC(O)C1CCCCCCC1 Amb28065889 [0,1,0,1,0,0|0,0,2]=4 4578 B11R1.841 CCCCC1C(=O)NC1CC Amb27673663 [0,1,0,1,0,0|1,0,0]=3 4579 B11R1.841 CC[C@@H]1NC(=O)[C@H]1CCOC Amb27989677 [0,1,0,1,0,0|1,0,0]=3 4580 B11R1.905 C#CCNC1(C(=O)O)CCC1 Amb18989721 [0,1,0,1,0,0|0,0,2]=4 4581 B11R1.905 C=CCCC1(C(=O)O)CCC1 Amb27670917 [0,1,0,1,0,0|0,0,1]=3 4582 B11R1.905 CCCCC1(C(=O)Cl)CCC1 Amb25383048 [0,1,0,1,0,0|1,0,0]=3 4583 B11R1.905 CCCCC1(C(=O)O)CCC1 Amb26069896 [0,1,0,1,0,0|0,0,0]=2 4584 B11R1.905 CCCNC1(C(=O)O)COC1 Amb27491917 [0,1,0,1,0,0|1,0,0]=3 4585 B11R1.905 CCCNC1(C(=O)O)CSC1 Amb28079805 [0,1,0,1,0,0|1,0,0]=3 4586 B11R1.905 CCCNC1(C(N)=O)CNC1 Amb27271317 [0,1,0,1,0,0|2,0,0]=4 4587 B11R1.905 CCCNC1(C(N)=O)COC1 Amb27491920 [0,1,0,1,0,0|2,0,0]=4 4588 B11R1.905 CCCNC1(C(N)=O)CSC1 Amb28079774 [0,1,0,1,0,0|2,0,0]=4 4589 B11R1.905 CCCOC1(C(=O)O)CCC1 Amb27271172 [0,1,0,1,0,0|0,0,0]=2 4590 B11R1.905 CCCOC1(C(=O)O)CNC1 Amb32939510 [0,1,0,1,0,0|1,0,0]=3 4591 B11R1.905 CCCOC1(C(=O)O)COC1 Amb32939507 [0,1,0,1,0,0|1,0,0]=3 4592 B11R1.905 CCCSC1(C(=O)O)CCC1 Amb27987054 [0,1,0,1,0,0|0,0,0]=2 4593 B11R1.905 CCOCC1(C(=O)O)CCC1 Amb23556103 [0,1,0,1,0,0|0,0,0]=2 4594 B11R1.905 CCSCC1(C(=O)O)CCC1 Amb33224191 [0,1,0,1,0,0|0,0,0]=2 4595 B11R1.905 CC\C=C\C1(C(=O)O)CCC1 Amb33268714 [0,1,0,1,0,0|0,0,1]=3 4596 B11R1.905 COCCC1(C(=O)O)CCC1 Amb20669213 [0,1,0,1,0,0|0,0,0]=2 4597 B11R1.905 COCCC1(C(=O)O)CNC1 Amb24764470 [0,1,0,1,0,0|1,0,0]=3 4598 B11R1.905 COCCC1(C(N)=O)CCC1 Amb27987447 [0,1,0,1,0,0|1,0,0]=3 4599 B11R1.905 CSCCC1(C(=O)O)CCC1 Amb27271788 [0,1,0,1,0,0|0,0,0]=2 4600 B11R1.905 C\C=C\CC1(C(=O)O)CCC1 Amb28075426 [0,1,0,1,0,0|0,0,1]=3 4601 B11R1.905 N#CCCC1(C(=O)O)CCC1 Amb29865113 [0,1,0,1,0,0|0,0,1]=3 4602 B11R1.905 N#CCCC1(C(=O)O)CNC1 Amb30016033 [0,1,0,1,0,0|1,0,1]=4 4603 B11R1.905 N#CNCC1(C(=O)O)CCC1 Amb30031699 [0,1,0,1,0,0|1,0,1]=4 4604 B11R1.905 NC(=O)C1(OCCO)CCC1 Amb31156073 [0,1,0,1,0,0|2,0,0]=4 4605 B11R1.905 O=C(O)C1(CCCF)CCC1 Amb27986331 [0,1,0,1,0,0|0,0,0]=2 4606 B11R1.905 O=C(O)C1(CCCO)CCC1 Amb27670916 [0,1,0,1,0,0|0,0,0]=2 4607 B11R1.905 O=C(O)C1(NCCO)CCC1 Amb24762077 [0,1,0,1,0,0|1,0,0]=3 4608 B11R1.905 O=C(O)C1(OCCCl)CCC1 Amb27271174 [0,1,0,1,0,0|1,0,0]=3 4609 B11R1.905 O=C(O)C1(OCCO)CCC1 Amb27271173 [0,1,0,1,0,0|1,0,0]=3 4610 B11R1.905 O=CNCC1(C(=O)O)CCC1 Amb27408249 [0,1,0,1,0,0|1,0,1]=4 4611 B11R1.1239 C#CCC1(C(=O)O)CCCC1 Amb25893086 [0,1,0,1,0,0|0,0,2]=4 4612 B11R1.1239 C#CCC1(C(=O)O)CCCN1 Amb28079501 [0,1,0,1,0,0|0,0,2]=4 4613 B11R1.1239 C#CCC1(C(=O)O)CCCN1 Amb33482889 [0,1,0,1,0,0|0,0,2]=4 4614 B11R1.1239 C#CCC1(C(=O)O)CCCO1 Amb25031452 [0,1,0,1,0,0|0,0,2]=4 4615 B11R1.1239 C#CCC1(C(=O)O)CCNC1 Amb24407717 [0,1,0,1,0,0|0,0,2]=4 4616 B11R1.1239 C#CCC1(C(=O)O)CCNC1 Amb33483969 [0,1,0,1,0,0|0,0,2]=4 4617 B11R1.1239 C#CCC1(C(=O)O)CCOC1 Amb28206536 [0,1,0,1,0,0|0,0,2]=4 4618 B11R1.1239 C#CC[C@@]1(C(=O)O)CCCN1 Amb30626098 [0,1,0,1,0,0|0,0,2]=4 4619 B11R1.1239 C#CC[C@]1(C(=O)O)CCCN1 Amb30626099 [0,1,0,1,0,0|0,0,2]=4 4620 B11R1.1239 C=C(C)C1(CCC)CCCN1 Amb27490451 [0,1,0,1,0,0|2,0,0]=4 4621 B11R1.1239 C=CCC1(C(=O)O)CCCC1 Amb25975378 [0,1,0,1,0,0|0,0,2]=4 4622 B11R1.1239 C=CCC1(C(=O)O)CCCN1 Amb18644733 [0,1,0,1,0,0|0,0,2]=4 4623 B11R1.1239 C=CCC1(C(=O)O)CCCN1 Amb34890910 [0,1,0,1,0,0|0,0,2]=4 4624 B11R1.1239 C=CCC1(C(=O)O)CCNC1 Amb25681790 [0,1,0,1,0,0|0,0,2]=4 4625 B11R1.1239 C=CC[C@]1(C(=O)O)CCCN1 Amb22338881 [0,1,0,1,0,0|0,0,2]=4 4626 B11R1.1239 C=CC[C@]1(C(=O)O)CCCN1 Amb24079124 [0,1,0,1,0,0|0,0,2]=4 4627 B11R1.1239 CCCC1(C(=O)O)CCCC1 Amb18300462 [0,1,0,1,0,0|0,0,0]=2 4628 B11R1.1239 CCCC1(C(=O)O)CCCN1 Amb15701583 [0,1,0,1,0,0|0,0,0]=2 4629 B11R1.1239 CCCC1(C(=O)O)CCCN1 Amb21960058 [0,1,0,1,0,0|0,0,0]=2 4630 B11R1.1239 CCCC1(C(=O)O)CCCO1 Amb28249501 [0,1,0,1,0,0|0,0,0]=2 4631 B11R1.1239 CCCC1(C(=O)O)CCCS1 Amb27473087 [0,1,0,1,0,0|0,0,0]=2 4632 B11R1.1239 CCCC1(C(C)=O)CCCN1 Amb26607478 [0,1,0,1,0,0|1,0,0]=3 4633 B11R1.1239 CCCC1(C(C)=O)CCNC1 Amb25836666 [0,1,0,1,0,0|1,0,0]=3 4634 B11R1.1239 CCCC1(C(C)=O)OCCO1 Amb24533061 [0,1,0,1,0,0|2,0,0]=4 4635 B11R1.1239 CCCC1(C(C)=O)OCCS1 Amb27836806 [0,1,0,1,0,0|2,0,0]=4 4636 B11R1.1239 CCCC1(C(C)O)CCCN1 Amb35740546 [0,1,0,1,0,0|1,0,1]=4 4637 B11R1.1239 CCCC1(C(C)O)CCNC1 Amb35583111 [0,1,0,1,0,0|1,0,1]=4 4638 B11R1.1239 CCC[C@@]1(C(=O)O)CCCN1 Amb25824609 [0,1,0,1,0,0|0,0,0]=2 4639 B11R1.1239 CCC[C@]1(C(=O)O)CCCN1 Amb28125924 [0,1,0,1,0,0|0,0,0]=2 4640 B11R1.1239 CCNC1(C(N)=O)CCNC1 Amb27658859 [0,1,0,1,0,0|2,0,0]=4 4641 B11R1.1239 CCNC1(C(N)=O)CCOC1 Amb27433134 [0,1,0,1,0,0|2,0,0]=4 4642 B11R1.1239 CCOC1(C(=O)Cl)CCCC1 Amb27483041 [0,1,0,1,0,0|2,0,0]=4 4643 B11R1.1239 CCOC1(C(=O)O)CCCC1 Amb18976726 [0,1,0,1,0,0|1,0,0]=3 4644 B11R1.1239 CCOC1(C(=O)O)CCNC1 Amb27813606 [0,1,0,1,0,0|1,0,0]=3 4645 B11R1.1239 CCOC1(C(=O)O)CCOC1 Amb24549159 [0,1,0,1,0,0|1,0,0]=3 4646 B11R1.1239 CCOC1(C(C)=O)CCOC1 Amb28317960 [0,1,0,1,0,0|2,0,0]=4 4647 B11R1.1239 CCSC1(C(=O)O)CC=CC1 Amb25972846 [0,1,0,1,0,0|1,0,1]=4 4648 B11R1.1239 CCSC1(C(=O)O)CCOC1 Amb32863049 [0,1,0,1,0,0|1,0,0]=3 4649 B11R1.1239 CNCC1(C(=O)O)CCOC1 Amb28133018 [0,1,0,1,0,0|1,0,0]=3 4650 B11R1.1239 CNCC1(C(N)=O)CCCC1 Amb27771974 [0,1,0,1,0,0|2,0,0]=4 4651 B11R1.1239 COCC1(C(=O)O)C=CCC1 Amb33328779 [0,1,0,1,0,0|1,0,1]=4 4652 B11R1.1239 COCC1(C(=O)O)CC=CC1 Amb33178681 [0,1,0,1,0,0|1,0,1]=4 4653 B11R1.1239 COCC1(C(=O)O)CCCC1 Amb17570028 [0,1,0,1,0,0|1,0,0]=3 4654 B11R1.1239 COCC1(C(=O)O)CCCN1 Amb25065716 [0,1,0,1,0,0|1,0,0]=3 4655 B11R1.1239 COCC1(C(=O)O)CCCN1 Amb33552544 [0,1,0,1,0,0|1,0,0]=3 4656 B11R1.1239 COCC1(C(=O)O)CCCO1 Amb27830689 [0,1,0,1,0,0|1,0,0]=3 4657 B11R1.1239 COCC1(C(=O)O)CCCS1 Amb27946450 [0,1,0,1,0,0|1,0,0]=3 4658 B11R1.1239 COCC1(C(=O)O)CCNC1 Amb25317854 [0,1,0,1,0,0|1,0,0]=3 4659 B11R1.1239 COCC1(C(=O)O)CCNC1 Amb32664730 [0,1,0,1,0,0|1,0,0]=3 4660 B11R1.1239 COCC1(C(=O)O)CCOC1 Amb26542619 [0,1,0,1,0,0|1,0,0]=3 4661 B11R1.1239 COCC1(C(C)=O)CCCN1 Amb33131625 [0,1,0,1,0,0|2,0,0]=4 4662 B11R1.1239 COCC1(C(N)=O)CCCC1 Amb9902166 [0,1,0,1,0,0|2,0,0]=4 4663 B11R1.1239 COCC1(C(N)=O)CCCN1 Amb28182505 [0,1,0,1,0,0|2,0,0]=4 4664 B11R1.1239 COCC1(C(N)=O)CCCN1 Amb32666728 [0,1,0,1,0,0|2,0,0]=4 4665 B11R1.1239 COC[C@@]1(C(N)=O)CCCN1 Amb28048900 [0,1,0,1,0,0|2,0,0]=4 4666 B11R1.1239 CSCC1(C(=O)O)CCCC1 Amb29868646 [0,1,0,1,0,0|1,0,0]=3 4667 B11R1.1239 N#CCC1(C(=O)O)CCCC1 Amb25685223 [0,1,0,1,0,0|1,0,1]=4 4668 B11R1.1239 N#CCC1(C(=O)O)CCCN1 Amb35708351 [0,1,0,1,0,0|1,0,1]=4 4669 B11R1.1239 N#CCC1(C(=O)O)CCCO1 Amb35719222 [0,1,0,1,0,0|1,0,1]=4 4670 B11R1.1239 N#CCC1(C(=O)O)CCNC1 Amb35708352 [0,1,0,1,0,0|1,0,1]=4 4671 B11R1.1239 N#CCC1(C(=O)O)CCOC1 Amb35708353 [0,1,0,1,0,0|1,0,1]=4 4672 B11R1.1239 NCCC1(C(=O)O)CCCC1 Amb32938539 [0,1,0,1,0,0|1,0,0]=3 4673 B11R1.1239 O=C(O)C1(CCCl)CCCC1 Amb27946449 [0,1,0,1,0,0|1,0,0]=3 4674 B11R1.1239 O=C(O)C1(CCCl)CCOC1 Amb24543900 [0,1,0,1,0,0|1,0,0]=3 4675 B11R1.1239 O=C(O)C1(CCF)CC=CC1 Amb29857983 [0,1,0,1,0,0|1,0,1]=4 4676 B11R1.1239 O=C(O)C1(CCF)CCCC1 Amb25890868 [0,1,0,1,0,0|1,0,0]=3 4677 B11R1.1239 O=C(O)C1(CCO)CC=CC1 Amb35733629 [0,1,0,1,0,0|1,0,1]=4 4678 B11R1.1239 O=C(O)C1(CCO)CCCC1 Amb27590952 [0,1,0,1,0,0|1,0,0]=3 4679 B11R1.1239 O=C(O)C1(CCO)CCNC1 Amb2696580 [0,1,0,1,0,0|1,0,0]=3 4680 B11R1.1239 O=C(O)C1(CCO)CCOC1 Amb28365351 [0,1,0,1,0,0|1,0,0]=3 4681 B11R1.1239 O=C(O)C1(CCO)CCSC1 Amb32946252 [0,1,0,1,0,0|1,0,0]=3 4682 B11R1.421 C=C(C)C1(O)CCCC1CC Amb28182566 [0,1,0,1,0,0|2,0,0]=4 4683 B11R1.421 CC1(C(=O)O)CCCC1CN Amb28121250 [0,1,0,1,0,0|1,0,0]=3 4684 B11R1.421 CC1(C(=O)O)CNCC1CO Amb2696582 [0,1,0,1,0,0|2,0,0]=4 4685 B11R1.421 CCC1CCCC1(C)C(=O)O Amb32654895 [0,1,0,1,0,0|0,0,0]=2 4686 B11R1.421 CCC1CCCC1(N)C(=O)O Amb27823632 [0,1,0,1,0,0|0,0,0]=2 4687 B11R1.421 CCC1CCCC1(N)C(N)=O Amb27395574 [0,1,0,1,0,0|1,0,0]=3 4688 B11R1.421 CCC1CNCC1(C)C(=O)O Amb2696678 [0,1,0,1,0,0|1,0,0]=3 4689 B11R1.421 CCC1CNCC1(F)C(=O)O Amb27855308 [0,1,0,1,0,0|1,0,0]=3 4690 B11R1.421 CCC1COCC1(N)C(=O)O Amb35646986 [0,1,0,1,0,0|1,0,0]=3 4691 B11R1.421 CCC1COCC1(N)C(N)=O Amb35616334 [0,1,0,1,0,0|2,0,0]=4 4692 B11R1.421 CCC1COCC1(O)C(=O)O Amb35632036 [0,1,0,1,0,0|1,0,0]=3 4693 B11R1.421 CCC1COCC1(O)C(N)=O Amb35632034 [0,1,0,1,0,0|2,0,0]=4 4694 B11R1.421 CCN1CCCC1(O)C(=O)O Amb27490977 [0,1,0,1,0,0|1,0,0]=3 4695 B11R1.421 CCN1CCC[C@@]1(C)C(=O)O Amb27163575 [0,1,0,1,0,0|1,0,0]=3 4696 B11R1.421 CC[C@@H]1CCC[C@]1(N)C(=O)O Amb25295379 [0,1,0,1,0,0|0,0,0]=2 4697 B11R1.421 CC[C@H]1CCC[C@@]1(C)C(C)=O Amb27437090 [0,1,0,1,0,0|1,0,0]=3 4698 B11R1.421 CC[C@H]1CCC[C@@]1(N)C(N)=O Amb27433439 [0,1,0,1,0,0|1,0,0]=3 4699 B11R1.421 COC1CCCC1(N)C(=O)O Amb26054799 [0,1,0,1,0,0|1,0,0]=3 4700 B11R1.421 COC1CCCC1(N)C(N)=O Amb27203913 [0,1,0,1,0,0|2,0,0]=4 4701 B11R1.421 COC1CCC[C@@]1(N)C(=O)O Amb27791756 [0,1,0,1,0,0|1,0,0]=3 4702 B11R1.421 CO[C@H]1CCC[C@@]1(C)C(=O)O Amb27232824 [0,1,0,1,0,0|1,0,0]=3 4703 B11R1.421 C[C@@]1(C(=O)O)CCC[C@H]1CN Amb27865504 [0,1,0,1,0,0|1,0,0]=3 4704 B11R1.421 C[C@]1(C(=O)O)CCC[C@H]1CCl Amb27847582 [0,1,0,1,0,0|1,0,0]=3 4705 B11R1.421 O=C(O)C1(Cl)CCCC1CCl Amb18130208 [0,1,0,1,0,0|1,0,0]=3 4706 B11R1.478 CCCC1(O)C(O)CC1CC Amb27756484 [0,1,0,1,0,0|1,0,1]=4 4707 B11R1.487 CC1CC(N)(C(N)=O)CN1C Amb28058258 [0,1,0,1,0,0|2,0,0]=4 4708 B11R1.487 CC1CC(O)(C(=O)O)CN1C Amb27883387 [0,1,0,1,0,0|1,0,0]=3 4709 B11R1.487 C[C@@H]1O[C@@](C)(C(=O)O)O[C@@H]1C Amb27823731 [0,1,0,1,0,0|2,0,0]=4 4710 B11R1.487 C[C@@H]1O[C@](C)(C(=O)O)O[C@@H]1C Amb27660839 [0,1,0,1,0,0|2,0,0]=4 4711 B11R1.487 C[C@H]1OC(C)(C(=O)O)O[C@@H]1C Amb28193748 [0,1,0,1,0,0|2,0,0]=4 4712 B11R1.487 NC1(C(=O)O)CC(O)C(O)C1 Amb28435165 [0,1,0,1,0,0|2,0,0]=4 4713 B11R1.487 NC1(C(=O)O)C[C@H](O)[C@H](O)C1 Amb27831420 [0,1,0,1,0,0|2,0,0]=4 4714 B11R1.667 CC(=O)C1(C)CCCC(C)C1 Amb27861382 [0,1,0,1,0,0|1,0,0]=3 4715 B11R1.667 CC(=O)C1(N)CCCC(C)C1 Amb25369024 [0,1,0,1,0,0|1,0,0]=3 4716 B11R1.667 CC(=O)[C@]1(C)CCC[C@@H](C)C1 Amb28411243 [0,1,0,1,0,0|1,0,0]=3 4717 B11R1.667 CC1(C(=O)Cl)CCCC(Cl)C1 Amb26600011 [0,1,0,1,0,0|2,0,0]=4 4718 B11R1.667 CC1(C(=O)O)CC(N)CCO1 Amb32675435 [0,1,0,1,0,0|2,0,0]=4 4719 B11R1.667 CC1(C(=O)O)CC(N)CCO1 Amb32682437 [0,1,0,1,0,0|2,0,0]=4 4720 B11R1.667 CC1(C(=O)O)CCCC(Cl)C1 Amb18127807 [0,1,0,1,0,0|1,0,0]=3 4721 B11R1.667 CC1(C(=O)O)CCCC(F)C1 Amb27429155 [0,1,0,1,0,0|1,0,0]=3 4722 B11R1.667 CC1=CCCC(C)(C(=O)O)C1 Amb18125780 [0,1,0,1,0,0|0,0,2]=4 4723 B11R1.667 CC1CC(C)(C(=O)O)CCO1 Amb32654883 [0,1,0,1,0,0|1,0,0]=3 4724 B11R1.667 CC1CC(Cl)(C(=O)Cl)CCO1 Amb33128015 [0,1,0,1,0,0|2,0,0]=4 4725 B11R1.667 CC1CC(Cl)(C(=O)O)CCO1 Amb33127970 [0,1,0,1,0,0|1,0,0]=3 4726 B11R1.667 CC1CC(N)(C(=O)O)CCO1 Amb26893175 [0,1,0,1,0,0|1,0,0]=3 4727 B11R1.667 CC1CC(N)(C(=O)O)CCO1 Amb30584653 [0,1,0,1,0,0|1,0,0]=3 4728 B11R1.667 CC1CC(N)(C(N)=O)CCN1 Amb29861116 [0,1,0,1,0,0|2,0,0]=4 4729 B11R1.667 CC1CC(O)(C(=O)O)CCO1 Amb25744122 [0,1,0,1,0,0|1,0,0]=3 4730 B11R1.667 CC1CCCC(Br)([N+](=O)[O-])C1 Amb33298991 [0,1,0,1,0,0|1,0,1]=4 4731 B11R1.667 CC1CCCC(C)(C(=O)Cl)C1 Amb25758662 [0,1,0,1,0,0|1,0,0]=3 4732 B11R1.667 CC1CCCC(C)(C(=O)O)C1 Amb25892566 [0,1,0,1,0,0|0,0,0]=2 4733 B11R1.667 CC1CCCC(Cl)(C(=O)Cl)C1 Amb33128000 [0,1,0,1,0,0|1,0,0]=3 4734 B11R1.667 CC1CCCC(Cl)(C(=O)O)C1 Amb33127952 [0,1,0,1,0,0|0,0,0]=2 4735 B11R1.667 CC1CCCC(N)(C(=O)O)C1 Amb2695467 [0,1,0,1,0,0|0,0,0]=2 4736 B11R1.667 CC1CCCC(N)(C(C)O)C1 Amb35587326 [0,1,0,1,0,0|1,0,1]=4 4737 B11R1.667 CC1CCCC(O)(C(N)=O)C1 Amb18183176 [0,1,0,1,0,0|1,0,0]=3 4738 B11R1.667 CC1CCOC(C)(C(=O)O)O1 Amb27426712 [0,1,0,1,0,0|2,0,0]=4 4739 B11R1.667 CC1CNCC(N)(C(N)=O)C1 Amb35709611 [0,1,0,1,0,0|2,0,0]=4 4740 B11R1.667 CN1CCCC(N)(C(=O)O)C1 Amb28280438 [0,1,0,1,0,0|1,0,0]=3 4741 B11R1.667 CN1CCOC(C)(C(=O)O)C1 Amb20061968 [0,1,0,1,0,0|2,0,0]=4 4742 B11R1.667 C[C@@H]1CCC[C@@](C)(C(=O)O)C1 Amb28384471 [0,1,0,1,0,0|0,0,0]=2 4743 B11R1.667 C[C@@H]1CCC[C@@](N)(C(=O)O)C1 Amb27858765 [0,1,0,1,0,0|0,0,0]=2 4744 B11R1.667 C[C@@H]1CCC[C@](N)(C(=O)O)C1 Amb27444576 [0,1,0,1,0,0|0,0,0]=2 4745 B11R1.667 C[C@@H]1CCO[C@@](C)(C(=O)O)O1 Amb27878680 [0,1,0,1,0,0|2,0,0]=4 4746 B11R1.667 C[C@@]1(C(=O)O)CCCC(=O)C1 Amb25138624 [0,1,0,1,0,0|1,0,1]=4 4747 B11R1.667 C[C@H]1CCC[C@](C)(C(=O)O)C1 Amb28132417 [0,1,0,1,0,0|0,0,0]=2 4748 B11R1.667 NC(=O)C1(N)CCCC(O)C1 Amb29866305 [0,1,0,1,0,0|2,0,0]=4 4749 B11R1.667 NC1(C(=O)O)CCCC(=O)C1 Amb23560233 [0,1,0,1,0,0|1,0,1]=4 4750 B11R1.667 NC1(C(=O)O)CCCC(O)C1 Amb27607815 [0,1,0,1,0,0|1,0,0]=3 4751 B11R1.667 NC1CCCC(F)(C(=O)O)C1 Amb27165541 [0,1,0,1,0,0|1,0,0]=3 4752 B11R1.667 N[C@@]1(C(=O)O)CCC[C@@H](O)C1 Amb25377812 [0,1,0,1,0,0|1,0,0]=3 4753 B11R1.667 O=C(O)C1(Cl)CCCC(Cl)C1 Amb28118839 [0,1,0,1,0,0|1,0,0]=3 4754 B11R1.667 O=C(O)C1(O)CCCC(O)C1 Amb28071186 [0,1,0,1,0,0|1,0,0]=3 4755 B11R1.667 O=C(O)[C@@]1(O)CCC[C@H](O)C1 Amb28131475 [0,1,0,1,0,0|1,0,0]=3 4756 B11R1.737 C=C(C)C1(O)CCCCCC1 Amb28197521 [0,1,0,1,0,0|2,0,0]=4 4757 B11R1.737 CC(=O)C1(O)CCCCCC1 Amb27409593 [0,1,0,1,0,0|1,0,0]=3 4758 B11R1.737 CC1(C(=O)Cl)CCCCCC1 Amb25757006 [0,1,0,1,0,0|1,0,0]=3 4759 B11R1.737 CC1(C(=O)O)CCCCCC1 Amb25152741 [0,1,0,1,0,0|0,0,0]=2 4760 B11R1.737 CC1(C(N)=O)CCCCCC1 Amb27970672 [0,1,0,1,0,0|1,0,0]=3 4761 B11R1.737 CC1(C(N)=O)CCCNCC1 Amb27792449 [0,1,0,1,0,0|2,0,0]=4 4762 B11R1.737 C[C@@]1(C(=O)O)CCCCCN1 Amb27848065 [0,1,0,1,0,0|1,0,0]=3 4763 B11R1.737 NC(=O)C1(N)CCCCCC1 Amb6892253 [0,1,0,1,0,0|1,0,0]=3 4764 B11R1.737 NC(=O)C1(N)CCCNCC1 Amb27200456 [0,1,0,1,0,0|2,0,0]=4 4765 B11R1.737 NC(=O)C1(N)CCCSCC1 Amb35692548 [0,1,0,1,0,0|2,0,0]=4 4766 B11R1.737 NC(=O)C1(O)CCCCCC1 Amb18799803 [0,1,0,1,0,0|1,0,0]=3 4767 B11R1.737 NC(=O)C1(O)CCCOCC1 Amb27617298 [0,1,0,1,0,0|2,0,0]=4 4768 B11R1.737 NC(=O)C1(O)CCCSCC1 Amb35691487 [0,1,0,1,0,0|2,0,0]=4 4769 B11R1.737 NC1(C(=O)O)CCCCCC1 Amb1841034 [0,1,0,1,0,0|0,0,0]=2 4770 B11R1.737 NC1(C(=O)O)CCCNCC1 Amb27847261 [0,1,0,1,0,0|1,0,0]=3 4771 B11R1.737 NC1(C(=O)O)CCCSCC1 Amb35691496 [0,1,0,1,0,0|1,0,0]=3 4772 B11R1.737 NC1(C(=O)O)COCCOC1 Amb27984548 [0,1,0,1,0,0|2,0,0]=4 4773 B11R1.737 O=C(Cl)C1(Cl)CCCCCC1 Amb33127987 [0,1,0,1,0,0|1,0,0]=3 4774 B11R1.737 O=C(F)C1(O)CCCCCC1 Amb25909616 [0,1,0,1,0,0|1,0,0]=3 4775 B11R1.737 O=C(O)C1(Cl)CCCCCC1 Amb26847917 [0,1,0,1,0,0|0,0,0]=2 4776 B11R1.737 O=C(O)C1(F)CCCCCC1 Amb25151314 [0,1,0,1,0,0|0,0,0]=2 4777 B11R1.737 O=C(O)C1(O)CCCCCC1 Amb33537594 [0,1,0,1,0,0|0,0,0]=2 4778 B11R1.737 O=C(O)C1(O)CCCSCC1 Amb35691488 [0,1,0,1,0,0|1,0,0]=3 4779 B11R1.774 CC1(CCN)CCCNC1=O Amb27164059 [0,1,0,1,0,0|2,0,0]=4 4780 B11R1.774 CCCC1(C)CCC=CC1=O Amb28351410 [0,1,0,1,0,0|1,0,1]=4 4781 B11R1.774 CCCC1(C)CCCNC1=O Amb33070942 [0,1,0,1,0,0|1,0,0]=3 4782 B11R1.774 CCCC1(C)NCCNC1=O Amb18285225 [0,1,0,1,0,0|2,0,0]=4 4783 B11R1.774 CCCC1(N)CCCNC1=O Amb27250704 [0,1,0,1,0,0|1,0,0]=3 4784 B11R1.774 CCSC1(C)CCCCC1=O Amb27972943 [0,1,0,1,0,0|2,0,0]=4 4785 B11R1.774 COCC1(C)CCCCC1=O Amb27945680 [0,1,0,1,0,0|2,0,0]=4 4786 B11R1.1241 CCCC1(C)CCCC1(C)O Amb26026886 [0,1,0,1,0,0|1,0,1]=4 4787 B11R1.1418 CC(CC#N)(C(=O)O)C1CC1 Amb35711782 [0,1,0,1,0,0|1,0,1]=4 4788 B11R1.1418 CCNC(C)(C(N)=O)C1CC1 Amb18304433 [0,1,0,1,0,0|2,0,0]=4 4789 B11R1.1418 CCOC(C)(C(C)=O)C1CC1 Amb27271175 [0,1,0,1,0,0|2,0,0]=4 4790 B11R1.1418 COCC(C)(C(=O)O)C1CC1 Amb27491885 [0,1,0,1,0,0|1,0,0]=3 4791 B11R1.1418 COCC(N)(C(=O)O)C1CC1 Amb27269907 [0,1,0,1,0,0|1,0,0]=3 4792 B11R1.1418 COCC(N)(C(N)=O)C1CC1 Amb27269906 [0,1,0,1,0,0|2,0,0]=4 4793 B11R1.1418 CSCC(N)(C(=O)O)C1CC1 Amb27269913 [0,1,0,1,0,0|1,0,0]=3 4794 B11R1.1418 CSCC(N)(C(N)=O)C1CC1 Amb27269914 [0,1,0,1,0,0|2,0,0]=4 4795 B11R1.58 CCC1CCCC1S(=O)(=O)Cl Amb28075653 [0,1,0,1,0,0|1,0,1]=4 4796 B11R1.58 CCC1CCCC1S(=O)(=O)F Amb33352518 [0,1,0,1,0,0|1,0,1]=4 4797 B11R1.58 CCC1CCCC1S(N)(=O)=O Amb24488409 [0,1,0,1,0,0|1,0,1]=4 4798 B11R1.155 CC1CCCC(C(C)(C)O)C1 Amb28437138 [0,1,0,1,0,0|1,0,1]=4 4799 B11R1.155 CC1CCCC(S(=O)(=O)Br)C1 Amb29857451 [0,1,0,1,0,0|1,0,1]=4 4800 B11R1.155 CC1CCCC(S(=O)(=O)Cl)C1 Amb18946624 [0,1,0,1,0,0|1,0,1]=4 4801 B11R1.155 CC1CCCC(S(=O)(=O)F)C1 Amb33352604 [0,1,0,1,0,0|1,0,1]=4 4802 B11R1.155 CC1CCCC(S(C)(=N)=O)C1 Amb32676136 [0,1,0,1,0,0|2,0,0]=4 4803 B11R1.155 CC1CCCC(S(N)(=O)=O)C1 Amb18186112 [0,1,0,1,0,0|1,0,1]=4 4804 B11R1.155 NC1CCCC(S(=O)(=O)O)C1 Amb28245760 [0,1,0,1,0,0|2,0,0]=4 4805 B11R1.155 N[C@@H]1CCC[C@@H](S(=O)(=O)O)C1 Amb27631340 [0,1,0,1,0,0|2,0,0]=4 4806 B11R1.155 O=S(=O)(O)[C@@H]1CCC[C@H](O)C1 Amb28319780 [0,1,0,1,0,0|2,0,0]=4 4807 B11R1.528 CCCC(C1CC1)S(=O)(=O)Cl Amb26998971 [0,1,0,1,0,0|1,0,1]=4 4808 B11R1.528 CCCC(C1CC1)S(=O)(=O)F Amb33352887 [0,1,0,1,0,0|1,0,1]=4 4809 B11R1.528 CCCC(C1CC1)S(N)(=O)=O Amb26998972 [0,1,0,1,0,0|1,0,1]=4 4810 B11R1.1121 CC(C)(O)C1CCCCCC1 Amb25302388 [0,1,0,1,0,0|1,0,1]=4 4811 B11R1.1121 NS(=O)(=O)C1CCCCCC1 Amb18186110 [0,1,0,1,0,0|1,0,1]=4 4812 B11R1.1121 O=S(=O)(Cl)C1CCCCCC1 Amb33529567 [0,1,0,1,0,0|1,0,1]=4 4813 B11R1.1121 O=S(=O)(F)C1CCCCCC1 Amb32717060 [0,1,0,1,0,0|1,0,1]=4 4814 B11R2.20 C1=C2OCCOC2CCC1 Amb27655044 [0,0,0,2,0,0|2,0,0]=4 4815 B11R2.20 C1CCC2=C(C1)CCCO2 Amb28132692 [0,0,0,2,0,0|1,0,1]=4 4816 B11R2.20 C1CCC2CCCN=C2C1 Amb26454400 [0,0,0,2,0,0|2,0,0]=4 4817 B11R2.20 C1CN=C2NCCCC2C1 Amb28364304 [0,0,0,2,0,0|2,0,0]=4 4818 B11R2.38 CC1CC12CCCCC2O Amb27589725 [0,0,0,2,0,0|1,0,1]=4 4819 B11R2.38 CC1CC12CCCNC2=O Amb33070941 [0,0,0,2,0,0|1,0,0]=3 4820 B11R2.38 CC1C[C@]12CCCC[C@@H]2O Amb27452012 [0,0,0,2,0,0|1,0,1]=4 4821 B11R2.38 C[C@@H]1C[C@]12CCCCC2=O Amb27197678 [0,0,0,2,0,0|1,0,0]=3 4822 B11R2.47 CC1CC2CCC1NC2=O Amb27876490 [0,0,0,2,0,0|1,0,0]=3 4823 B11R2.47 CC1CC2CCN1CC2=O Amb27262917 [0,0,0,2,0,0|2,0,0]=4 4824 B11R2.47 CN1CC2CCC1CC2=O Amb27945017 [0,0,0,2,0,0|2,0,0]=4 4825 B11R2.47 C[C@@H]1C[C@H]2CC[C@H]1CC2=O Amb27432509 [0,0,0,2,0,0|1,0,0]=3 4826 B11R2.47 C[C@H]1C[C@H]2CCN1CC2=O Amb27818059 [0,0,0,2,0,0|2,0,0]=4 4827 B11R2.47 O=C1C[C@H]2CC[C@@H]1C[C@@H]2O Amb28052469 [0,0,0,2,0,0|2,0,0]=4 4828 B11R2.47 O=C1C[C@H]2CC[C@@H]1C[C@H]2O Amb27211926 [0,0,0,2,0,0|2,0,0]=4 4829 B11R2.47 O=C1C[C@H]2CC[C@H]1CC2O Amb27211980 [0,0,0,2,0,0|2,0,0]=4 4830 B11R2.47 O=C1NC2CCC1CC2O Amb26356211 [0,0,0,2,0,0|2,0,0]=4 4831 B11R2.47 O=C1OC2CCC1CC2Cl Amb27816305 [0,0,0,2,0,0|1,0,0]=3 4832 B11R2.47 O=C1O[C@H]2CC[C@@H]1C[C@@H]2O Amb27630933 [0,0,0,2,0,0|1,0,0]=3 4833 B11R2.48 O=C1CN2CCC[C@@H]1CC2 Amb28255482 [0,0,0,2,0,0|2,0,0]=4 4834 B11R2.48 O=C1C[C@@H]2CCC[C@H]1CC2 Amb28199906 [0,0,0,2,0,0|1,0,0]=3 4835 B11R2.48 O=C1NC2CCC1CNC2 Amb27405712 [0,0,0,2,0,0|2,0,0]=4 4836 B11R2.48 O=C1N[C@@H]2CC[C@H]1CNC2 Amb28290884 [0,0,0,2,0,0|2,0,0]=4 4837 B11R2.48 O=C1N[C@H]2CC[C@@H]1CNC2 Amb22757913 [0,0,0,2,0,0|2,0,0]=4 4838 B11R2.48 OC1CC2CCCC1CC2 Amb2780681 [0,0,0,2,0,0|1,0,1]=4 4839 B11R2.48 O[C@@H]1C[C@@H]2CCC[C@H]1CC2 Amb27658281 [0,0,0,2,0,0|1,0,1]=4 4840 B11R2.48 O[C@H]1C[C@@H]2CCC[C@@H]1CC2 Amb27970294 [0,0,0,2,0,0|1,0,1]=4 4841 B11R2.48 O[C@H]1C[C@@H]2CCC[C@H]1CC2 Amb27848119 [0,0,0,2,0,0|1,0,1]=4 4842 B11R2.55 C=C1CCCCC1C2CC2 Amb35661883 [0,0,0,2,0,0|2,0,0]=4 4843 B11R2.55 O=C1CCCCC1C2CC2 Amb24271138 [0,0,0,2,0,0|1,0,0]=3 4844 B11R2.55 O=C1CCNCC1C2CC2 Amb28055686 [0,0,0,2,0,0|2,0,0]=4 4845 B11R2.55 O=C1CCOCC1C2CC2 Amb26476653 [0,0,0,2,0,0|2,0,0]=4 4846 B11R2.55 O=C1NCCCN1C2CC2 Amb27223003 [0,0,0,2,0,0|2,0,0]=4 4847 B11R2.55 O=C1NCCNC1C2CC2 Amb18947085 [0,0,0,2,0,0|2,0,0]=4 4848 B11R2.55 OC1CCCCC1C2CC2 Amb25736550 [0,0,0,2,0,0|1,0,1]=4 4849 B11R2.55 O[C@@H]1CCCC[C@H]1C2CC2 Amb25210827 [0,0,0,2,0,0|1,0,1]=4 4850 B11R2.68 CC1CC2CC1CCC2=O Amb27164704 [0,0,0,2,0,0|1,0,0]=3 4851 B11R2.104 O=C1CCCC2C(O)CC12 Amb27948669 [0,0,0,2,0,0|2,0,0]=4 4852 B11R2.104 O=C1CCC[C@@H]2C(O)C[C@H]12 Amb28366397 [0,0,0,2,0,0|2,0,0]=4 4853 B11R2.106 C=C1CCCC2CCCC12 Amb27791947 [0,0,0,2,0,0|2,0,0]=4 4854 B11R2.106 C=C1CCC[C@H]2CCC[C@@H]12 Amb24514856 [0,0,0,2,0,0|2,0,0]=4 4855 B11R2.106 O=C1CCCC2CCCC12 Amb28070832 [0,0,0,2,0,0|1,0,0]=3 4856 B11R2.106 O=C1CCCC2CCCN12 Amb22371129 [0,0,0,2,0,0|2,0,0]=4 4857 B11R2.106 O=C1CCCC2CCOC12 Amb27859380 [0,0,0,2,0,0|2,0,0]=4 4858 B11R2.106 O=C1CCCC2CNCC12 Amb22754735 [0,0,0,2,0,0|2,0,0]=4 4859 B11R2.106 O=C1CCCC2CNCC12 Amb32410157 [0,0,0,2,0,0|2,0,0]=4 4860 B11R2.106 O=C1CCCC2CSCC12 Amb32668551 [0,0,0,2,0,0|2,0,0]=4 4861 B11R2.106 O=C1CCCC2SCCC12 Amb27164705 [0,0,0,2,0,0|2,0,0]=4 4862 B11R2.106 O=C1CCC[C@@H]2SCC[C@H]12 Amb27433072 [0,0,0,2,0,0|2,0,0]=4 4863 B11R2.106 O=C1CCNC2CCCC12 Amb1085838 [0,0,0,2,0,0|2,0,0]=4 4864 B11R2.106 O=C1CCNC2CCCC12 Amb22283860 [0,0,0,2,0,0|2,0,0]=4 4865 B11R2.106 O=C1CCOC2CCCC12 Amb18831906 [0,0,0,2,0,0|2,0,0]=4 4866 B11R2.106 O=C1NCCC2NCCC12 Amb13888819 [0,0,0,2,0,0|2,0,0]=4 4867 B11R2.106 O=C1NCCC2OCCC12 Amb28185009 [0,0,0,2,0,0|2,0,0]=4 4868 B11R2.106 O=C1NCCN2CCCC12 Amb9767616 [0,0,0,2,0,0|2,0,0]=4 4869 B11R2.106 O=C1NCCN2CCC[C@@H]12 Amb28068347 [0,0,0,2,0,0|2,0,0]=4 4870 B11R2.106 O=C1NCC[C@@H]2NCC[C@@H]12 Amb18831845 [0,0,0,2,0,0|2,0,0]=4 4871 B11R2.106 O=C1NCC[C@@H]2OCC[C@@H]12 Amb34914981 [0,0,0,2,0,0|2,0,0]=4 4872 B11R2.106 O=C1NCC[C@@H]2OCC[C@H]12 Amb24710528 [0,0,0,2,0,0|2,0,0]=4 4873 B11R2.106 O=C1NCC[C@H]2NCC[C@H]12 Amb27420262 [0,0,0,2,0,0|2,0,0]=4 4874 B11R2.106 O=C1NCC[C@H]2OCC[C@@H]12 Amb26389316 [0,0,0,2,0,0|2,0,0]=4 4875 B11R2.106 O=C1NNC[C@@H]2CCC[C@H]12 Amb33734238 [0,0,0,2,0,0|2,0,0]=4 4876 B11R2.106 O=C1OCCC2CCNC12 Amb26611135 [0,0,0,2,0,0|1,0,0]=3 4877 B11R2.106 O=C1OCCC2CCNC12 Amb28555523 [0,0,0,2,0,0|1,0,0]=3 4878 B11R2.106 O=C1OCCC2CNCC12 Amb35750421 [0,0,0,2,0,0|1,0,0]=3 4879 B11R2.106 O=C1OCCC2CNCC12 Amb35751167 [0,0,0,2,0,0|1,0,0]=3 4880 B11R2.106 O=C1OCC[C@@H]2CNC[C@H]12 Amb35788152 [0,0,0,2,0,0|1,0,0]=3 4881 B11R2.106 O=C1OCC[C@@H]2CNC[C@H]12 Amb35789110 [0,0,0,2,0,0|1,0,0]=3 4882 B11R2.106 OC1CCC[C@@H]2CCC[C@H]12 Amb27184163 [0,0,0,2,0,0|1,0,1]=4 4883 B11R2.106 OC1OCCC2CCCC21 Amb27839207 [0,0,0,2,0,0|0,0,2]=4 4884 B11R2.106 O[C@@H]1CCC[C@H]2CCC[C@@H]12 Amb26943879 [0,0,0,2,0,0|1,0,1]=4 4885 B11R2.106 O[C@H]1CCC[C@@H]2CCC[C@H]12 Amb28256400 [0,0,0,2,0,0|1,0,1]=4 4886 B11R2.106 O[C@H]1CCC[C@H]2CCC[C@@H]12 Amb27660945 [0,0,0,2,0,0|1,0,1]=4 4887 B11R2.246 CCC[C@H]1C[C@@H]2C[C@@H]2C1=O Amb28285868 [0,0,0,2,0,0|1,0,0]=3 4888 B11R2.327 O=CC1C2CCC1C(=O)O2 Amb27954197 [0,0,0,2,0,0|1,0,1]=4 4889 B11R2.329 CC[C@@H]1[C@@H]2CCO[C@H]1C2=O Amb28052516 [0,0,0,2,0,0|2,0,0]=4 4890 B11R2.329 CC[C@H]1[C@@H]2OCC[C@H]1C2=O Amb28348611 [0,0,0,2,0,0|2,0,0]=4 4891 B11R2.357 O=C1C=C[C@@H]2CCC[C@H]1C2 Amb28074610 [0,0,0,2,0,0|1,0,1]=4 4892 B11R2.357 O=C1CCC2CCCC1C2 Amb26497599 [0,0,0,2,0,0|1,0,0]=3 4893 B11R2.357 O=C1CCC2CCCN1C2 Amb24419891 [0,0,0,2,0,0|2,0,0]=4 4894 B11R2.357 O=C1CCC2CCNC1C2 Amb33249781 [0,0,0,2,0,0|2,0,0]=4 4895 B11R2.357 O=C1CCC2CCNC1C2 Amb33249782 [0,0,0,2,0,0|2,0,0]=4 4896 B11R2.357 O=C1CCC2COCC1C2 Amb27770464 [0,0,0,2,0,0|2,0,0]=4 4897 B11R2.357 O=C1CCN2CCCC1C2 Amb18832014 [0,0,0,2,0,0|2,0,0]=4 4898 B11R2.357 O=C1CC[C@@H]2CCC[C@@H]1C2 Amb27859411 [0,0,0,2,0,0|1,0,0]=3 4899 B11R2.357 O=C1CC[C@@H]2CCC[C@H]1C2 Amb27489027 [0,0,0,2,0,0|1,0,0]=3 4900 B11R2.357 O=C1CC[C@H]2CCC[C@@H]1O2 Amb28052551 [0,0,0,2,0,0|2,0,0]=4 4901 B11R2.357 O=C1NCC2CCCC1C2 Amb27877688 [0,0,0,2,0,0|1,0,0]=3 4902 B11R2.357 O=C1NCC2CCCC1N2 Amb33804444 [0,0,0,2,0,0|2,0,0]=4 4903 B11R2.357 O=C1NCC2CCCC1N2 Amb33804625 [0,0,0,2,0,0|2,0,0]=4 4904 B11R2.357 O=C1NC[C@H]2CCC[C@@H]1C2 Amb27785820 [0,0,0,2,0,0|1,0,0]=3 4905 B11R2.357 O[C@@H]1CCC2CCCC1C2 Amb28050624 [0,0,0,2,0,0|1,0,1]=4 4906 B11R2.357 O[C@@H]1CC[C@@H]2CCC[C@H]1C2 Amb26435164 [0,0,0,2,0,0|1,0,1]=4 4907 B11R2.357 O[C@@H]1CC[C@H]2CCC[C@@H]1C2 Amb27863709 [0,0,0,2,0,0|1,0,1]=4 4908 B11R2.357 O[C@H]1CC[C@H]2CCC[C@@H]1C2 Amb27210814 [0,0,0,2,0,0|1,0,1]=4 4909 B11R2.370 O=C1CCCCC12CCC2 Amb26325424 [0,0,0,2,0,0|1,0,0]=3 4910 B11R2.370 O=C1CCCOC12CCC2 Amb33734670 [0,0,0,2,0,0|2,0,0]=4 4911 B11R2.370 O=C1CCNCC12CCC2 Amb18832011 [0,0,0,2,0,0|2,0,0]=4 4912 B11R2.370 O=C1CCNCC12CCC2 Amb33330366 [0,0,0,2,0,0|2,0,0]=4 4913 B11R2.370 O=C1CCOCC12CCC2 Amb25218301 [0,0,0,2,0,0|2,0,0]=4 4914 B11R2.370 O=C1NCCCC12CCC2 Amb16186650 [0,0,0,2,0,0|1,0,0]=3 4915 B11R2.370 O=C1NCCCC12CNC2 Amb25695552 [0,0,0,2,0,0|2,0,0]=4 4916 B11R2.370 O=C1NCCCC12CNC2 Amb34173873 [0,0,0,2,0,0|2,0,0]=4 4917 B11R2.370 O=C1NCCNC12CCC2 Amb25146311 [0,0,0,2,0,0|2,0,0]=4 4918 B11R2.370 O=C1OCCNC12CCC2 Amb28050252 [0,0,0,2,0,0|1,0,0]=3 4919 B11R2.370 O=C1OCCOC12CCC2 Amb32648798 [0,0,0,2,0,0|1,0,0]=3 4920 B11R2.402 OC12CCCCC1CCC2 Amb17593555 [0,0,0,2,0,0|1,0,1]=4 4921 B11R2.565 O=C1C2CCCC1CCC2 Amb26478705 [0,0,0,2,0,0|1,0,0]=3 4922 B11R2.565 O=C1C2CCCC1CNC2 Amb25290644 [0,0,0,2,0,0|2,0,0]=4 4923 B11R2.565 O=C1C2CCCC1CNC2 Amb33715685 [0,0,0,2,0,0|2,0,0]=4 4924 B11R2.565 O=C1C2CCCC1COC2 Amb22497865 [0,0,0,2,0,0|2,0,0]=4 4925 B11R2.565 O=C1[C@H]2CCC[C@@H]1CNC2 Amb28055348 [0,0,0,2,0,0|2,0,0]=4 4926 B11R2.565 O=C1[C@H]2CCC[C@@H]1CNC2 Amb34198924 [0,0,0,2,0,0|2,0,0]=4 4927 B11R2.565 O=C1[C@H]2CCC[C@@H]1COC2 Amb27267992 [0,0,0,2,0,0|2,0,0]=4 4928 B11R2.565 OC1C2CCCC1CCC2 Amb27255251 [0,0,0,2,0,0|1,0,1]=4 4929 B11R2.142 N=C(N)C1CCCC12CC2 Amb32658616 [0,0,0,2,0,0|2,0,0]=4 4930 B11R2.142 NC(=O)C1CCCC12CC2 Amb32658614 [0,0,0,2,0,0|1,0,0]=3 4931 B11R2.142 NC(=S)C1CCCC12CC2 Amb32658615 [0,0,0,2,0,0|1,1,0]=4 4932 B11R2.142 O=C(O)C1CCCC12CC2 Amb18202870 [0,0,0,2,0,0|0,0,0]=2 4933 B11R2.142 O=C(O)C1CCNC12CC2 Amb35750756 [0,0,0,2,0,0|1,0,0]=3 4934 B11R2.142 O=C(O)C1CCNC12CC2 Amb35752368 [0,0,0,2,0,0|1,0,0]=3 4935 B11R2.142 O=C(O)C1CNCC12CC2 Amb28042966 [0,0,0,2,0,0|1,0,0]=3 4936 B11R2.142 O=C(O)C1CNCC12CC2 Amb33339149 [0,0,0,2,0,0|1,0,0]=3 4937 B11R2.142 O=C(O)C1NCSC12CC2 Amb28292583 [0,0,0,2,0,0|2,0,0]=4 4938 B11R2.142 O=C(O)[C@@H]1CNCC12CC2 Amb24702610 [0,0,0,2,0,0|1,0,0]=3 4939 B11R2.142 O=C(O)[C@H]1CNCC12CC2 Amb25089673 [0,0,0,2,0,0|1,0,0]=3 4940 B11R2.167 CCC1CC2CC(O)C1C2 Amb27196851 [0,0,0,2,0,0|1,0,1]=4 4941 B11R2.167 CCC1C[C@H]2C[C@H](O)[C@H]1C2 Amb27420497 [0,0,0,2,0,0|1,0,1]=4 4942 B11R2.167 COC1CC2CC(=O)C1C2 Amb27227173 [0,0,0,2,0,0|2,0,0]=4 4943 B11R2.167 CSC1CC2CC(=O)C1C2 Amb27164706 [0,0,0,2,0,0|2,0,0]=4 4944 B11R2.167 CS[C@@H]1C[C@@H]2CC(=O)[C@H]1C2 Amb27640474 [0,0,0,2,0,0|2,0,0]=4 4945 B11R2.167 O=C1CC2CC(CCl)C1C2 Amb27596986 [0,0,0,2,0,0|2,0,0]=4 4946 B11R2.167 O=C1CC2CC(CO)C1C2 Amb27861227 [0,0,0,2,0,0|2,0,0]=4 4947 B11R2.167 O=C1C[C@@H]2C[C@H]1[C@H](CO)C2 Amb28054401 [0,0,0,2,0,0|2,0,0]=4 4948 B11R2.167 O=C1C[C@H]2C[C@H](CO)[C@@H]1C2 Amb28285736 [0,0,0,2,0,0|2,0,0]=4 4949 B11R2.202 CC1=CC(=O)C2CCCC12 Amb25862130 [0,0,0,2,0,0|1,0,1]=4 4950 B11R2.202 CC1CC(=O)C2CCCN12 Amb27218603 [0,0,0,2,0,0|2,0,0]=4 4951 B11R2.202 C[C@H]1CC(=O)[C@@H]2CCC[C@H]12 Amb27427657 [0,0,0,2,0,0|1,0,0]=3 4952 B11R2.202 O=C1OC(=O)C2CCCC12 Amb2694682 [0,0,0,2,0,0|1,0,1]=4 4953 B11R2.202 O=C1OC(=O)[C@@H]2CCC[C@H]12 Amb6299711 [0,0,0,2,0,0|1,0,1]=4 4954 B11R2.202 O=C1OC(O)[C@@H]2CCC[C@H]12 Amb27423196 [0,0,0,2,0,0|1,0,0]=3 4955 B11R2.577 CC(=O)C1C2CCC1C2Cl Amb27794786 [0,0,0,2,0,0|2,0,0]=4 4956 B11R2.587 N[C@@H]1[C@H]2CCC(C(=O)O)[C@H]21 Amb27880917 [0,0,0,2,0,0|1,0,0]=3 4957 B11R2.819 O=C(O)C12CCC1CNC2 Amb25688250 [0,0,0,2,0,0|1,0,0]=3 4958 B11R2.819 O=C(O)C12CCC1CNC2 Amb32661276 [0,0,0,2,0,0|1,0,0]=3 4959 B11R2.819 O=C(O)C12CCCN1CC2 Amb33483772 [0,0,0,2,0,0|1,0,0]=3 4960 B11R2.819 O=C(O)[C@@]12CC[C@@H]1CCN2 Amb31156565 [0,0,0,2,0,0|1,0,0]=3 4961 B11R2.819 O=C(O)[C@@]12CC[C@@H]1CCN2 Amb33044344 [0,0,0,2,0,0|1,0,0]=3 4962 B11R2.819 O=C(O)[C@]12CC[C@H]1CCN2 Amb35745854 [0,0,0,2,0,0|1,0,0]=3 4963 B11R2.819 O=C(O)[C@]12CC[C@H]1CNC2 Amb32992853 [0,0,0,2,0,0|1,0,0]=3 4964 B11R2.819 O=C(O)[C@]12CC[C@H]1CNC2 Amb33482775 [0,0,0,2,0,0|1,0,0]=3 4965 B11R2.822 O=C(O)[C@@H]1NC[C@@H]2CC[C@@H]21 Amb33743872 [0,0,0,2,0,0|1,0,0]=3 4966 B11R2.822 O=C(O)[C@@H]1NC[C@@H]2CC[C@@H]21 Amb33803658 [0,0,0,2,0,0|1,0,0]=3 4967 B11R2.822 O=C(O)[C@@H]1NC[C@H]2CC[C@H]21 Amb33714601 [0,0,0,2,0,0|1,0,0]=3 4968 B11R2.822 O=C(O)[C@@H]1NC[C@H]2CC[C@H]21 Amb33803580 [0,0,0,2,0,0|1,0,0]=3 4969 B11R2.822 O=C(O)[C@H]1OC[C@@H]2CC[C@H]12 Amb28203936 [0,0,0,2,0,0|1,0,0]=3 4970 B11R2.824 CC(=O)C1C2CCC1CC2 Amb28061122 [0,0,0,2,0,0|1,0,0]=3 4971 B11R2.824 NC(=O)C1C2CCC1CC2 Amb24757768 [0,0,0,2,0,0|1,0,0]=3 4972 B11R2.824 NC(=O)N1C2CCC1CC2 Amb27660519 [0,0,0,2,0,0|2,0,0]=4 4973 B11R2.824 O=C(Cl)N1C2CCC1CC2 Amb24543311 [0,0,0,2,0,0|2,0,0]=4 4974 B11R2.824 O=C(O)C1C2CCC1CC2 Amb27196504 [0,0,0,2,0,0|0,0,0]=2 4975 B11R2.824 O=C(O)C1C2CCC1NC2 Amb26054774 [0,0,0,2,0,0|1,0,0]=3 4976 B11R2.824 O=C(O)C1C2CCN1CC2 Amb24074708 [0,0,0,2,0,0|1,0,0]=3 4977 B11R2.824 O=C(O)C1C2CCN1CC2 Amb24078266 [0,0,0,2,0,0|1,0,0]=3 4978 B11R2.824 O=C(O)[C@@H]1[C@@H]2C=C[C@H]1CC2 Amb28423480 [0,0,0,2,0,0|0,0,2]=4 4979 B11R2.824 O=C(O)[C@@H]1[C@@H]2CC[C@H]1CN2 Amb23385237 [0,0,0,2,0,0|1,0,0]=3 4980 B11R2.824 O=C(O)[C@H]1[C@@H]2C=C[C@H]1CC2 Amb28050039 [0,0,0,2,0,0|0,0,2]=4 4981 B11R2.824 O=C(O)[C@H]1[C@@H]2CC[C@H]1CN2 Amb27194427 [0,0,0,2,0,0|1,0,0]=3 4982 B11R2.824 O=C(O)[C@H]1[C@@H]2CC[C@H]1NC2 Amb22757899 [0,0,0,2,0,0|1,0,0]=3 4983 B11R2.845 CC(=O)C1CC2CCC1C2 Amb2154722 [0,0,0,2,0,0|1,0,0]=3 4984 B11R2.845 CC(=O)C1CC2CCC1N2 Amb28050434 [0,0,0,2,0,0|2,0,0]=4 4985 B11R2.845 CC(=O)C1CC2CCC1O2 Amb22284669 [0,0,0,2,0,0|2,0,0]=4 4986 B11R2.845 CC(=O)C1CN2CCC1C2 Amb28049861 [0,0,0,2,0,0|2,0,0]=4 4987 B11R2.845 CC(=O)C1C[C@H]2CC[C@@H]1C2 Amb25292344 [0,0,0,2,0,0|1,0,0]=3 4988 B11R2.845 CC(=O)[C@@H]1CN2CC[C@@H]1C2 Amb28052568 [0,0,0,2,0,0|2,0,0]=4 4989 B11R2.845 CC(=O)[C@@H]1C[C@@H]2CC[C@H]1C2 Amb28351653 [0,0,0,2,0,0|1,0,0]=3 4990 B11R2.845 CC(=O)[C@@H]1C[C@@H]2CC[C@H]1O2 Amb28253667 [0,0,0,2,0,0|2,0,0]=4 4991 B11R2.845 CC(=O)[C@H]1C[C@H]2CC[C@H]1C2 Amb28052355 [0,0,0,2,0,0|1,0,0]=3 4992 B11R2.845 CC(O)[C@@H]1C[C@@H]2CC[C@H]1C2 Amb28194241 [0,0,0,2,0,0|1,0,1]=4 4993 B11R2.845 C[C@@H](O)C1CC2CCC1C2 Amb27823182 [0,0,0,2,0,0|1,0,1]=4 4994 B11R2.845 C[C@H](O)C1CC2CCC1C2 Amb27626429 [0,0,0,2,0,0|1,0,1]=4 4995 B11R2.845 C[C@H](O)[C@H]1C[C@H]2CC[C@H]1C2 Amb27660833 [0,0,0,2,0,0|1,0,1]=4 4996 B11R2.845 N=C(N)C1CC2CCC1C2 Amb33068945 [0,0,0,2,0,0|2,0,0]=4 4997 B11R2.845 N=C(N)C1CC2CCC1C2 Amb4297041 [0,0,0,2,0,0|2,0,0]=4 4998 B11R2.845 NC(=O)C1CC2CCC1O2 Amb24615277 [0,0,0,2,0,0|2,0,0]=4 4999 B11R2.845 NC(=O)[C@@H]1C[C@@H]2CC[C@H]1N2 Amb32723446 [0,0,0,2,0,0|2,0,0]=4 5000 B11R2.845 NC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2 Amb27975970 [0,0,0,2,0,0|2,0,0]=4 5001 B11R2.845 NC(=O)[C@H]1CC2CCC1C2 Amb27831874 [0,0,0,2,0,0|1,0,0]=3 5002 B11R2.845 NC(=O)[C@H]1C[C@H]2CC[C@@H]1C2 Amb28429311 [0,0,0,2,0,0|1,0,0]=3 5003 B11R2.845 NC(=S)C1CC2CCC1C2 Amb28047224 [0,0,0,2,0,0|1,1,0]=4 5004 B11R2.845 NS(=O)C1CC2CCC1C2 Amb32720498 [0,0,0,2,0,0|2,0,0]=4 5005 B11R2.845 O=C(Cl)C1CC2CCC1C2 Amb6744961 [0,0,0,2,0,0|1,0,0]=3 5006 B11R2.845 O=C(Cl)N1CC2CCC1C2 Amb28126555 [0,0,0,2,0,0|2,0,0]=4 5007 B11R2.845 O=C(O)C1=C[C@H]2CC[C@@H]1C2 Amb27467878 [0,0,0,2,0,0|0,0,2]=4 5008 B11R2.845 O=C(O)C1CC2C=CC1C2 Amb2550371 [0,0,0,2,0,0|0,0,2]=4 5009 B11R2.845 O=C(O)C1CC2CCC1C2 Amb32643951 [0,0,0,2,0,0|0,0,0]=2 5010 B11R2.845 O=C(O)C1CC2CCC1C2 Amb6335820 [0,0,0,2,0,0|0,0,0]=2 5011 B11R2.845 O=C(O)C1CC2CCC1N2 Amb28048880 [0,0,0,2,0,0|1,0,0]=3 5012 B11R2.845 O=C(O)C1CC2CCC1N2 Amb32932453 [0,0,0,2,0,0|1,0,0]=3 5013 B11R2.845 O=C(O)C1CC2CCC1O2 Amb18202638 [0,0,0,2,0,0|1,0,0]=3 5014 B11R2.845 O=C(O)C1CC2CCN1C2 Amb27252125 [0,0,0,2,0,0|1,0,0]=3 5015 B11R2.845 O=C(O)C1CC2CNC1C2 Amb33714481 [0,0,0,2,0,0|1,0,0]=3 5016 B11R2.845 O=C(O)C1CC2CNC1C2 Amb34162363 [0,0,0,2,0,0|1,0,0]=3 5017 B11R2.845 O=C(O)C1C[C@@H]2C=C[C@H]1C2 Amb3940802 [0,0,0,2,0,0|0,0,2]=4 5018 B11R2.845 O=C(O)C1C[C@@H]2CC[C@H]1C2 Amb28068735 [0,0,0,2,0,0|0,0,0]=2 5019 B11R2.845 O=C(O)C1C[C@H]2C=C[C@@H]1C2 Amb3989583 [0,0,0,2,0,0|0,0,2]=4 5020 B11R2.845 O=C(O)C1NC2CCC1C2 Amb2796335 [0,0,0,2,0,0|1,0,0]=3 5021 B11R2.845 O=C(O)C1NC2CCC1C2 Amb32665985 [0,0,0,2,0,0|1,0,0]=3 5022 B11R2.845 O=C(O)[C@@H]1CN2CC[C@H]1C2 Amb24546995 [0,0,0,2,0,0|1,0,0]=3 5023 B11R2.845 O=C(O)[C@@H]1C[C@@H]2C=C[C@@H]1C2 Amb27882669 [0,0,0,2,0,0|0,0,2]=4 5024 B11R2.845 O=C(O)[C@@H]1C[C@@H]2C=C[C@H]1C2 Amb2607776 [0,0,0,2,0,0|0,0,2]=4 5025 B11R2.845 O=C(O)[C@@H]1C[C@@H]2CCN1C2 Amb33716573 [0,0,0,2,0,0|1,0,0]=3 5026 B11R2.845 O=C(O)[C@@H]1C[C@@H]2CC[C@@H]1O2 Amb28133849 [0,0,0,2,0,0|1,0,0]=3 5027 B11R2.845 O=C(O)[C@@H]1C[C@@H]2CC[C@H]1C2 Amb27421974 [0,0,0,2,0,0|0,0,0]=2 5028 B11R2.845 O=C(O)[C@@H]1C[C@@H]2CC[C@H]1N2 Amb23385246 [0,0,0,2,0,0|1,0,0]=3 5029 B11R2.845 O=C(O)[C@@H]1C[C@@H]2CC[C@H]1O2 Amb24120328 [0,0,0,2,0,0|1,0,0]=3 5030 B11R2.845 O=C(O)[C@@H]1C[C@H]2C=C[C@@H]1C2 Amb22748416 [0,0,0,2,0,0|0,0,2]=4 5031 B11R2.845 O=C(O)[C@@H]1C[C@H]2CCN1C2 Amb24074707 [0,0,0,2,0,0|1,0,0]=3 5032 B11R2.845 O=C(O)[C@@H]1C[C@H]2CC[C@@H]1C2 Amb24630346 [0,0,0,2,0,0|0,0,0]=2 5033 B11R2.845 O=C(O)[C@@H]1C[C@H]2CC[C@@H]1N2 Amb23385249 [0,0,0,2,0,0|1,0,0]=3 5034 B11R2.845 O=C(O)[C@@H]1C[C@H]2CC[C@@H]1N2 Amb27254084 [0,0,0,2,0,0|1,0,0]=3 5035 B11R2.845 O=C(O)[C@@H]1C[C@H]2CC[C@@H]1O2 Amb19334556 [0,0,0,2,0,0|1,0,0]=3 5036 B11R2.845 O=C(O)[C@@H]1C[C@H]2CC[C@H]1O2 Amb27963653 [0,0,0,2,0,0|1,0,0]=3 5037 B11R2.845 O=C(O)[C@@H]1NC2CCC1C2 Amb27776982 [0,0,0,2,0,0|1,0,0]=3 5038 B11R2.845 O=C(O)[C@@H]1N[C@@H]2CC[C@H]1C2 Amb24560741 [0,0,0,2,0,0|1,0,0]=3 5039 B11R2.845 O=C(O)[C@@H]1N[C@H]2CC[C@@H]1C2 Amb18180724 [0,0,0,2,0,0|1,0,0]=3 5040 B11R2.845 O=C(O)[C@@H]1N[C@H]2CC[C@@H]1C2 Amb22748360 [0,0,0,2,0,0|1,0,0]=3 5041 B11R2.845 O=C(O)[C@@H]1N[C@H]2CC[C@H]1C2 Amb22745380 [0,0,0,2,0,0|1,0,0]=3 5042 B11R2.845 O=C(O)[C@H]1CC2CCC1C2 Amb27252127 [0,0,0,2,0,0|0,0,0]=2 5043 B11R2.845 O=C(O)[C@H]1CN2CC[C@@H]1C2 Amb27970123 [0,0,0,2,0,0|1,0,0]=3 5044 B11R2.845 O=C(O)[C@H]1C[C@@H]2C=C[C@@H]1C2 Amb27211097 [0,0,0,2,0,0|0,0,2]=4 5045 B11R2.845 O=C(O)[C@H]1C[C@@H]2C=C[C@H]1C2 Amb3941315 [0,0,0,2,0,0|0,0,2]=4 5046 B11R2.845 O=C(O)[C@H]1C[C@@H]2CC[C@H]1C2 Amb27420163 [0,0,0,2,0,0|0,0,0]=2 5047 B11R2.845 O=C(O)[C@H]1C[C@@H]2CC[C@H]1N2 Amb27631268 [0,0,0,2,0,0|1,0,0]=3 5048 B11R2.845 O=C(O)[C@H]1C[C@@H]2CC[C@H]1O2 Amb27810803 [0,0,0,2,0,0|1,0,0]=3 5049 B11R2.845 O=C(O)[C@H]1C[C@H]2C=C[C@@H]1C2 Amb25930342 [0,0,0,2,0,0|0,0,2]=4 5050 B11R2.845 O=C(O)[C@H]1C[C@H]2C=C[C@H]1C2 Amb27461516 [0,0,0,2,0,0|0,0,2]=4 5051 B11R2.845 O=C(O)[C@H]1C[C@H]2CCN1C2 Amb24074706 [0,0,0,2,0,0|1,0,0]=3 5052 B11R2.845 O=C(O)[C@H]1C[C@H]2CCN1C2 Amb27626890 [0,0,0,2,0,0|1,0,0]=3 5053 B11R2.845 O=C(O)[C@H]1C[C@H]2CC[C@@H]1C2 Amb24548859 [0,0,0,2,0,0|0,0,0]=2 5054 B11R2.845 O=C(O)[C@H]1C[C@H]2CC[C@@H]1O2 Amb24681023 [0,0,0,2,0,0|1,0,0]=3 5055 B11R2.845 O=C(O)[C@H]1C[C@H]2CC[C@H]1O2 Amb25230625 [0,0,0,2,0,0|1,0,0]=3 5056 B11R2.845 O=C(O)[C@H]1NC2CCC1C2 Amb26570917 [0,0,0,2,0,0|1,0,0]=3 5057 B11R2.845 O=C(O)[C@H]1N[C@@H]2CC[C@@H]1C2 Amb26546902 [0,0,0,2,0,0|1,0,0]=3 5058 B11R2.845 O=C(O)[C@H]1N[C@@H]2CC[C@@H]1C2 Amb34916347 [0,0,0,2,0,0|1,0,0]=3 5059 B11R2.845 O=C(O)[C@H]1N[C@@H]2CC[C@H]1C2 Amb2371885 [0,0,0,2,0,0|1,0,0]=3 5060 B11R2.845 O=S(Cl)C1CC2CCC1C2 Amb32720497 [0,0,0,2,0,0|2,0,0]=4 5061 B11R2.845 O=S([O-])C1CC2CCC1C2 Amb32754344 [0,0,0,2,0,0|1,0,1]=4 5062 B11R2.845 O=S([O-])C1C[C@H]2CC[C@@H]1C2 Amb32755454 [0,0,0,2,0,0|1,0,1]=4 5063 B11R2.845 O=[N+]([O-])C1CC2CCC1C2 Amb17940418 [0,0,0,2,0,0|1,0,1]=4 5064 B11R2.845 OB(O)C1CC2CCC1C2 Amb28203836 [0,0,0,2,0,0|1,0,1]=4 5065 B11R2.1726 CC1C2CCCC12C(=O)O Amb28251035 [0,0,0,2,0,0|0,0,0]=2 5066 B11R2.1726 C[C@@H]1[C@@H]2C=CC[C@@]21C(=O)O Amb27203313 [0,0,0,2,0,0|0,0,2]=4 5067 B11R2.1726 O=C(O)C12CCCC1C2Br Amb32666703 [0,0,0,2,0,0|1,0,0]=3 5068 B11R2.1726 O=C(O)[C@@]12CCC[C@@H]1[C@H]2Br Amb32679607 [0,0,0,2,0,0|1,0,0]=3 5069 B11R2.1726 O=C(O)[C@]12CCC[C@H]1[C@@H]2Br Amb32668409 [0,0,0,2,0,0|1,0,0]=3 5070 B11R2.530 CC1C=CC2C(C(=O)O)C12 Amb8439027 [0,0,0,2,0,0|0,0,2]=4 5071 B11R2.530 CN1CCC2C(C(=O)O)C21 Amb28132406 [0,0,0,2,0,0|1,0,0]=3 5072 B11R2.530 NC1CCC2C(C(=O)O)C12 Amb26946971 [0,0,0,2,0,0|1,0,0]=3 5073 B11R2.530 O=C(O)C1C2CCC(=O)C21 Amb25263963 [0,0,0,2,0,0|1,0,1]=4 5074 B11R2.530 O=C(O)[C@@H]1[C@H]2C(=O)CC[C@@H]12 Amb25970058 [0,0,0,2,0,0|1,0,1]=4 5075 B11R2.530 O=C(O)[C@@H]1[C@H]2CCC(=O)[C@H]21 Amb25174904 [0,0,0,2,0,0|1,0,1]=4 5076 B11R2.1852 CC(=O)C1C2CCCNC21 Amb27469821 [0,0,0,2,0,0|2,0,0]=4 5077 B11R2.1852 CC(=O)C1C2CCCSC21 Amb27883048 [0,0,0,2,0,0|2,0,0]=4 5078 B11R2.1852 CC(=O)C1[C@H]2CCCC[C@@H]12 Amb27440691 [0,0,0,2,0,0|1,0,0]=3 5079 B11R2.1852 CC(=O)C1[C@H]2CCCS[C@@H]12 Amb28240533 [0,0,0,2,0,0|2,0,0]=4 5080 B11R2.1852 CC(O)[C@@H]1[C@H]2CCCC[C@H]21 Amb27839225 [0,0,0,2,0,0|1,0,1]=4 5081 B11R2.1852 NC(=O)C1C2CCCCC21 Amb25983598 [0,0,0,2,0,0|1,0,0]=3 5082 B11R2.1852 NC(=O)[C@H]1[C@H]2CCCC[C@H]21 Amb27173630 [0,0,0,2,0,0|1,0,0]=3 5083 B11R2.1852 O=C(O)C1C2C=CCCC21 Amb27241791 [0,0,0,2,0,0|0,0,2]=4 5084 B11R2.1852 O=C(O)C1C2CCCCC21 Amb9774962 [0,0,0,2,0,0|0,0,0]=2 5085 B11R2.1852 O=C(O)C1C2CCCCN21 Amb32681201 [0,0,0,2,0,0|1,0,0]=3 5086 B11R2.1852 O=C(O)C1C2CCCNC21 Amb18831774 [0,0,0,2,0,0|1,0,0]=3 5087 B11R2.1852 O=C(O)C1C2CCCOC21 Amb9677556 [0,0,0,2,0,0|1,0,0]=3 5088 B11R2.1852 O=C(O)C1C2CCNCC21 Amb18831775 [0,0,0,2,0,0|1,0,0]=3 5089 B11R2.1852 O=C(O)C1C2CCNCC21 Amb32675132 [0,0,0,2,0,0|1,0,0]=3 5090 B11R2.1852 O=C(O)C1C2CCOCC21 Amb23538736 [0,0,0,2,0,0|1,0,0]=3 5091 B11R2.1852 O=C(O)C1C2OCCOC21 Amb26885378 [0,0,0,2,0,0|2,0,0]=4 5092 B11R2.1852 O=C(O)C1[C@@H]2C=CCC[C@H]12 Amb27468687 [0,0,0,2,0,0|0,0,2]=4 5093 B11R2.1852 O=C(O)C1[C@H]2CCCO[C@@H]12 Amb28135263 [0,0,0,2,0,0|1,0,0]=3 5094 B11R2.1852 O=C(O)C1[C@H]2CCCS[C@@H]12 Amb27403707 [0,0,0,2,0,0|1,0,0]=3 5095 B11R2.1852 O=C(O)C1[C@H]2CCOC[C@@H]12 Amb28344085 [0,0,0,2,0,0|1,0,0]=3 5096 B11R2.1852 O=C(O)C1[C@H]2CNCC[C@@H]12 Amb33803532 [0,0,0,2,0,0|1,0,0]=3 5097 B11R2.1852 O=C(O)[C@@H]1[C@H]2CCCC[C@H]21 Amb27615049 [0,0,0,2,0,0|0,0,0]=2 5098 B11R2.1852 O=C(O)[C@@H]1[C@H]2CCCO[C@H]21 Amb27784643 [0,0,0,2,0,0|1,0,0]=3 5099 B11R2.1852 O=C(O)[C@H]1[C@@H]2C=CCC[C@@H]21 Amb27422048 [0,0,0,2,0,0|0,0,2]=4 5100 B11R2.1852 O=C(O)[C@H]1[C@@H]2CCCO[C@@H]21 Amb25296387 [0,0,0,2,0,0|1,0,0]=3 5101 B11R2.1852 O=C(O)[C@H]1[C@@H]2OCCO[C@@H]21 Amb28397915 [0,0,0,2,0,0|2,0,0]=4 5102 B11R2.1852 O=C(O)[C@H]1[C@H]2CC=CC[C@H]21 Amb27655573 [0,0,0,2,0,0|0,0,2]=4 5103 B11R2.1852 O=C(O)[C@H]1[C@H]2CCCO[C@@H]12 Amb27784682 [0,0,0,2,0,0|1,0,0]=3 5104 B11R2.814 CC(=O)C1CC2CCOC21 Amb33330259 [0,0,0,2,0,0|2,0,0]=4 5105 B11R2.814 CC(=O)N1CC2CCCC21 Amb28065396 [0,0,0,2,0,0|2,0,0]=4 5106 B11R2.814 NC(=O)C1CC2CCCC21 Amb25269534 [0,0,0,2,0,0|1,0,0]=3 5107 B11R2.814 NC(=O)N1CC2CCCC21 Amb28316070 [0,0,0,2,0,0|2,0,0]=4 5108 B11R2.814 O=C(O)C1=CC2CCCC12 Amb33620437 [0,0,0,2,0,0|0,0,2]=4 5109 B11R2.814 O=C(O)C1CC2CCCC21 Amb24524606 [0,0,0,2,0,0|0,0,0]=2 5110 B11R2.814 O=C(O)C1CC2CNCC21 Amb27972409 [0,0,0,2,0,0|1,0,0]=3 5111 B11R2.814 O=C(O)C1CC2COCC21 Amb27635747 [0,0,0,2,0,0|1,0,0]=3 5112 B11R2.814 O=C(O)C1CC2OCCC21 Amb27669695 [0,0,0,2,0,0|1,0,0]=3 5113 B11R2.814 O=C(O)C1C[C@H]2CCC[C@@H]12 Amb28196683 [0,0,0,2,0,0|0,0,0]=2 5114 B11R2.814 O=C(O)[C@@H]1C[C@H]2CCO[C@H]21 Amb28059243 [0,0,0,2,0,0|1,0,0]=3 5115 B11R2.814 O=C(O)[C@H]1C[C@@H]2COC[C@@H]21 Amb27258191 [0,0,0,2,0,0|1,0,0]=3 5116 B11R2.814 O=C([O-])C1OC2CCCC21 Amb35752876 [0,0,0,2,0,0|1,0,1]=4 5117 B11R2.814 O=C([O-])[C@@H]1O[C@@H]2CCC[C@@H]21 Amb35789180 [0,0,0,2,0,0|1,0,1]=4 5118 B11R2.612 NC1CC(C(=O)O)C2CC12 Amb28436938 [0,0,0,2,0,0|1,0,0]=3 5119 B11R2.612 N[C@@H]1C[C@H](C(=O)O)[C@H]2C[C@H]21 Amb27471877 [0,0,0,2,0,0|1,0,0]=3 5120 B11R2.612 N[C@@H]1C[C@H](C(=O)O)[C@H]2C[C@H]21 Amb33097390 [0,0,0,2,0,0|1,0,0]=3 5121 B11R2.842 CC(=O)N1CC2CCC2C1 Amb29872147 [0,0,0,2,0,0|2,0,0]=4 5122 B11R2.842 NC(=O)C1CC2CCC2C1 Amb24408898 [0,0,0,2,0,0|1,0,0]=3 5123 B11R2.842 NC(=O)N1CC2CCC2C1 Amb35608820 [0,0,0,2,0,0|2,0,0]=4 5124 B11R2.842 O=C(Cl)C1CC2CCC2C1 Amb27983531 [0,0,0,2,0,0|1,0,0]=3 5125 B11R2.842 O=C(Cl)N1CC2CCC2C1 Amb26586181 [0,0,0,2,0,0|2,0,0]=4 5126 B11R2.842 O=C(Cl)N1C[C@H]2CC[C@H]2C1 Amb33295204 [0,0,0,2,0,0|2,0,0]=4 5127 B11R2.842 O=C(O)C1CC2CCC2C1 Amb25256091 [0,0,0,2,0,0|0,0,0]=2 5128 B11R2.842 O=C(O)[C@@H]1C[C@@H]2CC[C@@H]2N1 Amb33714602 [0,0,0,2,0,0|1,0,0]=3 5129 B11R2.411 CN1CC2CC2(C(=O)O)C1 Amb27391206 [0,0,0,2,0,0|1,0,0]=3 5130 B11R2.411 NC1CC2CC2(C(=O)O)C1 Amb32654399 [0,0,0,2,0,0|1,0,0]=3 5131 B11R2.411 NC1CC2CC2(C(=O)O)C1 Amb32753234 [0,0,0,2,0,0|1,0,0]=3 5132 B11R2.411 N[C@@H]1C[C@H]2C[C@@]2(C(=O)O)C1 Amb32671170 [0,0,0,2,0,0|1,0,0]=3 5133 B11R2.411 N[C@@H]1C[C@H]2C[C@@]2(C(=O)O)C1 Amb32674773 [0,0,0,2,0,0|1,0,0]=3 5134 B11R2.434 C[C@H]1C[C@@H]2CC(=O)[C@H](C1)C2 Amb27853742 [0,0,0,2,0,0|1,0,0]=3 5135 B11R2.434 C[C@H]1C[C@H]2CC(=O)[C@H](C1)C2 Amb27861316 [0,0,0,2,0,0|1,0,0]=3 5136 B11R2.434 O=C1C[C@@H]2C[C@H]1C[C@H](O)C2 Amb27211724 [0,0,0,2,0,0|2,0,0]=4 5137 B11R2.434 O=C1NC2CC(O)CC1C2 Amb23596883 [0,0,0,2,0,0|2,0,0]=4 5138 B11R2.470 CC1CCCC2(C1)OC2C Amb25793524 [0,0,0,2,0,0|1,0,1]=4 5139 B11R2.697 CC12CCCC(C1)C(=O)N2 Amb23596875 [0,0,0,2,0,0|1,0,0]=3 5140 B11R2.697 C[C@]12CCC[C@H](C1)C(=O)C2 Amb27970152 [0,0,0,2,0,0|1,0,0]=3 5141 B11R2.818 CC(=O)C12CCCC1(C)O2 Amb26483675 [0,0,0,2,0,0|2,0,0]=4 5142 B11R2.818 O=C(O)C12CCCC1(Br)C2 Amb27797171 [0,0,0,2,0,0|1,0,0]=3 5143 B11R2.839 CC(=O)N1CCC2CC2C1 Amb29855652 [0,0,0,2,0,0|2,0,0]=4 5144 B11R2.839 CC(O)C1CCC2CC2C1 Amb35710553 [0,0,0,2,0,0|1,0,1]=4 5145 B11R2.839 N=C(N)C1CCC2CC2C1 Amb35598558 [0,0,0,2,0,0|2,0,0]=4 5146 B11R2.839 NC(=O)C1CCC2CC2N1 Amb27186297 [0,0,0,2,0,0|2,0,0]=4 5147 B11R2.839 NC(=O)N1CCC2CC2C1 Amb30006810 [0,0,0,2,0,0|2,0,0]=4 5148 B11R2.839 NC(=S)C1CCC2CC2C1 Amb35668613 [0,0,0,2,0,0|1,1,0]=4 5149 B11R2.839 O=C(Cl)C1CCC2CC2C1 Amb35695772 [0,0,0,2,0,0|1,0,0]=3 5150 B11R2.839 O=C(Cl)N1CCC2CC2C1 Amb33296932 [0,0,0,2,0,0|2,0,0]=4 5151 B11R2.839 O=C(O)C1CCC2CC2C1 Amb27876727 [0,0,0,2,0,0|0,0,0]=2 5152 B11R2.839 O=C(O)[C@@H]1C[C@@H]2O[C@@H]2CN1 Amb27216871 [0,0,0,2,0,0|2,0,0]=4 5153 B11R2.839 O=C(O)[C@H]1CC[C@H]2O[C@H]2C1 Amb27420168 [0,0,0,2,0,0|1,0,0]=3 5154 B11R2.846 O=C(O)C1CC2CC(C1)N2 Amb28314296 [0,0,0,2,0,0|1,0,0]=3 5155 B11R2.1826 CC(=O)C12CCCN(C1)C2 Amb26328669 [0,0,0,2,0,0|2,0,0]=4 5156 B11R2.1826 NC(=O)C12CC(CCN1)C2 Amb27245125 [0,0,0,2,0,0|2,0,0]=4 5157 B11R2.1826 NC(=O)C12CCCC(C1)C2 Amb24426820 [0,0,0,2,0,0|1,0,0]=3 5158 B11R2.1826 O=C(O)C12CC(CCN1)C2 Amb24479083 [0,0,0,2,0,0|1,0,0]=3 5159 B11R2.1826 O=C(O)C12CC(CCN1)C2 Amb9677536 [0,0,0,2,0,0|1,0,0]=3 5160 B11R2.1826 O=C(O)C12CCCC(C1)C2 Amb25261064 [0,0,0,2,0,0|0,0,0]=2 5161 B11R2.1826 O=C(O)C12CNCC(C1)C2 Amb30588639 [0,0,0,2,0,0|1,0,0]=3 5162 B11R2.1837 CC(=O)N1CCC[C@@H]2C[C@@H]21 Amb27979316 [0,0,0,2,0,0|2,0,0]=4 5163 B11R2.1837 CC(O)C1CCCC2CC21 Amb27769077 [0,0,0,2,0,0|1,0,1]=4 5164 B11R2.1837 C[C@@H](O)C1CCCC2CC21 Amb35726291 [0,0,0,2,0,0|1,0,1]=4 5165 B11R2.1837 C[C@H](O)C1CCCC2CC21 Amb35726290 [0,0,0,2,0,0|1,0,1]=4 5166 B11R2.1837 N=C(N)C1CCCC2CC21 Amb35726414 [0,0,0,2,0,0|2,0,0]=4 5167 B11R2.1837 NC(=O)C1CCCC2CC21 Amb30008213 [0,0,0,2,0,0|1,0,0]=3 5168 B11R2.1837 NC(=S)C1CCCC2CC21 Amb35726430 [0,0,0,2,0,0|1,1,0]=4 5169 B11R2.1837 O=C(Cl)C1CCCC2CC21 Amb30007985 [0,0,0,2,0,0|1,0,0]=3 5170 B11R2.1837 O=C(O)C1CCCC2CC21 Amb26335134 [0,0,0,2,0,0|0,0,0]=2 5171 B11R2.1837 O=C(O)C1CCCC2OC21 Amb26014539 [0,0,0,2,0,0|1,0,0]=3 5172 B11R2.1837 O=C(O)C1NCCC2CC21 Amb24758905 [0,0,0,2,0,0|1,0,0]=3 5173 B11R2.1837 O=C(O)C1NCCC2CC21 Amb33295309 [0,0,0,2,0,0|1,0,0]=3 5174 B11R2.1837 O=C(O)C1NCC[C@@H]2C[C@H]12 Amb34913022 [0,0,0,2,0,0|1,0,0]=3 5175 B11R2.1837 O=C(O)C1NCC[C@H]2C[C@@H]12 Amb34158527 [0,0,0,2,0,0|1,0,0]=3 5176 B11R2.1837 O=C(O)[C@@H]1CCC[C@@H]2O[C@@H]21 Amb27626945 [0,0,0,2,0,0|1,0,0]=3 5177 B11R2.1837 O=C(O)[C@@H]1NCC[C@H]2C[C@H]21 Amb33496159 [0,0,0,2,0,0|1,0,0]=3 5178 B11R2.1837 O=C(O)[C@@H]1NCC[C@H]2C[C@H]21 Amb33496160 [0,0,0,2,0,0|1,0,0]=3 5179 B11R2.1837 O=C(O)[C@H]1CCC[C@@H]2C[C@H]12 Amb27630509 [0,0,0,2,0,0|0,0,0]=2 5180 B11R2.102 O=C1NC2CCCCC1C2 Amb28292243 [0,0,0,2,0,0|1,0,0]=3 5181 B11R2.356 O=C1CC(C2CC2)C(=O)O1 Amb33133500 [0,0,0,2,0,0|1,0,1]=4 5182 B11R2.621 O=C1CC2(CCC2)C(=O)O1 Amb26539723 [0,0,0,2,0,0|1,0,1]=4 5183 B11R2.231 CCC1NC(=O)C1C2CC2 Amb28144868 [0,0,0,2,0,0|1,0,0]=3 5184 B11R2.777 O=C(O)[C@@]1(C2CC2)C[C@@H]1F Amb27776575 [0,0,0,2,0,0|1,0,0]=3 5185 B11R2.777 O=C(O)[C@]1(C2CC2)C[C@@H]1F Amb25683532 [0,0,0,2,0,0|1,0,0]=3 5186 B11R2.777 O=C(O)[C@]1(C2CC2)C[C@H]1F Amb25663262 [0,0,0,2,0,0|1,0,0]=3 5187 B11R2.837 CC(=O)C(C1CC1)C2CC2 Amb28061755 [0,0,0,2,0,0|1,0,0]=3 5188 B11R2.837 CC(O)C(C1CC1)C2CC2 Amb28061754 [0,0,0,2,0,0|1,0,1]=4 5189 B11R2.837 C[C@@H](O)C(C1CC1)C2CC2 Amb28385335 [0,0,0,2,0,0|1,0,1]=4 5190 B11R2.837 C[C@H](O)C(C1CC1)C2CC2 Amb27424915 [0,0,0,2,0,0|1,0,1]=4 5191 B11R2.837 NC(=O)C(C1CC1)C2CC2 Amb27634776 [0,0,0,2,0,0|1,0,0]=3 5192 B11R2.837 NC(=S)C(C1CC1)C2CC2 Amb27483829 [0,0,0,2,0,0|1,1,0]=4 5193 B11R2.837 O=C(Cl)C(C1CC1)C2CC2 Amb28067355 [0,0,0,2,0,0|1,0,0]=3 5194 B11R2.837 O=C(O)C(C1CC1)C2CC2 Amb18288871 [0,0,0,2,0,0|0,0,0]=2 5195 B11R2.1849 O=C(O)C1(C2CC2)CCC1 Amb18831905 [0,0,0,2,0,0|0,0,0]=2 5196 B11R2.1849 O=C(O)C1(C2CC2)CNC1 Amb28058132 [0,0,0,2,0,0|1,0,0]=3 5197 B11R2.230 COC1CC(=O)C12CCC2 Amb25319822 [0,0,0,2,0,0|2,0,0]=4 5198 B11R2.711 O=C1CC2CCCCCC12 Amb27424796 [0,0,0,2,0,0|1,0,0]=3 5199 B11R2.711 O=C1NC2CCCCCC12 Amb20622529 [0,0,0,2,0,0|1,0,0]=3 5200 B11R2.711 O=C1N[C@@H]2CCCCC[C@H]12 Amb27188465 [0,0,0,2,0,0|1,0,0]=3 5201 B11R2.711 O=C1N[C@H]2CCCCC[C@@H]12 Amb27259331 [0,0,0,2,0,0|1,0,0]=3 5202 B11R2.711 OC1C[C@H]2CCCCC[C@@H]12 Amb28455280 [0,0,0,2,0,0|1,0,1]=4 5203 B11R2.711 O[C@@H]1C[C@@H]2CCCCC[C@@H]21 Amb27197162 [0,0,0,2,0,0|1,0,1]=4 5204 B11R2.813 CC(=O)C12CCCCC1C2 Amb24602616 [0,0,0,2,0,0|1,0,0]=3 5205 B11R2.813 CC(=O)C12CCCCC1O2 Amb26992382 [0,0,0,2,0,0|2,0,0]=4 5206 B11R2.813 CC(=O)[C@@]12CCCC[C@@H]1C2 Amb27267199 [0,0,0,2,0,0|1,0,0]=3 5207 B11R2.813 CC(=O)[C@@]12CCCC[C@@H]1O2 Amb27440077 [0,0,0,2,0,0|2,0,0]=4 5208 B11R2.813 CC(O)C12CCCCC1C2 Amb35728132 [0,0,0,2,0,0|1,0,1]=4 5209 B11R2.813 NC(=O)C12CCCCC1C2 Amb35692384 [0,0,0,2,0,0|1,0,0]=3 5210 B11R2.813 NC(=O)C12CNCCC1C2 Amb27670222 [0,0,0,2,0,0|2,0,0]=4 5211 B11R2.813 NC(=O)[C@@]12C[C@@H]1CCCN2 Amb33038428 [0,0,0,2,0,0|2,0,0]=4 5212 B11R2.813 NC(=O)[C@]12C[C@H]1CCCN2 Amb35746877 [0,0,0,2,0,0|2,0,0]=4 5213 B11R2.813 O=C(Cl)C12CCCCC1C2 Amb27760357 [0,0,0,2,0,0|1,0,0]=3 5214 B11R2.813 O=C(O)C12CC1CCCN2 Amb24112951 [0,0,0,2,0,0|1,0,0]=3 5215 B11R2.813 O=C(O)C12CC1CCCN2 Amb33714480 [0,0,0,2,0,0|1,0,0]=3 5216 B11R2.813 O=C(O)C12CC1OCCO2 Amb27479382 [0,0,0,2,0,0|2,0,0]=4 5217 B11R2.813 O=C(O)C12CCCCC1C2 Amb25709012 [0,0,0,2,0,0|0,0,0]=2 5218 B11R2.813 O=C(O)C12CCCCC1O2 Amb26396244 [0,0,0,2,0,0|1,0,0]=3 5219 B11R2.813 O=C(O)C12CCCNC1C2 Amb10610565 [0,0,0,2,0,0|1,0,0]=3 5220 B11R2.813 O=C(O)C12CCCNC1C2 Amb27777480 [0,0,0,2,0,0|1,0,0]=3 5221 B11R2.813 O=C(O)C12CCNCC1C2 Amb26047270 [0,0,0,2,0,0|1,0,0]=3 5222 B11R2.813 O=C(O)C12CCNCC1C2 Amb33715675 [0,0,0,2,0,0|1,0,0]=3 5223 B11R2.813 O=C(O)C12CCOCC1C2 Amb32667182 [0,0,0,2,0,0|1,0,0]=3 5224 B11R2.813 O=C(O)C12CNCCC1C2 Amb10610566 [0,0,0,2,0,0|1,0,0]=3 5225 B11R2.813 O=C(O)C12CNCCC1C2 Amb24426368 [0,0,0,2,0,0|1,0,0]=3 5226 B11R2.813 O=C(O)C12CNCCC1O2 Amb28434668 [0,0,0,2,0,0|2,0,0]=4 5227 B11R2.813 O=C(O)C12COCCC1O2 Amb27240327 [0,0,0,2,0,0|2,0,0]=4 5228 B11R2.813 O=C(O)[C@@]12CNCC[C@@H]1C2 Amb32662009 [0,0,0,2,0,0|1,0,0]=3 5229 B11R2.813 O=C(O)[C@@]12CNCC[C@@H]1C2 Amb32662022 [0,0,0,2,0,0|1,0,0]=3 5230 B11R2.813 O=C(O)[C@@]12CNCC[C@@H]1O2 Amb27252360 [0,0,0,2,0,0|2,0,0]=4 5231 B11R2.813 O=C(O)[C@@]12CNCC[C@H]1C2 Amb32662007 [0,0,0,2,0,0|1,0,0]=3 5232 B11R2.813 O=C(O)[C@@]12CNCC[C@H]1C2 Amb32662020 [0,0,0,2,0,0|1,0,0]=3 5233 B11R2.813 O=C(O)[C@@]12C[C@@H]1CCCN2 Amb33098529 [0,0,0,2,0,0|1,0,0]=3 5234 B11R2.813 O=C(O)[C@]12CCOC[C@H]1C2 Amb33295349 [0,0,0,2,0,0|1,0,0]=3 5235 B11R2.813 O=C(O)[C@]12CNCC[C@@H]1C2 Amb28429201 [0,0,0,2,0,0|1,0,0]=3 5236 B11R2.813 O=C(O)[C@]12C[C@H]1CCCN2 Amb24609781 [0,0,0,2,0,0|1,0,0]=3 5237 B11R2.813 O=C(O)[C@]12C[C@H]1CCCN2 Amb35746859 [0,0,0,2,0,0|1,0,0]=3 5238 B11R2.813 OB(O)C12CCCCC1C2 Amb32671966 [0,0,0,2,0,0|1,0,1]=4 5239 B11R2.1036 C1CCCC(C2CO2)CC1 Amb26624350 [0,0,0,2,0,0|1,0,1]=4 5240 B11R2.1036 C1CCCC([C@@H]2CO2)CC1 Amb32881843 [0,0,0,2,0,0|1,0,1]=4 5241 B11R2.1036 C1CCCC([C@H]2CO2)CC1 Amb32881844 [0,0,0,2,0,0|1,0,1]=4 5242 B11R0.280 CCCC(C#CC(=O)O)CCC Amb33168958 [0,0,0,0,0,2|0,0,0]=2 5243 B11R0.280 CCCC(CCC)CCC(=O)O Amb33475131 [0,0,0,0,0,2|0,0,0]=2 5244 B11R0.280 CCCC(CCC)CCC(C)=O Amb33273171 [0,0,0,0,0,2|1,0,0]=3 5245 B11R0.280 CCCC(CCC)CCC(C)O Amb32730990 [0,0,0,0,0,2|1,0,1]=4 5246 B11R0.280 CCCC(CCC)CC[C@@H](C)O Amb32730987 [0,0,0,0,0,2|1,0,1]=4 5247 B11R0.280 CCCC(CCC)CC[C@H](C)O Amb32730989 [0,0,0,0,0,2|1,0,1]=4 5248 B11R0.280 CCCC(CCC)CC[N+](=O)[O-] Amb33273440 [0,0,0,0,0,2|1,0,1]=4 5249 B11R0.280 CCCC(CCC)OCC(=O)O Amb33273128 [0,0,0,0,0,2|0,0,0]=2 5250 B11R0.280 CCCC(CCN)CCC(N)=O Amb19515542 [0,0,0,0,0,2|2,0,0]=4 5251 B11R0.280 CCCC(\C=C\C(=O)O)CCC Amb32731042 [0,0,0,0,0,2|0,0,0]=2 5252 B11R0.280 CCCC(\C=C\C(C)=O)CCC Amb33273201 [0,0,0,0,0,2|1,0,0]=3 5253 B11R0.280 CCCC(\C=C\[N+](=O)[O-])CCC Amb33273439 [0,0,0,0,0,2|1,0,1]=4 5254 B11R0.280 CCCN(CCC)CCC(=O)Cl Amb17143103 [0,0,0,0,0,2|2,0,0]=4 5255 B11R0.280 CCCN(CCC)CCC(=O)O Amb5761444 [0,0,0,0,0,2|1,0,0]=3 5256 B11R0.280 CCOC(CCC(=O)O)OCC Amb30666608 [0,0,0,0,0,2|2,0,0]=4 5257 B11R0.280 CCOC(\C=C\C(=O)O)OCC Amb33341955 [0,0,0,0,0,2|2,0,0]=4