0 B11R1.16 CCCC(=O)N1CCNCC1 P63909 [0,0,0,0,0,0|3,0,0]=3 1 B11R1.16 CCOC(=O)C1CCNCC1 E29669 [0,0,0,0,0,0|1,0,0]=1 2 B11R1.16 CCOC(=O)C1CCNCC1 P28285 [0,0,0,0,0,0|1,0,0]=1 3 B11R1.16 CCOC(=O)C1CCOCC1 E47102 [0,0,0,0,0,0|1,0,0]=1 4 B11R1.16 CCOC(=O)C1OCCCO1 D10084 [0,0,0,0,0,0|2,0,0]=2 5 B11R1.16 CCOC(=O)C1SCCCS1 D10076 [0,0,0,0,0,0|2,0,0]=2 6 B11R1.16 CCOC(=O)N1CCCCC1 E47120 [0,0,0,0,0,0|1,0,0]=1 7 B11R1.16 CCOC(=O)N1CCNCC1 E39297 [0,0,0,0,0,0|2,0,0]=2 8 B11R1.16 CCOC(=O)[C@@H]1CCC=CO1 E25573 [0,0,0,0,0,0|1,0,2]=3 9 B11R1.16 CCOC(=O)[C@@H]1CCCCN1 E47117 [0,0,0,0,0,0|1,0,0]=1 10 B11R1.16 CCOC(=O)[C@@H]1CCCCN1 E49565 [0,0,0,0,0,0|1,0,0]=1 11 B11R1.16 CCOC(=O)[C@@H]1CCCCN1 E49567 [0,0,0,0,0,0|1,0,0]=1 12 B11R1.16 CCOC(=O)[C@@H]1CCCCO1 E63418 [0,0,0,0,0,0|1,0,0]=1 13 B11R1.16 CCOC(=O)[C@@H]1CCCNC1 D21711 [0,0,0,0,0,0|1,0,0]=1 14 B11R1.16 CCOC(=O)[C@@H]1CCCNC1 E1816 [0,0,0,0,0,0|1,0,0]=1 15 B11R1.16 CCOC(=O)[C@@H]1CCCNC1 E22645 [0,0,0,0,0,0|1,0,0]=1 16 B11R1.16 CCOC(=O)[C@@H]1CNCCN1 E46602 [0,0,0,0,0,0|2,0,0]=2 17 B11R1.16 CCOC(=O)[C@@H]1CNCCO1 E43856 [0,0,0,0,0,0|2,0,0]=2 18 B11R1.16 CCOC(=O)[C@@H]1COCCN1 E46494 [0,0,0,0,0,0|2,0,0]=2 19 B11R1.16 CCOC(=O)[C@H]1CCCNC1 D25574 [0,0,0,0,0,0|1,0,0]=1 20 B11R1.16 CCOC(=O)[C@H]1CCCNC1 E1843 [0,0,0,0,0,0|1,0,0]=1 21 B11R1.16 CCOC(=O)[C@H]1CCCNC1 E23938 [0,0,0,0,0,0|1,0,0]=1 22 B11R1.16 CCOC(=O)[C@H]1CCCNC1 E39525 [0,0,0,0,0,0|1,0,0]=1 23 B11R1.16 N#CCC(=O)C1CCOCC1 X12641 [0,0,0,0,0,0|3,0,1]=4 24 B10R1.15 CC[C@H](N)C1CCCCC1 C52215 [1,0,0,0,0,0|1,0,1]=3 25 B10R1.15 CC[C@H](O)C1CCNCC1 P62545 [1,0,0,0,0,0|1,0,2]=4 26 B10R1.15 CNC(=O)[C@@H]1CCCNC1 N16649 [1,0,0,0,0,0|2,0,0]=3 27 B10R1.15 CNC(=O)[C@H]1CCCNC1 M16650 [1,0,0,0,0,0|2,0,0]=3 28 B10R1.15 CNC(=O)[C@H]1CCCNC1 M63083 [1,0,0,0,0,0|2,0,0]=3 29 B10R1.15 COC(=O)C1=CCCCC1 M47018 [1,0,0,0,0,0|0,0,2]=3 30 B10R1.15 COC(=O)C1=CCOCC1 D4955 [1,0,0,0,0,0|1,0,2]=4 31 B10R1.15 COC(=O)C1=CNCCC1 M29675 [1,0,0,0,0,0|1,0,2]=4 32 B10R1.15 COC(=O)C1=COCCC1 M43727 [1,0,0,0,0,0|1,0,2]=4 33 B10R1.15 COC(=O)C1CCNCC1 M25177 [1,0,0,0,0,0|1,0,0]=2 34 B10R1.15 COC(=O)C1CCNCC1 M39294 [1,0,0,0,0,0|1,0,0]=2 35 B10R1.15 COC(=O)C1CCOCC1 M10320 [1,0,0,0,0,0|1,0,0]=2 36 B10R1.15 COC(=O)C1CCSCC1 M13092 [1,0,0,0,0,0|1,0,0]=2 37 B10R1.15 COC(=O)N1CCNCC1 M62366 [1,0,0,0,0,0|2,0,0]=3 38 B10R1.15 COC(=O)[C@@H]1CCCCN1 M28387 [1,0,0,0,0,0|1,0,0]=2 39 B10R1.15 COC(=O)[C@@H]1CCCCN1 M39293 [1,0,0,0,0,0|1,0,0]=2 40 B10R1.15 COC(=O)[C@@H]1CCCCN1 M39425 [1,0,0,0,0,0|1,0,0]=2 41 B10R1.15 COC(=O)[C@@H]1CCCCO1 M43819 [1,0,0,0,0,0|1,0,0]=2 42 B10R1.15 COC(=O)[C@@H]1CCCNC1 M18060 [1,0,0,0,0,0|1,0,0]=2 43 B10R1.15 COC(=O)[C@@H]1CCCNC1 M21650 [1,0,0,0,0,0|1,0,0]=2 44 B10R1.15 COC(=O)[C@@H]1CNCCN1 M43559 [1,0,0,0,0,0|2,0,0]=3 45 B10R1.15 COC(=O)[C@@H]1CNCCO1 M43453 [1,0,0,0,0,0|2,0,0]=3 46 B10R1.15 COC(=O)[C@@H]1CNCCO1 M43456 [1,0,0,0,0,0|2,0,0]=3 47 B10R1.15 COC(=O)[C@@H]1COCCN1 M13411 [1,0,0,0,0,0|2,0,0]=3 48 B10R1.15 COC(=O)[C@@H]1COCCN1 M18297 [1,0,0,0,0,0|2,0,0]=3 49 B10R1.15 COC(=O)[C@@H]1COCCN1 M19898 [1,0,0,0,0,0|2,0,0]=3 50 B10R1.15 COC(=O)[C@@H]1COCCN1 M41516 [1,0,0,0,0,0|2,0,0]=3 51 B10R1.15 COC(=O)[C@H]1CCCNC1 M21649 [1,0,0,0,0,0|1,0,0]=2 52 B10R1.15 COC(=O)[C@H]1CCCNC1 M26313 [1,0,0,0,0,0|1,0,0]=2 53 B10R1.15 COC(=O)[C@H]1CCCOC1 M5495 [1,0,0,0,0,0|1,0,0]=2 54 B10R1.15 COC(=O)[C@H]1CNCCN1 P15343 [1,0,0,0,0,0|2,0,0]=3 55 B10R1.15 COC(=O)[C@H]1CNCCO1 M37050 [1,0,0,0,0,0|2,0,0]=3 56 B10R1.15 COC(=O)[C@H]1CNCCO1 M43455 [1,0,0,0,0,0|2,0,0]=3 57 B10R1.15 COC(=O)[C@H]1COCCN1 M13412 [1,0,0,0,0,0|2,0,0]=3 58 B10R1.15 CSC(=S)N1CCCCC1 M43860 [1,0,0,0,0,0|1,2,0]=4 59 B10R1.15 NCC(=O)C1CCCCC1 A11156 [1,0,0,0,0,0|1,0,0]=2 60 B10R1.15 NCC(=O)N1CCCCC1 A46500 [1,0,0,0,0,0|2,0,0]=3 61 B10R1.15 NNC(=O)C1CCOCC1 T15051 [1,0,0,0,0,0|3,0,0]=4 62 B10R1.15 NNC(=O)[C@H]1CCCOC1 T15052 [1,0,0,0,0,0|3,0,0]=4 63 B10R1.15 N[C@H](CO)C1CCCCC1 A47172 [1,0,0,0,0,0|2,0,1]=4 64 B10R1.15 O=C(CBr)C1CCOCC1 B13722 [1,0,0,0,0,0|2,0,0]=3 65 B10R1.15 O=C(CBr)N1CCOCC1 B41454 [1,0,0,0,0,0|3,0,0]=4 66 B10R1.15 O=C(CCl)N1CCOCC1 C41455 [1,0,0,0,0,0|3,0,0]=4 67 B10R1.15 O=C(CO)N1CCOCC1 H41514 [1,0,0,0,0,0|3,0,0]=4 68 B10R1.17 BrCCOC1CCCCC1 B47143 [1,0,0,0,0,0|3,0,0]=4 69 B10R1.17 CCCCC1CCNCC1 B0923 [1,0,0,0,0,0|2,0,1]=4 70 B12R1.16 C=C1CCC(C(=O)OCC)CC1 E53209 [0,1,0,0,0,0|0,0,1]=2 71 B12R1.16 CCOC(=O)C1CCC(N)CC1 E24029 [0,1,0,0,0,0|0,0,0]=1 72 B12R1.16 CCOC(=O)C1CCC(N)CC1 E52205 [0,1,0,0,0,0|0,0,0]=1 73 B12R1.16 CCOC(=O)C1CCC(N)CC1 E52207 [0,1,0,0,0,0|0,0,0]=1 74 B12R1.16 CCOC(=O)C1CCC(N)CO1 E14987 [0,1,0,0,0,0|1,0,0]=2 75 B12R1.16 CCOC(=O)C1CCC(O)CC1 E37902 [0,1,0,0,0,0|0,0,0]=1 76 B12R1.16 CCOC(=O)C1CCC(O)CC1 E50510 [0,1,0,0,0,0|0,0,0]=1 77 B12R1.16 CCOC(=O)C1CCC(O)CO1 E11761 [0,1,0,0,0,0|1,0,0]=2 78 B12R1.16 CCOC(=O)C1CCN(C)CC1 E50535 [0,1,0,0,0,0|1,0,0]=2 79 B12R1.16 CCOC(=O)N1CCC(=O)CC1 C39440 [0,1,0,0,0,0|1,0,1]=3 80 B12R1.16 CCOC(=O)N1CCC(N)CC1 E47148 [0,1,0,0,0,0|1,0,0]=2 81 B12R1.16 CCOC(=O)N1CCC(O)CC1 E39442 [0,1,0,0,0,0|1,0,0]=2 82 B12R1.16 CCOC(=O)[C@@H]1CCC(=O)CO1 E14988 [0,1,0,0,0,0|1,0,1]=3 83 B12R1.16 CCOC(=O)[C@@H]1CC[C@@H](N)CO1 E14997 [0,1,0,0,0,0|1,0,0]=2 84 B12R1.16 CCOC(=O)[C@H]1CC[C@@H](N)CO1 E14994 [0,1,0,0,0,0|1,0,0]=2 85 B12R1.16 CCOC(=O)[C@H]1CC[C@@H](O)CO1 E14996 [0,1,0,0,0,0|1,0,0]=2 86 B12R1.16 CCOC(=O)[C@H]1CC[C@H](O)CO1 E14995 [0,1,0,0,0,0|1,0,0]=2 87 B12R1.17 CCOC(=O)[C@@H]1CC(=O)CCO1 P22839 [0,1,0,0,0,0|1,0,1]=3 88 B12R1.17 CCOC(=O)[C@H]1CCCC(=O)C1 E23119 [0,1,0,0,0,0|0,0,1]=2 89 B12R1.17 CCOC(=O)[C@H]1C[C@H](C)CCN1 E25195 [0,1,0,0,0,0|1,0,0]=2 90 B12R1.34 COC(=O)C(=O)C1CCCCC1 M24628 [0,1,0,0,0,0|2,0,0]=3 91 B12R1.34 CON(C)C(=O)C1CCOCC1 M10026 [0,1,0,0,0,0|3,0,0]=4 92 B12R1.308 CCOC(=O)C1=C(N)CCCC1 E50468 [0,1,0,0,0,0|0,0,2]=3 93 B12R1.308 CCOC(=O)C1CCCCC1O E50509 [0,1,0,0,0,0|0,0,0]=1 94 B12R1.308 CCOC(=O)[C@@H]1CCCCC1=O E50439 [0,1,0,0,0,0|0,0,1]=2 95 B12R1.308 CCOC(=O)[C@@H]1CCCCN1C E50530 [0,1,0,0,0,0|1,0,0]=2 96 B12R1.308 CCOC(=O)[C@@H]1CCCC[C@@H]1O E50512 [0,1,0,0,0,0|0,0,0]=1 97 B12R1.308 CCOC(=O)[C@@H]1CCCC[C@H]1O E50513 [0,1,0,0,0,0|0,0,0]=1 98 B12R1.308 CCOC(=O)[C@@H]1CCCN[C@@H]1C E29500 [0,1,0,0,0,0|1,0,0]=2 99 B12R1.308 CCOC(=O)[C@@H]1CCNCC1=O E49554 [0,1,0,0,0,0|1,0,1]=3 100 B12R1.308 CCOC(=O)[C@@H]1CNCCC1=O E15548 [0,1,0,0,0,0|1,0,1]=3 101 B12R1.308 CCOC(=O)[C@@H]1COCCC1=O E37534 [0,1,0,0,0,0|1,0,1]=3 102 B12R1.308 CCOC(=O)[C@@H]1OCCCC1=O E17657 [0,1,0,0,0,0|1,0,1]=3 103 B12R1.1595 CCOC(=O)C1(C)CCNCC1 E22475 [0,1,0,0,0,0|1,0,0]=2 104 B12R1.1595 CCOC(=O)C1(C)CCNCC1 E37315 [0,1,0,0,0,0|1,0,0]=2 105 B12R1.1595 CCOC(=O)C1(F)CCNCC1 E49560 [0,1,0,0,0,0|1,0,0]=2 106 B12R1.1595 CCOC(=O)C1(N)CCCCC1 E52202 [0,1,0,0,0,0|0,0,0]=1 107 B12R1.1595 CCOC(=O)C1(N)CCSCC1 E29577 [0,1,0,0,0,0|1,0,0]=2 108 B12R1.1595 CCOC(=O)C1(O)CCCCC1 E32369 [0,1,0,0,0,0|0,0,0]=1 109 B12R1.1595 CCOC(=O)[C@@]1(C)CCCNC1 E52204 [0,1,0,0,0,0|1,0,0]=2 110 B12R1.1595 CCOC(=O)[C@]1(C)CCCNC1 E22903 [0,1,0,0,0,0|1,0,0]=2 111 B10R0.1 CCOC(=O)CCCCCBr E39444 [0,0,1,0,0,0|1,0,0]=2 112 B10R0.1 CCOC(=O)CCCCCO E47160 [0,0,1,0,0,0|1,0,0]=2 113 B10R0.1 CCOC(=O)CCCN=[N+]=[N-] E3898 [0,0,1,0,0,0|3,0,0]=4 114 B10R0.1 CCOC(=O)CNCCC#N E46482 [0,0,1,0,0,0|2,0,1]=4 115 B10R0.19 CCCCC(=O)C(=O)OCC E12153 [0,0,1,0,0,0|1,0,1]=3 116 B10R0.19 CCOC(=O)[C@@H](N)CCCN E63673 [0,0,1,0,0,0|2,0,0]=3 117 B10R0.19 CCOC=C(C)C(=O)OCC E47098 [0,0,1,0,0,0|1,0,2]=4 118 B12R2.8 O=C1NCCC12CCCCC2 A50465 [0,0,0,1,0,0|1,0,0]=2 119 B12R2.8 O=C1NCCC12CCNCC2 D31553 [0,0,0,1,0,0|2,0,0]=3 120 B12R2.8 O=C1NCC[C@@]12CCCNC2 D17070 [0,0,0,1,0,0|2,0,0]=3 121 B12R2.8 O=C1OCCC12CCNCC2 X49550 [0,0,0,1,0,0|1,0,0]=2 122 B12R2.8 O=C1OCCC12CCNCC2 X64274 [0,0,0,1,0,0|1,0,0]=2 123 B12R2.13 O=C1CC(=O)C12CCCCC2 S50286 [0,0,0,1,0,0|2,0,1]=4 124 B12R2.1469 CCOC(=O)C12CNCC1C2 E14526 [0,0,0,1,0,0|1,0,0]=2 125 B12R2.1469 CCOC(=O)C12CNCC1C2 E49551 [0,0,0,1,0,0|1,0,0]=2 126 B12R2.1479 CCOC(=O)C1C2CNCC21 E49552 [0,0,0,1,0,0|1,0,0]=2 127 B12R2.1479 CCOC(=O)C1C2COCC21 E47026 [0,0,0,1,0,0|1,0,0]=2 128 B12R2.1479 CCOC(=O)[C@@H]1[C@H]2COC[C@H]21 E13625 [0,0,0,1,0,0|1,0,0]=2 129 B12R2.1479 CCOC(=O)[C@H]1[C@H]2COC[C@H]21 E18958 [0,0,0,1,0,0|1,0,0]=2 130 B12R2.1488 CCOC(=O)C1CC2CC2C1 E29680 [0,0,0,1,0,0|0,0,0]=1 131 B12R2.2028 O=C1NC(=O)[C@@H]2CCCC[C@H]12 H39437 [0,0,0,1,0,0|2,0,1]=4 132 B12R2.2075 O=C(C1CC1)N2CCNCC2 C24454 [0,0,0,1,0,0|3,0,0]=4 133 B12R2.2075 O=C(C1CC1)N2CCNCC2 C67133 [0,0,0,1,0,0|3,0,0]=4 134 B10R1.11 CCOC(=O)[C@@H]1CCCO1 E43818 [0,0,0,0,1,0|1,0,0]=2 135 B10R1.11 CCOC(=O)[C@@H]1CSCN1 E61537 [0,0,0,0,1,0|2,0,0]=3 136 B10R1.11 CCOC(=O)[C@H]1CCCN1 E37266 [0,0,0,0,1,0|1,0,0]=2 137 B10R1.11 CCOC(=O)[C@H]1CCNC1 E25456 [0,0,0,0,1,0|1,0,0]=2 138 B10R1.11 N#CCC(=O)C1CCCC1 C10418 [0,0,0,0,1,0|2,0,1]=4 139 B12R1.32 CCOC(=O)C=C1CCCNC1 E52195 [0,0,0,0,0,1|1,0,1]=3 140 B12R1.32 CCOC(=O)C=C1CCOCC1 E12043 [0,0,0,0,0,1|1,0,1]=3 141 B12R1.32 CCOC(=O)CC1CCNCC1 E0928 [0,0,0,0,0,1|1,0,0]=2 142 B12R1.32 CCOC(=O)CC1CCNCC1 E24428 [0,0,0,0,0,1|1,0,0]=2 143 B12R1.32 CCOC(=O)CC1CCOCC1 E8052 [0,0,0,0,0,1|1,0,0]=2 144 B12R1.32 CCOC(=O)CN1CCOCC1 E47127 [0,0,0,0,0,1|2,0,0]=3 145 B12R1.32 CCOC(=O)C[C@H]1CCCNC1 E10869 [0,0,0,0,0,1|1,0,0]=2 146 B12R1.32 CCOC(=O)\C=C1\CCCNC1 E52196 [0,0,0,0,0,1|1,0,1]=3 147 B9R0.5 CCC=CCC(=O)OCC E47083 [1,0,1,0,0,0|0,0,2]=4 148 B9R0.5 CCCC=CC(=O)OCC E47082 [1,0,1,0,0,0|0,0,2]=4 149 B9R0.5 CCOC(=O)CCCCBr E39295 [1,0,1,0,0,0|1,0,0]=3 150 B9R0.5 CCOC(=O)CCCCN E46517 [1,0,1,0,0,0|1,0,0]=3 151 B9R0.5 CCOC(=O)CCC[Zn]I E31894 [1,0,1,0,0,0|2,0,0]=4 152 B9R0.5 CCOC(=O)COCCCl E41531 [1,0,1,0,0,0|2,0,0]=4 153 B9R0.45 CCCCCCCNCC E50620 [1,0,1,0,0,0|1,0,1]=4 154 B9R0.46 COC(=O)CCCCCBr M39296 [1,0,1,0,0,0|1,0,0]=3 155 B9R0.46 COC(=O)CCCCCN M67967 [1,0,1,0,0,0|1,0,0]=3 156 B9R0.8 CCCC[C@H](N)C(=O)OC M46518 [1,0,1,0,0,0|1,0,0]=3 157 B9R0.8 COC(=O)[C@@H](Br)CCCBr M41466 [1,0,1,0,0,0|2,0,0]=4 158 B9R0.35 CCCC(=O)C(=O)OCC E43810 [1,0,1,0,0,0|1,0,1]=4 159 B9R0.35 CCC[C@H](C)C(=O)OCC E39445 [1,0,1,0,0,0|0,0,0]=2 160 B9R0.35 CCC[C@H](N)C(=O)OCC N65311 [1,0,1,0,0,0|1,0,0]=3 161 B9R0.37 CCOC(=O)C(CO)CO E64559 [1,0,1,0,0,0|2,0,0]=4 162 B9R0.37 CCOC(=O)[C@@H](C#N)CC E43773 [1,0,1,0,0,0|1,0,1]=4 163 B9R1.6 CC(=O)C1CCCCC1 C25535 [2,0,0,0,0,0|0,0,0]=2 164 B9R1.6 CC(=O)C1CCNCC1 P69462 [2,0,0,0,0,0|1,0,0]=3 165 B9R1.6 CC(=O)C1CCOCC1 T11195 [2,0,0,0,0,0|1,0,0]=3 166 B9R1.6 CC(=O)N1CCNCC1 A67843 [2,0,0,0,0,0|2,0,0]=4 167 B9R1.6 C[C@H](Br)C1CCCCC1 B37545 [2,0,0,0,0,0|1,0,1]=4 168 B9R1.6 NC(=O)C1CCNCC1 P10277 [2,0,0,0,0,0|2,0,0]=4 169 B9R1.6 NC(=O)C1CCNCC1 P43467 [2,0,0,0,0,0|2,0,0]=4 170 B9R1.6 NC(=O)[C@@H]1CCCNC1 P12324 [2,0,0,0,0,0|2,0,0]=4 171 B9R1.6 NC(=O)[C@@H]1CCCNC1 P7512 [2,0,0,0,0,0|2,0,0]=4 172 B9R1.6 NC(=O)[C@H]1CCCNC1 P12323 [2,0,0,0,0,0|2,0,0]=4 173 B9R1.6 NC(=O)[C@H]1CCCNC1 P7513 [2,0,0,0,0,0|2,0,0]=4 174 B9R1.6 O=C(Cl)C1CCOCC1 T3932 [2,0,0,0,0,0|2,0,0]=4 175 B9R1.6 O=C(O)C1CCCCC1 C64950 [2,0,0,0,0,0|0,0,0]=2 176 B9R1.6 O=C(O)C1CCNCC1 P23933 [2,0,0,0,0,0|1,0,0]=3 177 B9R1.6 O=C(O)C1CCNCC1 P24453 [2,0,0,0,0,0|1,0,0]=3 178 B9R1.6 O=C(O)C1CCOCC1 T0117 [2,0,0,0,0,0|1,0,0]=3 179 B9R1.6 O=C(O)C1CCSCC1 T13091 [2,0,0,0,0,0|1,0,0]=3 180 B9R1.6 O=C(O)N1CCCCC1 P62582 [2,0,0,0,0,0|1,0,0]=3 181 B9R1.6 O=C(O)[C@@H]1CC=CCC1 C11079 [2,0,0,0,0,0|0,0,2]=4 182 B9R1.6 O=C(O)[C@@H]1CC=CCC1 C68354 [2,0,0,0,0,0|0,0,2]=4 183 B9R1.6 O=C(O)[C@@H]1CCCCN1 P43440 [2,0,0,0,0,0|1,0,0]=3 184 B9R1.6 O=C(O)[C@@H]1CCCCN1 P43443 [2,0,0,0,0,0|1,0,0]=3 185 B9R1.6 O=C(O)[C@@H]1CCCCO1 T31331 [2,0,0,0,0,0|1,0,0]=3 186 B9R1.6 O=C(O)[C@@H]1CCCNC1 P12310 [2,0,0,0,0,0|1,0,0]=3 187 B9R1.6 O=C(O)[C@@H]1CNCCN1 P10721 [2,0,0,0,0,0|2,0,0]=4 188 B9R1.6 O=C(O)[C@@H]1CNCCN1 P11877 [2,0,0,0,0,0|2,0,0]=4 189 B9R1.6 O=C(O)[C@@H]1CNCCN1 P13373 [2,0,0,0,0,0|2,0,0]=4 190 B9R1.6 O=C(O)[C@@H]1CNCCN1 P41382 [2,0,0,0,0,0|2,0,0]=4 191 B9R1.6 O=C(O)[C@@H]1CNCCO1 M41374 [2,0,0,0,0,0|2,0,0]=4 192 B9R1.6 O=C(O)[C@@H]1CNCCO1 M61070 [2,0,0,0,0,0|2,0,0]=4 193 B9R1.6 O=C(O)[C@@H]1COCCN1 M15337 [2,0,0,0,0,0|2,0,0]=4 194 B9R1.6 O=C(O)[C@@H]1COCCN1 M17082 [2,0,0,0,0,0|2,0,0]=4 195 B9R1.6 O=C(O)[C@@H]1COCCN1 M31616 [2,0,0,0,0,0|2,0,0]=4 196 B9R1.6 O=C(O)[C@@H]1COCCO1 D41234 [2,0,0,0,0,0|2,0,0]=4 197 B9R1.6 O=C(O)[C@H]1CC=CCC1 C11080 [2,0,0,0,0,0|0,0,2]=4 198 B9R1.6 O=C(O)[C@H]1CCCCN1 P28251 [2,0,0,0,0,0|1,0,0]=3 199 B9R1.6 O=C(O)[C@H]1CCCNC1 P12311 [2,0,0,0,0,0|1,0,0]=3 200 B9R1.6 O=C(O)[C@H]1CCCNC1 P43444 [2,0,0,0,0,0|1,0,0]=3 201 B9R1.6 O=C(O)[C@H]1CCCOC1 T0697 [2,0,0,0,0,0|1,0,0]=3 202 B9R1.6 O=C(O)[C@H]1CCCSC1 T1163 [2,0,0,0,0,0|1,0,0]=3 203 B9R1.6 O=C(O)[C@H]1CNCCN1 P10722 [2,0,0,0,0,0|2,0,0]=4 204 B9R1.6 O=C(O)[C@H]1CNCCN1 P11878 [2,0,0,0,0,0|2,0,0]=4 205 B9R1.6 O=C(O)[C@H]1CNCCO1 M18388 [2,0,0,0,0,0|2,0,0]=4 206 B9R1.6 O=C(O)[C@H]1CNCCO1 M63934 [2,0,0,0,0,0|2,0,0]=4 207 B9R1.6 O=C(O)[C@H]1COCCN1 M15338 [2,0,0,0,0,0|2,0,0]=4 208 B9R1.6 O=C(O)[C@H]1COCCN1 M41376 [2,0,0,0,0,0|2,0,0]=4 209 B9R1.6 O=C(O)[C@H]1COCCO1 D41233 [2,0,0,0,0,0|2,0,0]=4 210 B9R1.6 OB(O)C1CCCCC1 C2380 [2,0,0,0,0,0|1,0,1]=4 211 B9R1.8 BrCCC1CCCCC1 B0374 [2,0,0,0,0,0|1,0,1]=4 212 B9R1.8 CCCC1CCNCC1 P49579 [2,0,0,0,0,0|1,0,1]=4 213 B9R1.8 CCC[C@H]1CCCCN1 P49580 [2,0,0,0,0,0|1,0,1]=4 214 B9R1.8 CCNC1CCOCC1 E43915 [2,0,0,0,0,0|2,0,0]=4 215 B9R1.8 COCC1CCNCC1 M14337 [2,0,0,0,0,0|1,0,1]=4 216 B9R1.8 COCC1CCNCC1 M26475 [2,0,0,0,0,0|1,0,1]=4 217 B9R1.8 COC[C@H]1CCCCN1 M46509 [2,0,0,0,0,0|1,0,1]=4 218 B9R1.8 COC[C@H]1CCCCN1 M46512 [2,0,0,0,0,0|1,0,1]=4 219 B9R1.8 ICCC1CCCCC1 I0264 [2,0,0,0,0,0|1,0,1]=4 220 B9R1.8 NCCC1CCCCC1 C49581 [2,0,0,0,0,0|1,0,1]=4 221 B9R1.8 [Mg+]CCC1CCCCC1 C31709 [2,0,0,0,0,0|1,0,1]=4 222 B11R0.4 CCOC(=O)CCCCCCBr E50560 [0,1,1,0,0,0|0,0,0]=2 223 B11R0.4 CCOC(=O)CCCCCCN E52216 [0,1,1,0,0,0|0,0,0]=2 224 B11R0.4 CCOC(=O)CCCCN=[N+]=[N-] A9113 [0,1,1,0,0,0|2,0,0]=4 225 B11R0.68 CSCC[C@H](N)C(=O)OC(C)C P61475 [0,1,1,0,0,0|2,0,0]=4 226 B11R0.191 CCCC[C@H](CC)C(=O)OCC E53338 [0,1,1,0,0,0|0,0,0]=2 227 B11R0.247 CCCCC(F)(F)C(=O)OCC E47090 [0,1,1,0,0,0|1,0,0]=3 228 B11R0.61 CCOC(=O)C(OCC)OCC E28530 [0,1,1,0,0,0|1,0,0]=3 229 B11R1.22 CNC(=O)[C@H]1CC[C@@H](N)CC1 A65469 [1,1,0,0,0,0|1,0,0]=3 230 B11R1.22 COC(=O)C1CCC(=O)CC1 M47024 [1,1,0,0,0,0|0,0,1]=3 231 B11R1.22 COC(=O)C1CCC(N)CC1 M47125 [1,1,0,0,0,0|0,0,0]=2 232 B11R1.22 COC(=O)C1CCC(O)CC1 M8610 [1,1,0,0,0,0|0,0,0]=2 233 B11R1.22 COC(=O)C1CCN(C)CC1 M21735 [1,1,0,0,0,0|1,0,0]=3 234 B11R1.22 COC(=O)N1CCC(=O)CC1 M43780 [1,1,0,0,0,0|1,0,1]=4 235 B11R1.22 COC(=O)N1CCC(N)CC1 M43878 [1,1,0,0,0,0|1,0,0]=3 236 B11R1.22 COC(=O)[C@@H]1CC[C@@H](C)NC1 M29475 [1,1,0,0,0,0|1,0,0]=3 237 B11R1.22 COC(=O)[C@@H]1CC[C@@H](C)NC1 M29476 [1,1,0,0,0,0|1,0,0]=3 238 B11R1.22 COC(=O)[C@@H]1CC[C@H](C)NC1 M66014 [1,1,0,0,0,0|1,0,0]=3 239 B11R1.22 COC(=O)[C@@H]1CC[C@H](O)CN1 M14678 [1,1,0,0,0,0|1,0,0]=3 240 B11R1.22 COC(=O)[C@H]1CCC(=O)NC1 M0586 [1,1,0,0,0,0|1,0,1]=4 241 B11R1.22 COC(=O)[C@H]1CC[C@@H](C)NC1 M11802 [1,1,0,0,0,0|1,0,0]=3 242 B11R1.22 COC(=O)[C@H]1CC[C@@H](C)NC1 M66013 [1,1,0,0,0,0|1,0,0]=3 243 B11R1.22 COC(=O)[C@H]1CC[C@@H](N)CC1 M12150 [1,1,0,0,0,0|0,0,0]=2 244 B11R1.22 COC(=O)[C@H]1CC[C@@H](O)CC1 M13282 [1,1,0,0,0,0|0,0,0]=2 245 B11R1.22 COC(=O)[C@H]1CC[C@H](C)NC1 M60290 [1,1,0,0,0,0|1,0,0]=3 246 B11R1.22 COC(=O)[C@H]1CC[C@H](N)CC1 M1501 [1,1,0,0,0,0|0,0,0]=2 247 B11R1.22 COC(=O)[C@H]1CC[C@H](O)CC1 M13283 [1,1,0,0,0,0|0,0,0]=2 248 B11R1.23 COC(=O)C1CC(O)CCN1 M43857 [1,1,0,0,0,0|1,0,0]=3 249 B11R1.23 COC(=O)C1CCCC(O)C1 M47101 [1,1,0,0,0,0|0,0,0]=2 250 B11R1.23 COC(=O)C1CNCC(C)C1 M9144 [1,1,0,0,0,0|1,0,0]=3 251 B11R1.23 COC(=O)[C@@H]1CC(=O)CCN1 O7322 [1,1,0,0,0,0|1,0,1]=4 252 B11R1.23 COC(=O)[C@@H]1CCC[C@H](O)C1 M24974 [1,1,0,0,0,0|0,0,0]=2 253 B11R1.23 COC(=O)[C@@H]1CCN[C@H](C)C1 M11586 [1,1,0,0,0,0|1,0,0]=3 254 B11R1.23 COC(=O)[C@@H]1CCN[C@H](C)C1 M60158 [1,1,0,0,0,0|1,0,0]=3 255 B11R1.23 COC(=O)[C@H]1CCCC(=O)C1 M47023 [1,1,0,0,0,0|0,0,1]=3 256 B11R1.23 COC(=O)[C@H]1CCC[C@@H](O)C1 M20059 [1,1,0,0,0,0|0,0,0]=2 257 B11R1.23 COC(=O)[C@H]1CCNC(=O)C1 M7686 [1,1,0,0,0,0|1,0,1]=4 258 B11R1.23 COC(=O)[C@H]1CNC[C@@H](C)C1 M21608 [1,1,0,0,0,0|1,0,0]=3 259 B11R1.36 O=C(O)C(=O)C1CCCCC1 C23673 [1,1,0,0,0,0|1,0,1]=4 260 B11R1.222 COC(=O)C1CCNCC1F M59820 [1,1,0,0,0,0|1,0,0]=3 261 B11R1.222 COC(=O)C1CNCCC1O M46495 [1,1,0,0,0,0|1,0,0]=3 262 B11R1.222 COC(=O)[C@@H]1CCCCC1=O M23599 [1,1,0,0,0,0|0,0,1]=3 263 B11R1.222 COC(=O)[C@@H]1CCCNC1=O M43779 [1,1,0,0,0,0|1,0,1]=4 264 B11R1.222 COC(=O)[C@@H]1CNCCC1=O M46477 [1,1,0,0,0,0|1,0,1]=4 265 B11R1.222 COC(=O)[C@@H]1CNCCN1C M43879 [1,1,0,0,0,0|2,0,0]=4 266 B11R1.222 COC(=O)[C@@H]1COCCC1=O M18404 [1,1,0,0,0,0|1,0,1]=4 267 B11R1.222 COC(=O)[C@@H]1COCC[C@@H]1N M32271 [1,1,0,0,0,0|1,0,0]=3 268 B11R1.222 COC(=O)[C@@H]1CSCCC1=O M8265 [1,1,0,0,0,0|1,0,1]=4 269 B11R1.878 COC(=O)C1(C)CCNCC1 M12045 [1,1,0,0,0,0|1,0,0]=3 270 B11R1.878 COC(=O)C1(C)CCOCC1 M8033 [1,1,0,0,0,0|1,0,0]=3 271 B11R1.878 COC(=O)C1(F)CCOCC1 M11565 [1,1,0,0,0,0|1,0,0]=3 272 B11R1.878 COC(=O)C1(N)CCCCC1 M49571 [1,1,0,0,0,0|0,0,0]=2 273 B11R1.878 COC(=O)C1(N)CCOCC1 M12044 [1,1,0,0,0,0|1,0,0]=3 274 B11R1.878 COC(=O)C1(N)CCOCC1 M29746 [1,1,0,0,0,0|1,0,0]=3 275 B11R1.878 COC(=O)C1(O)CCNCC1 M46496 [1,1,0,0,0,0|1,0,0]=3 276 B11R1.878 COC(=O)C1(O)CCOCC1 M12108 [1,1,0,0,0,0|1,0,0]=3 277 B11R1.878 COC(=O)[C@@]1(C)CCCNC1 M11316 [1,1,0,0,0,0|1,0,0]=3 278 B11R1.878 COC(=O)[C@]1(C)COCCN1 M10768 [1,1,0,0,0,0|2,0,0]=4 279 B11R1.878 COC(=O)[C@]1(O)CCCNC1 M37711 [1,1,0,0,0,0|1,0,0]=3 280 B11R1.900 CCOCC1(O)CCNCC1 E15616 [1,1,0,0,0,0|1,0,1]=4 281 B11R1.15 CCOC(=O)N1CCC(=O)C1 E1177 [0,1,0,0,1,0|1,0,1]=4 282 B11R1.15 CCOC(=O)[C@@H]1CCC(=O)N1 P69422 [0,1,0,0,1,0|1,0,1]=4 283 B11R1.15 CCOC(=O)[C@@H]1CNC(=O)C1 E43778 [0,1,0,0,1,0|1,0,1]=4 284 B11R1.15 CCOC(=O)[C@@H]1C[C@@H](O)CN1 E62122 [0,1,0,0,1,0|1,0,0]=3 285 B11R1.15 CCOC(=O)[C@H]1CCC(=O)C1 E11055 [0,1,0,0,1,0|0,0,1]=3 286 B11R1.15 CCOC(=O)[C@H]1CCC(=O)N1 E38583 [0,1,0,0,1,0|1,0,1]=4 287 B11R1.15 CCOC(=O)[C@H]1C[C@H](F)CN1 E10905 [0,1,0,0,1,0|1,0,0]=3 288 B11R1.199 CCOC(=O)C1CCCC1N E49570 [0,1,0,0,1,0|0,0,0]=2 289 B11R1.199 CCOC(=O)[C@@H]1CCC[C@@H]1N E63697 [0,1,0,0,1,0|0,0,0]=2 290 B11R1.199 CCOC(=O)[C@@H]1CCNC1=O X13453 [0,1,0,0,1,0|1,0,1]=4 291 B11R1.199 CCOC(=O)[C@@H]1CCOC1=O E43734 [0,1,0,0,1,0|1,0,1]=4 292 B11R1.199 CCOC(=O)[C@@H]1CNCC1=O E38847 [0,1,0,0,1,0|1,0,1]=4 293 B11R1.199 CCOC(=O)[C@@H]1COCC1=O E43735 [0,1,0,0,1,0|1,0,1]=4 294 B11R1.199 CCOC(=O)[C@@H]1CSCC1=O E13246 [0,1,0,0,1,0|1,0,1]=4 295 B11R1.199 CCOC(=O)[C@H]1CCC[C@H]1N E69723 [0,1,0,0,1,0|0,0,0]=2 296 B13R1.19 CCOC(=O)CC1CCC(=O)CC1 E24374 [0,1,0,0,0,1|0,0,1]=3 297 B13R1.19 CCOC(=O)C[C@H]1CC[C@H](N)CC1 E25275 [0,1,0,0,0,1|0,0,0]=2 298 B13R1.19 CCOC(=O)C[C@H]1CC[C@H](N)CC1 E53290 [0,1,0,0,0,1|0,0,0]=2 299 B13R1.19 CCOC(=O)C[C@H]1CC[C@H](O)CC1 E67160 [0,1,0,0,0,1|0,0,0]=2 300 B13R1.20 CCOC(=O)CC1CCNC(C)C1 X30145 [0,1,0,0,0,1|1,0,0]=3 301 B13R1.47 CCOC(=O)[C@@H](N)C1CCOCC1 E15546 [0,1,0,0,0,1|1,0,0]=3 302 B13R1.348 C[C@H](Cl)OC(=O)OC1CCCCC1 C39552 [0,1,0,0,0,1|0,0,0]=2 303 B13R1.470 CCOC(=O)CC1CCNCC1C E20779 [0,1,0,0,0,1|1,0,0]=3 304 B13R1.2570 CCOC(=O)CC1(O)CCCCC1 E53277 [0,1,0,0,0,1|0,0,0]=2 305 B13R1.463 CCOC(=O)[C@@H]1CCNCCC1=O E52197 [0,1,0,0,0,1|0,0,1]=3 306 B13R1.463 CCOC(=O)[C@@H]1CCSCCC1=O E10055 [0,1,0,0,0,1|0,0,1]=3 307 B13R1.132 CC(C)OC(=O)N1CCC(O)CC1 P50542 [0,2,0,0,0,0|1,0,0]=3 308 B13R1.452 CCOC(=O)C1CCC(CN)CC1 E54214 [0,2,0,0,0,0|0,0,0]=2 309 B13R1.452 CCOC(=O)C1CCC(CO)CC1 E53278 [0,2,0,0,0,0|0,0,0]=2 310 B13R1.452 CCOC(=O)N1CCC(CO)CC1 E62445 [0,2,0,0,0,0|1,0,0]=3 311 B13R1.466 CCOC(=O)N1CC[C@@H](N)[C@@H](O)C1 A25588 [0,2,0,0,0,0|1,0,0]=3 312 B13R1.466 CCOC(=O)[C@@H]1CC[C@@H](O)[C@@H](N)C1 A13800 [0,2,0,0,0,0|0,0,0]=2 313 B13R1.466 CCOC(=O)[C@@H]1CC[C@H](O)[C@@H](N)C1 A13799 [0,2,0,0,0,0|0,0,0]=2 314 B13R1.466 CCOC(=O)[C@H]1CC[C@@H](O)[C@H](F)C1 E60312 [0,2,0,0,0,0|0,0,0]=2 315 B13R1.466 CCOC(=O)[C@H]1CC[C@@H](O)[C@H](N)C1 A13798 [0,2,0,0,0,0|0,0,0]=2 316 B13R1.1512 CCOC(=O)C1CCC(F)(F)CC1 E14121 [0,2,0,0,0,0|0,0,0]=2 317 B13R1.1512 CCOC(=O)C1COC(C)(C)OC1 E25552 [0,2,0,0,0,0|2,0,0]=4 318 B13R1.1512 CCOC(=O)[C@H]1CC[C@](C)(O)CC1 C23270 [0,2,0,0,0,0|0,0,0]=2 319 B13R1.4446 CCOC(=O)C1(C)CCC(=O)CC1 E29671 [0,2,0,0,0,0|0,0,1]=3 320 B13R1.24 CCCCOC(=O)N1CCNCC1 B50570 [0,2,0,0,0,0|2,0,0]=4 321 B13R1.352 CC(C)(C)OC(=O)C1CCNCC1 P37700 [0,2,0,0,0,0|1,0,0]=3 322 B13R1.352 CC(C)(C)OC(=O)C1CCNCC1 P38516 [0,2,0,0,0,0|1,0,0]=3 323 B13R1.352 CC(C)(C)OC(=O)N1CCCCC1 P1581 [0,2,0,0,0,0|1,0,0]=3 324 B13R1.352 CC(C)(C)OC(=O)N1CCCNC1 T38825 [0,2,0,0,0,0|2,0,0]=4 325 B13R1.352 CC(C)(C)OC(=O)N1CCNCC1 B39586 [0,2,0,0,0,0|2,0,0]=4 326 B13R1.352 CC(C)(C)OC(=O)N1CCNCC1 B4704 [0,2,0,0,0,0|2,0,0]=4 327 B13R1.352 CC(C)(C)OC(=O)N1CCOCC1 B50538 [0,2,0,0,0,0|2,0,0]=4 328 B13R1.352 CC(C)(C)OC(=O)[C@@H]1CCCCN1 B54212 [0,2,0,0,0,0|1,0,0]=3 329 B13R1.4472 CCOC(=O)C1(C#N)CCNCC1 E32324 [0,2,0,0,0,0|1,0,0]=3 330 B13R1.4472 CCOC(=O)C1(C#N)CCOCC1 E8164 [0,2,0,0,0,0|1,0,0]=3 331 B11R1.30 CCOC(=O)C[C@H]1CCCO1 E47100 [0,0,1,1,0,0|1,0,0]=3 332 B11R1.30 CCOC(=O)C[C@H]1CCNC1 E15030 [0,0,1,1,0,0|1,0,0]=3 333 B11R1.112 CCOC(=O)[C@@H]1C[C@@H]1CC#N E29955 [0,0,1,1,0,0|1,0,1]=4 334 B11R1.112 CCOC(=O)[C@@H]1C[C@H]1CC#N E29954 [0,0,1,1,0,0|1,0,1]=4 335 B11R1.351 CCOC(=O)C(=O)CC1CC1 C2015 [0,0,1,1,0,0|1,0,1]=4 336 B11R1.831 CCOC(=O)C1(C#N)CCC1 E46927 [0,0,1,1,0,0|1,0,1]=4 337 B11R1.831 CCOC(=O)C1(CO)CCC1 E61939 [0,0,1,1,0,0|1,0,0]=3 338 B11R2.1 O=C1CC[C@@H]2CNCCN12 H10647 [1,0,0,1,0,0|2,0,0]=4 339 B11R2.1 O=C1CC[C@@H]2CNCCN12 H31039 [1,0,0,1,0,0|2,0,0]=4 340 B11R2.1 O=C1CC[C@H]2CNCCN12 H10646 [1,0,0,1,0,0|2,0,0]=4 341 B11R2.1 O=C1CC[C@H]2CNCCN12 X17072 [1,0,0,1,0,0|2,0,0]=4 342 B11R2.1 O=C1NC[C@@H]2CCNC[C@H]12 O1562 [1,0,0,1,0,0|2,0,0]=4 343 B11R2.1 O=C1NC[C@H]2CCNC[C@@H]12 X14209 [1,0,0,1,0,0|2,0,0]=4 344 B11R2.1 O=C1OC[C@@H]2CNCCN12 H13025 [1,0,0,1,0,0|2,0,0]=4 345 B11R2.1 O=C1OC[C@H]2CNCCN12 H8753 [1,0,0,1,0,0|2,0,0]=4 346 B11R2.12 O=C1NCC12CCNCC2 D13655 [1,0,0,1,0,0|2,0,0]=4 347 B11R2.12 O=C1NCC12CCNCC2 D30159 [1,0,0,1,0,0|2,0,0]=4 348 B11R2.895 COC(=O)C12CNCC1C2 M20319 [1,0,0,1,0,0|1,0,0]=3 349 B11R2.905 COC(=O)[C@@H]1[C@H]2CNC[C@H]21 M13240 [1,0,0,1,0,0|1,0,0]=3 350 B11R2.911 COC(=O)[C@H]1NC[C@@H]2CC12 A15435 [1,0,0,1,0,0|1,0,0]=3 351 B11R2.911 COC(=O)[C@H]1NC[C@H]2C[C@H]21 A8246 [1,0,0,1,0,0|1,0,0]=3 352 B11R2.914 COC(=O)C1CC2OC2C1 M13555 [1,0,0,1,0,0|1,0,0]=3 353 B11R2.914 COC(=O)C1C[C@@H]2O[C@@H]2C1 M29970 [1,0,0,1,0,0|1,0,0]=3 354 B11R2.20 C1CCC2NCCCC2C1 D68891 [1,0,0,1,0,0|2,0,0]=4 355 B11R2.1261 C1CC2(CCN1)CCOC2 X20506 [1,0,0,1,0,0|1,0,1]=4 356 B11R2.1261 C1CC2(CCN1)CCOC2 X30086 [1,0,0,1,0,0|1,0,1]=4 357 B11R2.1261 C1CCC2(CC1)CCNC2 A14069 [1,0,0,1,0,0|1,0,1]=4 358 B11R2.1261 C1CNC[C@@]2(C1)CCOC2 X23357 [1,0,0,1,0,0|1,0,1]=4 359 B11R2.3 O=C1NCC[C@]12CCNC2 D10776 [0,0,0,1,1,0|2,0,0]=4 360 B11R2.3 O=C1NCC[C@]12CCNC2 D37515 [0,0,0,1,1,0|2,0,0]=4 361 B11R2.202 O=C1OC(=O)C2CCCC12 T65030 [0,0,0,1,1,0|1,0,1]=4 362 B13R2.15 O=C1CCCN1C2CCNCC2 P52198 [0,0,0,1,0,1|2,0,0]=4 363 B13R2.11128 O=C1CC2(CCNCC2)CCN1 D55427 [0,0,0,1,0,1|2,0,0]=4 364 B13R2.11128 O=C1CCCC2(CCNCC2)N1 D13940 [0,0,0,1,0,1|2,0,0]=4 365 B13R2.11128 O=C1CCCC2(CCNCC2)N1 D16941 [0,0,0,1,0,1|2,0,0]=4 366 B13R2.11128 O=C1NC2(CCNCC2)CCO1 X7222 [0,0,0,1,0,1|1,0,0]=3 367 B13R2.11128 O=C1NCCC2(CCNCC2)O1 X49556 [0,0,0,1,0,1|2,0,0]=4 368 B13R2.11128 O=C1N[C@@]2(CCCNC2)CCO1 X7224 [0,0,0,1,0,1|1,0,0]=3 369 B13R2.844 CCOC(=O)[C@@H]1CC[C@@H]2O[C@@H]2C1 X11081 [0,0,0,1,0,1|0,0,0]=2 370 B13R2.844 CCOC(=O)[C@H]1CC[C@H]2O[C@H]2C1 X13796 [0,0,0,1,0,1|0,0,0]=2 371 B13R2.822 CCOC(=O)C1C2CCC(=O)C21 E37086 [0,1,0,1,0,0|0,0,1]=3 372 B13R2.822 CCOC(=O)[C@@H]1[C@H]2CCC(=O)[C@H]21 E69707 [0,1,0,1,0,0|0,0,1]=3 373 B13R2.856 CCOC(=O)C1CC2CCC1N2 A19972 [0,1,0,1,0,0|0,0,0]=2 374 B13R2.856 CCOC(=O)[C@H]1CC2CCC1N2 A6547 [0,1,0,1,0,0|0,0,0]=2 375 B13R2.856 CCOC(=O)[C@H]1N[C@@H]2CC[C@H]1C2 E66622 [0,1,0,1,0,0|1,0,0]=3 376 B13R2.14 O=C1NCCCC12CCNCC2 D15309 [0,1,0,1,0,0|2,0,0]=4 377 B13R2.59 CN1CNC(=O)C12CCNCC2 M14207 [0,1,0,1,0,0|2,0,0]=4 378 B13R2.59 CN1CNC(=O)[C@@]12CCCNC2 M14205 [0,1,0,1,0,0|2,0,0]=4 379 B9R1.11 CNC(=O)[C@@H]1CCCN1 M43471 [1,0,0,0,1,0|2,0,0]=4 380 B9R1.11 COC(=O)C1=CCCC1 M43720 [1,0,0,0,1,0|0,0,2]=4 381 B9R1.11 COC(=O)C1CC=CC1 M13554 [1,0,0,0,1,0|0,0,2]=4 382 B9R1.11 COC(=O)C1CCCC1 M43805 [1,0,0,0,1,0|0,0,0]=2 383 B9R1.11 COC(=O)[C@@H]1CCCN1 M38491 [1,0,0,0,1,0|1,0,0]=3 384 B9R1.11 COC(=O)[C@@H]1CCNC1 M20211 [1,0,0,0,1,0|1,0,0]=3 385 B9R1.11 COC(=O)[C@@H]1CCNC1 M25987 [1,0,0,0,1,0|1,0,0]=3 386 B9R1.11 COC(=O)[C@@H]1CCOC1 M10323 [1,0,0,0,1,0|1,0,0]=3 387 B9R1.11 COC(=O)[C@H]1CCNC1 E6960 [1,0,0,0,1,0|1,0,0]=3 388 B9R1.11 COC(=O)[C@H]1CCNC1 M10274 [1,0,0,0,1,0|1,0,0]=3 389 B9R1.11 COC(=O)[C@H]1CCNC1 M20204 [1,0,0,0,1,0|1,0,0]=3 390 B9R1.11 COC(=O)[C@H]1CCNC1 P12312 [1,0,0,0,1,0|1,0,0]=3 391 B9R1.11 COC(=O)[C@H]1CCOC1 M12450 [1,0,0,0,1,0|1,0,0]=3 392 B9R1.11 COC(=O)[C@H]1CCOC1 M7564 [1,0,0,0,1,0|1,0,0]=3 393 B9R1.73 CCOC(=N)C1CCC1 E64744 [0,0,0,0,2,0|1,0,0]=3 394 B9R1.73 CCOC(=O)C1CNC1 E0677 [0,0,0,0,2,0|1,0,0]=3 395 B11R1.852 COC(=O)[C@H]1CCCNCC1 M15039 [1,0,0,0,0,1|0,0,0]=2 396 B13R1.42 CCOC(=O)CO[C@@H]1CCCCO1 E50521 [0,0,0,0,0,2|1,0,0]=3