0 B12R0.5 CCCCCCCCCCCCN Amb22366429 [0,0,0,0,0,0|4,0,0]=4 1 B12R0.5 CCCCCCCCCCCC[15NH2] Amb22362752 [0,0,0,0,0,0|4,0,0]=4 2 B12R0.5 CCCCCCNCCCCCC Amb22350699 [0,0,0,0,0,0|4,0,0]=4 3 B12R0.5 CCCCCCNCCCCCC Amb22359816 [0,0,0,0,0,0|4,0,0]=4 4 B12R0.5 NCCCCCCCCCCCN Amb16233911 [0,0,0,0,0,0|3,0,0]=3 5 B12R0.5 NCCCCCCCCCCCS Amb22336989 [0,0,0,0,0,0|4,0,0]=4 6 B12R0.5 NCCNCCCCCNCCN Amb24184153 [0,0,0,0,0,0|1,0,0]=1 7 B12R0.5 NCCNCCNCCNCCN Amb22167349 [0,0,0,0,0,0|0,0,0]=0 8 B12R0.5 NCCOCCOCCOCCN Amb2583289 [0,0,0,0,0,0|3,0,0]=3 9 B12R0.5 NCCOCCOCCOCCO Amb10604926 [0,0,0,0,0,0|4,0,0]=4 10 B12R0.5 OCCNCCCCCNCCO Amb24080936 [0,0,0,0,0,0|3,0,0]=3 11 B11R0.3 CCCCCCCCNCCN Amb18794624 [1,0,0,0,0,0|2,0,0]=3 12 B11R0.3 CCCCCCCCNCCN Amb22358941 [1,0,0,0,0,0|2,0,0]=3 13 B11R0.3 CCCCCSCCOCCN Amb17501985 [1,0,0,0,0,0|3,0,0]=4 14 B11R0.3 CCCNCCCCNCCC Amb18803293 [1,0,0,0,0,0|2,0,0]=3 15 B11R0.3 CCCNCCNCCCOC Amb18804248 [1,0,0,0,0,0|3,0,0]=4 16 B11R0.3 NCCCCCCCCCCBr Amb17609917 [1,0,0,0,0,0|3,0,0]=4 17 B11R0.3 NCCCCCCCCCCN Amb22732919 [1,0,0,0,0,0|2,0,0]=3 18 B11R0.3 NCCCCCCCCCCO Amb17607975 [1,0,0,0,0,0|3,0,0]=4 19 B11R0.3 NCCNCCCCNCCN Amb22365939 [1,0,0,0,0,0|0,0,0]=1 20 B13R0.336 CCCCCCCCCCNCCN Amb18333779 [0,1,0,0,0,0|3,0,0]=4 21 B13R0.336 CCCNCCCCCCNCCC Amb22346014 [0,1,0,0,0,0|3,0,0]=4 22 B13R0.336 CCCNCCNCCCCCCC Amb20140560 [0,1,0,0,0,0|3,0,0]=4 23 B13R0.336 NCCCNCCCCNCCCN Amb20671224 [0,1,0,0,0,0|3,0,0]=4 24 B13R0.336 NCCCNCCCNCCCCN Amb23399719 [0,1,0,0,0,0|3,0,0]=4 25 B13R1.28 CCCNCCNC1CCCCC1 Amb19075077 [0,0,0,1,0,0|3,0,0]=4 26 B13R1.28 CCCSCCNC1CNCCC1 Amb19600980 [0,0,0,1,0,0|3,0,0]=4 27 B13R1.28 NCCNCCCC1CCCCC1 Amb18104941 [0,0,0,1,0,0|3,0,0]=4 28 B13R1.119 CCCNCCNCC1CCCO1 Amb19076056 [0,0,0,1,0,0|3,0,0]=4 29 B13R1.207 NCCN1CCCCCCC1CN Amb25063397 [0,0,0,1,0,0|2,0,0]=3 30 B13R1.279 CC1CNCCNCCNCCN1 Amb25684256 [0,0,0,1,0,0|1,0,0]=2 31 B13R1.555 CC1CSCCN1CCOCCN Amb24769047 [0,0,0,1,0,0|3,0,0]=4 32 B13R1.555 CCCCCCN1CCNCC1C Amb18326616 [0,0,0,1,0,0|3,0,0]=4 33 B13R1.555 CCCNCCN1CCCCC1C Amb18318953 [0,0,0,1,0,0|3,0,0]=4 34 B13R1.1887 CCCNCCN1CCCCCC1 Amb17234129 [0,0,0,1,0,0|3,0,0]=4 35 B13R1.1887 ClCCNCCN1CCCCCC1 Amb20414386 [0,0,0,1,0,0|3,0,0]=4 36 B13R1.1887 NCCNCCN1CCCCCC1 Amb20573224 [0,0,0,1,0,0|2,0,0]=3 37 B13R1.1887 NCCOCCN1CCNCCC1 Amb17479021 [0,0,0,1,0,0|2,0,0]=3 38 B13R1.1887 OCCNCCN1CCCCCC1 Amb20573591 [0,0,0,1,0,0|3,0,0]=4 39 B13R1.2883 C1CCCCNCCCCCCN1 Amb25805167 [0,0,0,1,0,0|3,0,0]=4 40 B13R1.2883 C1CCNCCNCCOCCN1 Amb25301224 [0,0,0,1,0,0|2,0,0]=3 41 B13R1.2883 C1CNCCCCCCNCCN1 Amb21953148 [0,0,0,1,0,0|2,0,0]=3 42 B13R1.2883 C1CNCCCCCNCCCN1 Amb24364784 [0,0,0,1,0,0|2,0,0]=3 43 B13R1.2883 C1NCCNCCNCCNCC1 Amb10808112 [0,0,0,1,0,0|1,0,0]=2 44 B10R0.71 CCCCCCNCCCN Amb17315272 [2,0,0,0,0,0|2,0,0]=4 45 B10R0.71 CCCCCNCCCCC Amb22359459 [2,0,0,0,0,0|2,0,0]=4 46 B10R0.71 CCCCCNCCCCC Amb22366791 [2,0,0,0,0,0|2,0,0]=4 47 B10R0.71 CCCCCSCCCCN Amb17500943 [2,0,0,0,0,0|2,0,0]=4 48 B10R0.71 CCCCNCCCCCO Amb17334477 [2,0,0,0,0,0|2,0,0]=4 49 B10R0.71 CCCCSCCOCCN Amb17501984 [2,0,0,0,0,0|2,0,0]=4 50 B10R0.71 CCCNCCNCCCC Amb18800035 [2,0,0,0,0,0|1,0,0]=3 51 B10R0.71 CCCNCCNCCOC Amb18797900 [2,0,0,0,0,0|2,0,0]=4 52 B10R0.71 CCNCCNCCCOC Amb18797907 [2,0,0,0,0,0|2,0,0]=4 53 B10R0.71 NCCCCNCCCCN Amb22055385 [2,0,0,0,0,0|0,0,0]=2 54 B10R0.71 NCCNCCCNCCN Amb10068689 [2,0,0,0,0,0|0,0,0]=2 55 B10R0.71 NCCNCCNCCC#N Amb22367952 [2,0,0,0,0,0|0,0,2]=4 56 B10R0.71 NCCNCCNCCCN Amb24184062 [2,0,0,0,0,0|0,0,0]=2 57 B10R0.71 NCCSCCCSCCN Amb21953251 [2,0,0,0,0,0|2,0,0]=4 58 B10R0.71 NCCSCCCSCCN Amb21953300 [2,0,0,0,0,0|2,0,0]=4 59 B10R0.71 OCCCCNCCCCO Amb21858890 [2,0,0,0,0,0|2,0,0]=4 60 B10R0.71 OCCNCCCNCCO Amb21858029 [2,0,0,0,0,0|2,0,0]=4 61 B12R0.206 NCCNCCNC(=O)CCCO Amb24073381 [1,1,0,0,0,0|1,0,1]=4 62 B12R0.234 CC(=O)NCCNCCNCCN Amb24073038 [1,1,0,0,0,0|0,0,1]=3 63 B12R1.8 CCCNCCN1CCCCC1 Amb17232778 [1,0,0,1,0,0|2,0,0]=4 64 B12R1.8 CCNCCCC1CCCCN1 Amb18806805 [1,0,0,1,0,0|2,0,0]=4 65 B12R1.8 CCNCCCC1CNCCC1 Amb18802058 [1,0,0,1,0,0|2,0,0]=4 66 B12R1.8 ClCCNCCN1CCCCC1 Amb20573237 [1,0,0,1,0,0|2,0,0]=4 67 B12R1.8 ClCCNCCN1CCOCC1 Amb17336538 [1,0,0,1,0,0|2,0,0]=4 68 B12R1.8 NCCCCCN1CCNCC1 Amb22756848 [1,0,0,1,0,0|1,0,0]=3 69 B12R1.8 NCCCCCN1CCOCC1 Amb13949080 [1,0,0,1,0,0|2,0,0]=4 70 B12R1.8 NCCCCCN1CCSCC1 Amb19060232 [1,0,0,1,0,0|2,0,0]=4 71 B12R1.8 NCCNCCN1CCCCC1 Amb20573497 [1,0,0,1,0,0|1,0,0]=3 72 B12R1.8 NCCNCCN1CCNCC1 Amb18647689 [1,0,0,1,0,0|0,0,0]=2 73 B12R1.8 NCCNCCN1CCOCC1 Amb18795063 [1,0,0,1,0,0|1,0,0]=3 74 B12R1.8 NCCOCCN1CCCCC1 Amb17138694 [1,0,0,1,0,0|2,0,0]=4 75 B12R1.8 NCCOCCN1CCNCC1 Amb17478997 [1,0,0,1,0,0|1,0,0]=3 76 B12R1.8 NCCOCCN1CCOCC1 Amb17138729 [1,0,0,1,0,0|2,0,0]=4 77 B12R1.8 OCCNCCN1CCCCC1 Amb18807488 [1,0,0,1,0,0|2,0,0]=4 78 B12R1.8 OCCOCCC1CNCCN1 Amb24089704 [1,0,0,1,0,0|2,0,0]=4 79 B12R1.8 OCCOCCN1CCNCC1 Amb20621403 [1,0,0,1,0,0|2,0,0]=4 80 B12R1.18 CC1CCCCCC1NCCN Amb24725700 [1,0,0,1,0,0|2,0,0]=4 81 B12R1.18 CCCCC1NCCCCC1N Amb25766465 [1,0,0,1,0,0|2,0,0]=4 82 B12R1.18 CCNCC1CCCCCC1N Amb25830871 [1,0,0,1,0,0|2,0,0]=4 83 B12R1.18 NCCNC1CCCCCC1O Amb18986525 [1,0,0,1,0,0|2,0,0]=4 84 B12R1.37 CCNCCNCC1CCCO1 Amb18807526 [1,0,0,1,0,0|2,0,0]=4 85 B12R1.45 CCN1CCCC1CNCCN Amb23570922 [1,0,0,1,0,0|1,0,0]=3 86 B12R1.45 NCCCCN1CCCC1CO Amb18789797 [1,0,0,1,0,0|2,0,0]=4 87 B12R1.173 C=CCN1CCNCCNCC1 Amb25187380 [1,0,0,1,0,0|1,0,1]=4 88 B12R1.173 N#CCN1CCNCCNCC1 Amb25139600 [1,0,0,1,0,0|0,0,2]=4 89 B12R1.173 NCCN1CCCCCCCC1 Amb24365183 [1,0,0,1,0,0|2,0,0]=4 90 B12R1.173 NCCN1CCNCCNCC1 Amb24697529 [1,0,0,1,0,0|0,0,0]=2 91 B12R1.173 OCCN1CCSCCNCC1 Amb21953507 [1,0,0,1,0,0|2,0,0]=4 92 B12R1.173 SCCN1CCSCCNCC1 Amb21953508 [1,0,0,1,0,0|2,0,0]=4 93 B12R1.267 CC1CNCCN1CCCCF Amb19890731 [1,0,0,1,0,0|2,0,0]=4 94 B12R1.267 CCCCCN1CCNCC1C Amb17232790 [1,0,0,1,0,0|2,0,0]=4 95 B12R1.267 CCNCCN1CCCCC1C Amb19024685 [1,0,0,1,0,0|2,0,0]=4 96 B12R1.267 CCOCCN1CCNCC1C Amb19028068 [1,0,0,1,0,0|2,0,0]=4 97 B12R1.281 CCC1CCCCCN1CCN Amb25035125 [1,0,0,1,0,0|2,0,0]=4 98 B12R1.281 NCC1CCCCCN1CCF Amb25076950 [1,0,0,1,0,0|2,0,0]=4 99 B12R1.320 CCCN1CCCC1CCCN Amb23541767 [1,0,0,1,0,0|2,0,0]=4 100 B12R1.329 NCCNC1CCCCCCC1 Amb18969720 [1,0,0,1,0,0|2,0,0]=4 101 B12R1.372 CCCCCNC1CCCC1N Amb23559149 [1,0,0,1,0,0|2,0,0]=4 102 B12R1.550 C1CCCCNCCCCCN1 Amb24743503 [1,0,0,1,0,0|2,0,0]=4 103 B12R1.550 C1CCCNCCCCCCN1 Amb24532505 [1,0,0,1,0,0|2,0,0]=4 104 B12R1.550 C1CCNCCCCCCCN1 Amb24682593 [1,0,0,1,0,0|2,0,0]=4 105 B12R1.550 C1CNCCCCCNCCN1 Amb21953165 [1,0,0,1,0,0|1,0,0]=3 106 B12R1.550 C1CNCCNC=CNCCN1 Amb25802199 [1,0,0,1,0,0|0,0,2]=4 107 B12R1.550 C1CNCCNCCNCCN1 Amb20246637 [1,0,0,1,0,0|0,0,0]=2 108 B12R1.550 C1CNCCNCCNCCN1 Amb21953268 [1,0,0,1,0,0|0,0,0]=2 109 B12R1.550 C1CNCCNCCNCCN1 Amb21953651 [1,0,0,1,0,0|0,0,0]=2 110 B12R1.550 C1CNCCSCCNCCO1 Amb24424491 [1,0,0,1,0,0|2,0,0]=4 111 B12R1.550 C1CNCCSCCNCCS1 Amb21953206 [1,0,0,1,0,0|2,0,0]=4 112 B12R1.550 C1CNCCSCCNCCS1 Amb25081392 [1,0,0,1,0,0|2,0,0]=4 113 B12R1.550 C1CSCCNCCNCCS1 Amb21953199 [1,0,0,1,0,0|2,0,0]=4 114 B12R1.550 C1CSCCNCCNCCS1 Amb21953200 [1,0,0,1,0,0|2,0,0]=4 115 B12R1.1414 CCNCCN1CCCCCC1 Amb13949094 [1,0,0,1,0,0|2,0,0]=4 116 B12R1.1414 FCCCCN1CCCNCC1 Amb19890863 [1,0,0,1,0,0|2,0,0]=4 117 B12R1.1414 NCCCCN1CCCCCC1 Amb22586873 [1,0,0,1,0,0|2,0,0]=4 118 B14R1.40 CCCNCCNCCN1CCCC1 Amb20414319 [0,1,0,1,0,0|2,0,0]=4 119 B14R1.656 OCCCC1CNCCNCCNC1 Amb24658305 [0,1,0,1,0,0|2,0,0]=4 120 B14R1.882 CC1CCCCN1CCCNCCN Amb20573407 [0,1,0,1,0,0|2,0,0]=4 121 B14R1.845 NCC1CNCCNCCNCCN1 Amb25211337 [0,1,0,1,0,0|0,0,0]=2 122 B14R1.2352 CNCCNCCN1CCCCCC1 Amb20573236 [0,1,0,1,0,0|2,0,0]=4 123 B14R1.2352 NCCNCCCN1CCCCCC1 Amb20573162 [0,1,0,1,0,0|2,0,0]=4 124 B14R1.2874 C1CNCCCNCCCNCCN1 Amb24378696 [0,1,0,1,0,0|1,0,0]=3 125 B14R1.2874 C1CNCCCNCCNCCCN1 Amb21953005 [0,1,0,1,0,0|1,0,0]=3 126 B14R1.2874 C1CNCCCNCCNCCCN1 Amb21953175 [0,1,0,1,0,0|1,0,0]=3 127 B14R1.2874 C1CNCCCNCCNCCCN1 Amb21953224 [0,1,0,1,0,0|1,0,0]=3 128 B14R1.2874 C1CNCCCNCCNCCCN1 Amb21953226 [0,1,0,1,0,0|1,0,0]=3 129 B14R1.2874 C1CNCCCNCCNCCCN1 Amb21953239 [0,1,0,1,0,0|1,0,0]=3 130 B14R1.2874 C1CNCCCNCCNCCCN1 Amb21953625 [0,1,0,1,0,0|1,0,0]=3 131 B14R2.24 C[C@H]1CNCCN1C2CNCCC2 Amb24661967 [0,0,0,2,0,0|2,0,0]=4 132 B14R2.1253 C1NCCCC1N2CCCNCC2 Amb18946029 [0,0,0,2,0,0|2,0,0]=4 133 B14R2.6347 NCCN1CCNC2CC1CCC2 Amb25228143 [0,0,0,2,0,0|2,0,0]=4 134 B14R2.112 NCCN1C[C@@H]2CCCCN2CC1 Amb24470162 [0,0,0,2,0,0|2,0,0]=4 135 B14R2.50 CC1CNCCN1C[C@@H]2CCCN2 Amb24676549 [0,0,0,2,0,0|2,0,0]=4 136 B14R2.50 C[C@@H]1CNCCN1C[C@@H]2CCCN2 Amb25231437 [0,0,0,2,0,0|2,0,0]=4 137 B14R2.50 C[C@H]1CNCCN1C[C@@H]2CCCN2 Amb25286381 [0,0,0,2,0,0|2,0,0]=4 138 B14R2.83 NCC1CCCN1C[C@@H]2CCCN2 Amb25256248 [0,0,0,2,0,0|2,0,0]=4 139 B14R2.2840 C(C1CCCN1)N2CCCNCC2 Amb18957989 [0,0,0,2,0,0|2,0,0]=4 140 B14R2.2840 C([C@@H]1CCCN1)N2CCCNCC2 Amb25690542 [0,0,0,2,0,0|2,0,0]=4 141 B14R2.583 CC1CN2CCCC2CN1CCN Amb25060370 [0,0,0,2,0,0|2,0,0]=4 142 B14R2.296 C[C@H]1CNCCN1[C@@H]2CNC[C@H]2O Amb25100040 [0,0,0,2,0,0|2,0,0]=4