@MOLECULE triphosphoric acid, mono[[(2r,5s)-5-(6-amino-9h-purin-9-yl)tetrahydro-2-furanyl]methyl] ester 45 47 0 0 0 SMALL GASTEIGER @ATOM 1 P -2.4392 2.1041 0.4253 P.3 1 UNL11 0.3796 2 P -3.0955 -0.6020 -0.8185 P.3 1 UNL11 0.3953 3 P -1.0424 -2.0755 0.9611 P.3 1 UNL11 0.3763 4 O 2.2279 2.4501 -1.2202 O.3 1 UNL11 -0.3727 5 O -1.1131 2.4546 -0.3783 O.3 1 UNL11 -0.2950 6 O -3.1744 0.8827 -0.2818 O.3 1 UNL11 -0.1514 7 O -2.0713 1.7210 1.9135 O.3 1 UNL11 -0.3366 8 O -3.3662 3.2139 0.2986 O.2 1 UNL11 -0.1630 9 O -1.9405 -1.0851 0.1501 O.3 1 UNL11 -0.3131 10 O -2.3940 -0.5879 -2.2395 O.3 1 UNL11 -0.3161 11 O -4.4005 -1.2215 -0.8322 O.2 1 UNL11 -0.1843 12 O -1.9116 -2.5924 2.1824 O.3 1 UNL11 -0.2854 13 O -0.8823 -3.3924 0.0876 O.3 1 UNL11 -0.3788 14 O 0.1268 -1.3293 1.4075 O.2 1 UNL11 -0.2807 15 N 3.4859 0.8351 -0.0904 N.ar 1 UNL11 -0.3934 16 N 3.9303 -0.9969 1.1989 N.ar 1 UNL11 -0.3246 17 N 2.1238 -0.2945 -1.8529 N.ar 1 UNL11 -0.4856 18 N 1.7295 -2.6318 -1.3593 N.ar 1 UNL11 -0.6035 19 N 2.6877 -3.7553 0.4603 N.pl3 1 UNL11 -0.5410 20 C 3.4047 2.2540 -0.4960 C.3 1 UNL11 0.3004 21 C 1.1699 2.9262 -0.3704 C.3 1 UNL11 0.0804 22 C 3.3270 3.2023 0.7188 C.3 1 UNL11 -0.3353 23 C 1.8145 3.3448 0.9616 C.3 1 UNL11 -0.3124 24 C 0.1467 1.7777 -0.2614 C.3 1 UNL11 -0.0536 25 C 2.8581 -0.2362 -0.7072 C.ar 1 UNL11 0.3056 26 C 4.1209 0.3131 1.0692 C.ar 1 UNL11 0.1092 27 C 3.1340 -1.3774 0.1249 C.ar 1 UNL11 -0.1943 28 C 2.5152 -2.5997 -0.2409 C.ar 1 UNL11 0.4805 29 C 1.5952 -1.5026 -2.1078 C.ar 1 UNL11 0.2850 30 H 4.2258 2.4588 -1.2268 H 1 UNL11 0.1598 31 H 0.7491 3.7851 -0.9398 H 1 UNL11 0.1588 32 H 3.8681 2.8466 1.6069 H 1 UNL11 0.1551 33 H 3.7807 4.1753 0.4534 H 1 UNL11 0.1617 34 H 1.4785 2.6991 1.7932 H 1 UNL11 0.1627 35 H 1.5359 4.3715 1.2489 H 1 UNL11 0.1561 36 H 0.3096 1.1697 0.6468 H 1 UNL11 0.1436 37 H 0.2356 1.1201 -1.1574 H 1 UNL11 0.1598 38 H 4.7036 0.9310 1.7324 H 1 UNL11 0.1921 39 H 0.9758 -1.5942 -3.0176 H 1 UNL11 0.1982 40 H 3.0920 -3.7058 1.3796 H 1 UNL11 0.3238 41 H 2.1197 -4.5536 0.2452 H 1 UNL11 0.3156 42 H -1.5882 0.8132 1.9255 H 1 UNL11 0.3400 43 H -1.4431 -0.2091 -2.1470 H 1 UNL11 0.3179 44 H -2.7531 -3.0668 1.8166 H 1 UNL11 0.3151 45 H -0.1602 -3.2249 -0.6330 H 1 UNL11 0.3481 @BOND 1 1 5 1 2 1 6 1 3 1 7 1 4 1 8 2 5 2 6 1 6 2 9 1 7 2 10 1 8 2 11 2 9 3 9 1 10 3 12 1 11 3 13 1 12 3 14 2 13 4 20 1 14 4 21 1 15 5 24 1 16 7 42 1 17 10 43 1 18 12 44 1 19 13 45 1 20 15 20 1 21 15 25 ar 22 15 26 ar 23 16 26 ar 24 16 27 ar 25 17 25 ar 26 17 29 ar 27 18 28 ar 28 18 29 ar 29 19 28 1 30 19 40 1 31 19 41 1 32 20 22 1 33 20 30 1 34 21 23 1 35 21 24 1 36 21 31 1 37 22 23 1 38 22 32 1 39 22 33 1 40 23 34 1 41 23 35 1 42 24 36 1 43 24 37 1 44 25 27 ar 45 26 38 1 46 27 28 ar 47 29 39 1