@MOLECULE triphosphoric acid, mono[2-[(2-amino-3,6-dihydro-6-oxo-9h-purin-9-yl)methoxy]-3-hydroxypropyl] ester 46 47 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 C -4.4029 0.1546 -0.2651 C.ar 1 UNL1 0.3402 2 C -4.9672 1.1836 0.5659 C.ar 1 UNL1 -0.2853 3 N -5.0542 -0.9637 -0.6490 N.ar 1 UNL1 -0.5865 4 P 4.5745 1.0660 -0.6097 P.3 1 UNL1 0.4070 5 N -3.1331 0.6075 -0.6090 N.ar 1 UNL1 -0.3571 6 N -6.9849 -0.1070 0.6373 N.ar 1 UNL1 -0.5693 7 N -4.0272 2.2001 0.7632 N.ar 1 UNL1 -0.3417 8 C -6.2921 0.9841 1.0011 C.ar 1 UNL1 0.5299 9 C -6.3440 -1.0282 -0.1747 C.ar 1 UNL1 0.5657 10 P 4.3093 -1.1431 1.4675 P.3 1 UNL1 0.3971 11 P 1.5493 1.3227 -0.6098 P.3 1 UNL1 0.3890 12 O 4.6921 0.1779 0.6869 O.3 1 UNL1 -0.2166 13 O 3.0906 1.6316 -0.7027 O.3 1 UNL1 -0.1871 14 C -2.9416 1.8392 0.0966 C.ar 1 UNL1 0.1702 15 C -2.0576 -0.2123 -1.1257 C.3 1 UNL1 0.1536 16 O 4.7997 0.1679 -1.8899 O.3 1 UNL1 -0.3282 17 O 5.4526 2.2081 -0.5074 O.2 1 UNL1 -0.1254 18 O 4.2629 -2.2885 0.3468 O.3 1 UNL1 -0.4337 19 O 2.7896 -1.0369 1.8741 O.3 1 UNL1 -0.3219 20 O 1.1377 1.8263 0.8330 O.3 1 UNL1 -0.2976 21 O 1.6208 -0.2866 -0.4374 O.3 1 UNL1 -0.4033 22 O 5.2277 -1.2869 2.5776 O.2 1 UNL1 -0.2172 23 O 0.7537 1.9080 -1.6674 O.2 1 UNL1 -0.2204 24 O -6.9459 1.8453 1.7929 O.3 1 UNL1 -0.3851 25 N -7.0793 -2.1225 -0.5286 N.pl3 1 UNL1 -0.5661 26 O -1.3513 -0.5537 0.0630 O.3 1 UNL1 -0.4329 27 C 0.7391 -1.2433 -1.0164 C.3 1 UNL1 -0.0208 28 C -0.3907 -1.5718 -0.0258 C.3 1 UNL1 0.0732 29 O -0.9217 -3.0716 -1.7651 O.3 1 UNL1 -0.5697 30 C -1.0422 -2.9243 -0.3593 C.3 1 UNL1 -0.0661 31 H -2.0067 2.3830 0.0298 H 1 UNL1 0.2167 32 H -1.4060 0.3943 -1.7945 H 1 UNL1 0.1605 33 H -2.4448 -1.1190 -1.6410 H 1 UNL1 0.1614 34 H 4.1583 -0.6350 -1.8534 H 1 UNL1 0.3255 35 H 5.1368 -2.8069 0.3536 H 1 UNL1 0.3222 36 H 2.2102 -0.9670 1.0144 H 1 UNL1 0.3435 37 H 1.7090 1.3348 1.5395 H 1 UNL1 0.3275 38 H -6.3423 2.6242 2.0101 H 1 UNL1 0.3543 39 H -6.6895 -2.8151 -1.1333 H 1 UNL1 0.3232 40 H -8.0283 -2.2079 -0.2189 H 1 UNL1 0.3300 41 H 1.4231 -2.1145 -1.1402 H 1 UNL1 0.1439 42 H 0.3517 -0.9760 -2.0166 H 1 UNL1 0.1444 43 H -0.0138 -1.5727 1.0318 H 1 UNL1 0.1627 44 H -1.4062 -3.8590 -2.0763 H 1 UNL1 0.3225 45 H -2.1109 -2.9336 -0.0726 H 1 UNL1 0.1449 46 H -0.5180 -3.7622 0.1308 H 1 UNL1 0.1227 @BOND 1 44 29 1 2 42 27 1 3 16 34 1 4 16 4 1 5 32 15 1 6 29 30 1 7 23 11 2 8 33 15 1 9 41 27 1 10 39 25 1 11 15 5 1 12 15 26 1 13 27 21 1 14 27 28 1 15 13 11 1 16 13 4 1 17 3 1 ar 18 3 9 ar 19 11 21 1 20 11 20 1 21 4 17 2 22 4 12 1 23 5 1 ar 24 5 14 ar 25 25 40 1 26 25 9 1 27 30 45 1 28 30 28 1 29 30 46 1 30 1 2 ar 31 9 6 ar 32 28 26 1 33 28 43 1 34 31 14 1 35 14 7 ar 36 18 35 1 37 18 10 1 38 2 7 ar 39 2 8 ar 40 6 8 ar 41 12 10 1 42 20 37 1 43 8 24 1 44 36 19 1 45 10 19 1 46 10 22 2 47 24 38 1