@MOLECULE n-[(5-hydroxy-2-pyridinyl)methyl]-9-(beta-d-glycero-pentofuranosyl)-9h-purin-6-amine 45 48 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O4* 3.4693 -0.9338 -1.2915 O.3 1 UNL1 -0.4187 2 O2* 5.5031 1.0669 0.1882 O.3 1 UNL1 -0.5444 3 O3* 5.7369 -1.3393 1.0301 O.3 1 UNL1 -0.5342 4 O5* 1.5739 -2.7645 -0.8474 O.3 1 UNL1 -0.5197 5 O -6.5269 -2.5728 -0.4585 O.3 1 UNL1 -0.4501 6 N 2.2066 0.9709 -0.9522 N.ar 1 UNL1 -0.3859 7 N 0.2449 1.6224 -1.9220 N.ar 1 UNL1 -0.3260 8 N 1.3741 0.7127 1.3847 N.ar 1 UNL1 -0.5467 9 N -2.2905 2.0176 -0.2002 N.pl3 1 UNL1 -0.4419 10 N -0.9794 1.2358 1.6058 N.ar 1 UNL1 -0.5809 11 N -5.4312 0.8305 -0.3151 N.ar 1 UNL1 -0.3283 12 C2* 4.2441 0.4981 0.4605 C.3 1 UNL1 0.0399 13 C1* 3.5567 0.4236 -0.9248 C.3 1 UNL1 0.2659 14 C3* 4.3881 -0.9829 0.9155 C.3 1 UNL1 0.0656 15 C4* 3.6827 -1.8040 -0.1802 C.3 1 UNL1 0.0112 16 C5* 2.3300 -2.3694 0.2749 C.3 1 UNL1 -0.0533 17 C 1.2552 0.9990 0.0612 C.ar 1 UNL1 0.2965 18 C 1.5199 1.3348 -2.1493 C.ar 1 UNL1 0.1408 19 C 0.0344 1.4281 -0.5581 C.ar 1 UNL1 -0.2041 20 C -1.1098 1.5525 0.2784 C.ar 1 UNL1 0.4558 21 C 0.2274 0.8553 2.0843 C.ar 1 UNL1 0.3074 22 C -3.5145 1.9953 0.6061 C.3 1 UNL1 -0.0688 23 C -4.2756 0.7096 0.3732 C.ar 1 UNL1 0.0654 24 C -3.7931 -0.5188 0.8419 C.ar 1 UNL1 -0.1405 25 C -4.5246 -1.6736 0.5760 C.ar 1 UNL1 -0.2419 26 C -6.1525 -0.2664 -0.5681 C.ar 1 UNL1 -0.0318 27 C -5.7154 -1.5384 -0.1361 C.ar 1 UNL1 0.1994 28 H2* 6.0740 1.0212 0.9905 H 1 UNL1 0.3392 29 H3* 6.2181 -1.1749 0.1842 H 1 UNL1 0.3306 30 H5* 1.4787 -1.9920 -1.4505 H 1 UNL1 0.3230 31 H -6.1537 -3.4427 -0.1672 H 1 UNL1 0.3309 32 H -2.3959 2.1300 -1.2067 H 1 UNL1 0.3397 33 H2* 3.7142 1.1326 1.2020 H 1 UNL1 0.1780 34 H1* 4.1677 0.9043 -1.7367 H 1 UNL1 0.1831 35 H3* 3.9918 -1.1609 1.9377 H 1 UNL1 0.1700 36 H4* 4.3304 -2.6010 -0.6096 H 1 UNL1 0.1695 37 H5*1 2.4525 -3.3031 0.8553 H 1 UNL1 0.1510 38 H5*2 1.7432 -1.6435 0.8668 H 1 UNL1 0.1401 39 H 2.0246 1.3742 -3.1038 H 1 UNL1 0.2041 40 H 0.2721 0.6283 3.1643 H 1 UNL1 0.1976 41 H -4.1349 2.8832 0.3204 H 1 UNL1 0.1771 42 H -3.2698 2.1089 1.6931 H 1 UNL1 0.1879 43 H -2.8582 -0.5642 1.4042 H 1 UNL1 0.1863 44 H -4.1737 -2.6445 0.9137 H 1 UNL1 0.1702 45 H -7.0874 -0.1433 -1.1231 H 1 UNL1 0.1910 @BOND 1 39 18 1 2 18 7 ar 3 18 6 ar 4 7 19 ar 5 34 13 1 6 30 4 1 7 1 13 1 8 1 15 1 9 32 9 1 10 45 26 1 11 6 13 1 12 6 17 ar 13 13 12 1 14 4 16 1 15 36 15 1 16 26 11 ar 17 26 27 ar 18 19 17 ar 19 19 20 ar 20 5 31 1 21 5 27 1 22 11 23 ar 23 9 20 1 24 9 22 1 25 15 16 1 26 15 14 1 27 27 25 ar 28 17 8 ar 29 29 3 1 30 2 12 1 31 2 28 1 32 16 37 1 33 16 38 1 34 20 10 ar 35 41 22 1 36 23 22 1 37 23 24 ar 38 12 14 1 39 12 33 1 40 25 24 ar 41 25 44 1 42 22 42 1 43 24 43 1 44 14 3 1 45 14 35 1 46 8 21 ar 47 10 21 ar 48 21 40 1