@MOLECULE (1s)-1-(6-amino-7h-purin-8-yl)-1,4-anhydro-3-deoxy-d-erythro-pentitol 31 33 0 0 0 SMALL GASTEIGER @ATOM 1 O -2.1599 -0.3273 -1.1372 O.3 1 UNL1111111111 -0.4433 2 O -3.3004 2.4634 -0.0326 O.3 1 UNL1111111111 -0.6128 3 O -2.0039 -3.1122 -0.4079 O.3 1 UNL1111111111 -0.4821 4 N 0.8043 0.5646 -1.1673 N.ar 1 UNL1111111111 -0.3355 5 N 0.1955 0.4830 1.0224 N.ar 1 UNL1111111111 -0.4684 6 N 2.4351 -0.0322 1.9483 N.ar 1 UNL1111111111 -0.7302 7 N 4.1776 -0.2251 0.2861 N.ar 1 UNL1111111111 -0.7708 8 N 3.8660 0.1107 -1.9961 N.pl3 1 UNL1111111111 -1.1722 9 C -2.5567 1.3868 0.4889 C.3 1 UNL1111111111 0.0506 10 C -1.6471 0.9085 -0.6725 C.3 1 UNL1111111111 0.5395 11 C -3.4033 0.1578 0.8521 C.3 1 UNL1111111111 -0.5619 12 C -2.9883 -0.9352 -0.1411 C.3 1 UNL1111111111 -0.0779 13 C -0.2318 0.6713 -0.2393 C.ar 1 UNL1111111111 0.0995 14 C -2.1914 -2.0672 0.5233 C.3 1 UNL1111111111 -0.1133 15 C 1.9624 0.2812 -0.4464 C.ar 1 UNL1111111111 -0.5179 16 C 1.5600 0.2317 0.9464 C.ar 1 UNL1111111111 0.6761 17 C 3.3280 0.0441 -0.7363 C.ar 1 UNL1111111111 0.9794 18 C 3.7004 -0.2479 1.5624 C.ar 1 UNL1111111111 0.4426 19 H -1.9886 1.8097 1.3477 H 1 UNL1111111111 0.1230 20 H -1.7202 1.5931 -1.5517 H 1 UNL1111111111 0.0846 21 H -3.2194 -0.1452 1.8999 H 1 UNL1111111111 0.1850 22 H -4.4819 0.3754 0.7834 H 1 UNL1111111111 0.2436 23 H -3.8318 -1.3391 -0.7421 H 1 UNL1111111111 0.1733 24 H -2.7535 -2.5460 1.3460 H 1 UNL1111111111 0.2159 25 H -1.2111 -1.7225 0.8979 H 1 UNL1111111111 0.2422 26 H 0.7390 0.6446 -2.1576 H 1 UNL1111111111 0.3384 27 H -4.2488 2.4030 0.1892 H 1 UNL1111111111 0.3593 28 H -1.4707 -2.7772 -1.1601 H 1 UNL1111111111 0.3245 29 H 4.4437 -0.4728 2.3488 H 1 UNL1111111111 0.2016 30 H 4.8360 -0.1199 -2.1227 H 1 UNL1111111111 0.5096 31 H 3.2867 0.1316 -2.8035 H 1 UNL1111111111 0.4977 @BOND 1 1 10 1 2 1 12 1 3 2 9 1 4 2 27 1 5 3 14 1 6 3 28 1 7 4 13 ar 8 4 15 ar 9 4 26 1 10 5 13 ar 11 5 16 ar 12 6 16 ar 13 6 18 ar 14 7 17 ar 15 7 18 ar 16 8 17 1 17 8 30 1 18 8 31 1 19 9 10 1 20 9 11 1 21 9 19 1 22 10 13 1 23 10 20 1 24 11 12 1 25 11 21 1 26 11 22 1 27 12 14 1 28 12 23 1 29 14 24 1 30 14 25 1 31 15 16 ar 32 15 17 ar 33 18 29 1