@MOLECULE famciclovir 42 43 0 0 0 SMALL GASTEIGER @ATOM 1 O -3.6012 -1.2734 -0.0592 O.3 1 UNL11111111 -0.4486 2 O -1.3465 2.1540 0.1528 O.3 1 UNL11111111 -0.4312 3 O -5.1660 -0.6890 -1.5567 O.2 1 UNL11111111 -0.5065 4 O -0.7761 4.0597 1.1847 O.2 1 UNL11111111 -0.5145 5 N 1.4338 -1.3654 1.0239 N.ar 1 UNL11111111 -0.3326 6 N 2.8758 -3.0579 0.5415 N.ar 1 UNL11111111 -0.3203 7 N 2.5965 0.4812 -0.1036 N.ar 1 UNL11111111 -0.5524 8 N 4.6940 -0.2878 -1.1601 N.ar 1 UNL11111111 -0.5190 9 N 3.9878 1.9392 -1.2694 N.pl3 1 UNL11111111 -0.5705 10 C -2.0747 0.1283 1.0791 C.3 1 UNL11111111 -0.1403 11 C -0.8660 -0.6281 0.5218 C.3 1 UNL11111111 -0.2954 12 C 0.2727 -0.6651 1.5516 C.3 1 UNL11111111 -0.0692 13 C -3.2203 0.1055 0.0507 C.3 1 UNL11111111 -0.0178 14 C -1.7601 1.5970 1.3987 C.3 1 UNL11111111 -0.0304 15 C 2.4451 -0.8037 0.2815 C.ar 1 UNL11111111 0.2934 16 C 1.7365 -2.7490 1.1494 C.ar 1 UNL11111111 0.1200 17 C 3.3634 -1.8817 -0.0242 C.ar 1 UNL11111111 -0.1787 18 C 4.5056 -1.5495 -0.7691 C.ar 1 UNL11111111 0.2013 19 C -4.6020 -1.5510 -0.9343 C.2 1 UNL11111111 0.6283 20 C -0.8096 3.4022 0.1803 C.2 1 UNL11111111 0.6370 21 C 3.7469 0.6721 -0.8242 C.ar 1 UNL11111111 0.5292 22 C -4.8427 -3.0210 -0.9610 C.3 1 UNL11111111 -0.5121 23 C -0.3170 3.7462 -1.1823 C.3 1 UNL11111111 -0.5094 24 H -2.4282 -0.3661 2.0192 H 1 UNL11111111 0.1552 25 H -0.5139 -0.1461 -0.4147 H 1 UNL11111111 0.1743 26 H -1.1633 -1.6571 0.2357 H 1 UNL11111111 0.1612 27 H 0.5853 0.3838 1.8011 H 1 UNL11111111 0.1742 28 H -0.0506 -1.1452 2.5006 H 1 UNL11111111 0.1491 29 H -4.0976 0.6883 0.3754 H 1 UNL11111111 0.1365 30 H -2.8977 0.4594 -0.9452 H 1 UNL11111111 0.1521 31 H -0.9532 1.7140 2.1454 H 1 UNL11111111 0.1436 32 H -2.6522 2.1484 1.7501 H 1 UNL11111111 0.1364 33 H 1.0868 -3.4217 1.6865 H 1 UNL11111111 0.1946 34 H 5.2674 -2.2923 -1.0463 H 1 UNL11111111 0.1958 35 H -5.1333 -3.4023 0.0288 H 1 UNL11111111 0.1836 36 H -3.9400 -3.5719 -1.2663 H 1 UNL11111111 0.1873 37 H -5.6520 -3.2549 -1.6736 H 1 UNL11111111 0.1867 38 H -1.1293 3.7262 -1.9242 H 1 UNL11111111 0.1861 39 H 0.4394 3.0182 -1.5207 H 1 UNL11111111 0.1935 40 H 0.1347 4.7476 -1.1966 H 1 UNL11111111 0.1794 41 H 3.3747 2.6838 -1.0021 H 1 UNL11111111 0.3230 42 H 4.8281 2.1428 -1.7733 H 1 UNL11111111 0.3271 @BOND 1 1 13 1 2 1 19 1 3 2 14 1 4 2 20 1 5 3 19 2 6 4 20 2 7 5 12 1 8 5 15 ar 9 5 16 ar 10 6 16 ar 11 6 17 ar 12 7 15 ar 13 7 21 ar 14 8 18 ar 15 8 21 ar 16 9 21 1 17 9 41 1 18 9 42 1 19 10 11 1 20 10 13 1 21 10 14 1 22 10 24 1 23 11 12 1 24 11 25 1 25 11 26 1 26 12 27 1 27 12 28 1 28 13 29 1 29 13 30 1 30 14 31 1 31 14 32 1 32 15 17 ar 33 16 33 1 34 17 18 ar 35 18 34 1 36 19 22 1 37 20 23 1 38 22 35 1 39 22 36 1 40 22 37 1 41 23 38 1 42 23 39 1 43 23 40 1