@MOLECULE 2-[(4-azido-2-hydroxybenzyl)amino]-2-deoxyhexose 23 18 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O 3.1566 2.8795 1.1459 O.3 1 UNL1 -0.1953 2 C 2.3926 2.1526 0.6618 C.1 1 UNL1 0.4530 3 C 1.7673 1.2676 -0.0695 C.1 1 UNL1 -0.1821 4 C 4.3691 -0.5032 1.4911 C.2 1 UNL1 0.5089 5 C 3.2185 -2.5728 0.7197 C.2 2 UNL2 0.4234 6 C 7.4669 -0.7619 -1.1749 C.2 3 UNL3 0.4176 7 C 5.5722 1.0554 -0.1252 C.2 4 UNL4 0.4298 8 O 6.1724 1.8350 -0.6975 O.2 4 UNL4 -0.4228 9 O 8.4327 -1.0985 -1.6721 O.2 3 UNL3 -0.4159 10 O 2.6331 -3.5463 0.6627 O.2 2 UNL2 -0.4127 11 O 3.4791 0.1701 1.7546 O.2 1 UNL1 -0.5236 12 N 0.9835 0.4968 -0.6508 N.pl3 1 UNL1 -0.0648 13 C -0.3330 0.4169 -0.4300 C.1 1 UNL1 0.0727 14 C -1.5418 0.2313 -0.3799 C.1 1 UNL1 -0.0728 15 C -2.8816 0.0687 -0.3105 C.1 1 UNL1 0.0810 16 C -4.0911 -0.0651 -0.2446 C.1 1 UNL1 -0.1641 17 C -5.5030 -0.1384 -0.1645 C.3 1 UNL1 0.4987 18 C -6.2755 0.9279 -0.1897 C.1 1 UNL1 -0.5945 19 C -7.0763 1.9242 -0.2087 C.1 1 UNL1 0.5823 20 O -7.7724 2.8563 -0.2305 O.3 1 UNL1 -0.2853 21 N -6.1364 -1.3956 -0.0518 N.2 1 UNL1 -0.4260 22 N -5.5288 -2.4923 -0.0346 N.2 1 UNL1 0.4358 23 N -5.2103 -3.5784 0.0013 N.2 1 UNL1 -0.1435 @BOND 1 9 6 2 2 8 7 2 3 12 13 1 4 12 3 1 5 13 14 3 6 14 15 1 7 15 16 3 8 16 17 1 9 20 19 1 10 19 18 3 11 18 17 1 12 17 21 1 13 3 2 3 14 21 22 2 15 22 23 2 16 2 1 1 17 10 5 2 18 4 11 2