@MOLECULE 6-o-sulfo-d-glucose 28 27 0 0 0 SMALL GASTEIGER @ATOM 1 S -3.3070 0.4912 -0.1006 S.O2 1 UNL1111111111 2.5584 2 O 0.8436 0.8897 0.2889 O.3 1 UNL1111111111 -0.5904 3 O 2.2604 -0.4999 2.0288 O.3 1 UNL1111111111 -0.5427 4 O 0.5016 -2.6789 -0.4790 O.3 1 UNL1111111111 -0.5288 5 O -1.7100 0.0603 0.0288 O.3 1 UNL1111111111 -0.7543 6 O 4.0442 -0.4718 -1.0583 O.3 1 UNL1111111111 -0.5505 7 O 3.7608 2.1676 -0.8326 O.2 1 UNL1111111111 -0.4418 8 O -3.9221 -0.4986 1.0502 O.3 1 UNL1111111111 -0.8119 9 O -3.4205 1.8241 0.4029 O.2 1 UNL1111111111 -0.8635 10 O -3.7650 0.0686 -1.3839 O.2 1 UNL1111111111 -0.8500 11 C 1.2308 -0.3865 -0.1814 C.3 1 UNL1111111111 0.0385 12 C 2.4692 -0.7558 0.6631 C.3 1 UNL1111111111 0.0989 13 C 0.1058 -1.4211 0.0076 C.3 1 UNL1111111111 0.0648 14 C 3.7073 0.0492 0.2087 C.3 1 UNL1111111111 -0.0178 15 C -1.1920 -1.0198 -0.7321 C.3 1 UNL1111111111 0.0071 16 C 3.4331 1.5446 0.1485 C.2 1 UNL1111111111 0.3214 17 H 1.5053 -0.2679 -1.2559 H 1 UNL1111111111 0.1498 18 H 2.6823 -1.8518 0.6150 H 1 UNL1111111111 0.1748 19 H -0.0951 -1.6134 1.0898 H 1 UNL1111111111 0.1775 20 H 4.5733 -0.1593 0.8839 H 1 UNL1111111111 0.1691 21 H -1.8982 -1.8734 -0.7547 H 1 UNL1111111111 0.1523 22 H -1.0100 -0.6557 -1.7604 H 1 UNL1111111111 0.1389 23 H -0.1350 0.9917 0.2609 H 1 UNL1111111111 0.3656 24 H 1.6383 0.2559 2.1400 H 1 UNL1111111111 0.3351 25 H 0.9713 -2.6054 -1.3377 H 1 UNL1111111111 0.3203 26 H 2.9528 2.0170 1.0104 H 1 UNL1111111111 0.1359 27 H 4.2654 0.2672 -1.6802 H 1 UNL1111111111 0.3453 28 H -4.1656 -0.0887 1.8979 H 1 UNL1111111111 0.3981 @BOND 1 1 5 1 2 1 8 1 3 1 9 2 4 1 10 2 5 2 11 1 6 2 23 1 7 3 12 1 8 3 24 1 9 4 13 1 10 4 25 1 11 5 15 1 12 6 14 1 13 6 27 1 14 7 16 2 15 8 28 1 16 11 12 1 17 11 13 1 18 11 17 1 19 12 14 1 20 12 18 1 21 13 15 1 22 13 19 1 23 14 16 1 24 14 20 1 25 15 21 1 26 15 22 1 27 16 26 1