@MOLECULE glucosamine 6-sulfate 29 29 0 0 0 SMALL GASTEIGER @ATOM 1 S -3.1680 -0.0628 -0.2383 S.O2 1 UNL1111111111 2.5490 2 O 0.9904 -1.2685 0.4560 O.3 1 UNL1111111111 -0.4922 3 O 0.5855 2.2846 0.9529 O.3 1 UNL1111111111 -0.5360 4 O 2.8220 2.1285 -0.9093 O.3 1 UNL1111111111 -0.5368 5 O 2.6242 -2.6250 -0.2000 O.3 1 UNL1111111111 -0.4937 6 O -1.5750 0.2468 0.1204 O.3 1 UNL1111111111 -0.7683 7 O -2.8671 -0.8245 -1.6586 O.3 1 UNL1111111111 -0.7961 8 O -3.6341 -1.0085 0.7285 O.2 1 UNL1111111111 -0.8837 9 O -3.8247 1.1771 -0.4903 O.2 1 UNL1111111111 -0.8196 10 N 4.4104 -0.2543 -0.5407 N.3 1 UNL1111111111 -0.6153 11 C 2.4190 1.1530 0.0221 C.3 1 UNL1111111111 0.0577 12 C 0.8968 1.1181 0.2257 C.3 1 UNL1111111111 0.0565 13 C 2.9420 -0.2147 -0.5086 C.3 1 UNL1111111111 -0.0985 14 C 0.5383 -0.1008 1.1056 C.3 1 UNL1111111111 0.0566 15 C 2.4131 -1.3809 0.3678 C.3 1 UNL1111111111 0.3442 16 C -0.9747 -0.3149 1.2708 C.3 1 UNL1111111111 0.0430 17 H 0.3519 1.1096 -0.7426 H 1 UNL1111111111 0.1497 18 H 2.9407 1.4810 0.9518 H 1 UNL1111111111 0.1626 19 H 2.5799 -0.3568 -1.5605 H 1 UNL1111111111 0.1628 20 H 1.0190 -0.0141 2.1075 H 1 UNL1111111111 0.1370 21 H 2.8587 -1.4591 1.3800 H 1 UNL1111111111 0.1395 22 H -1.3655 0.2139 2.1604 H 1 UNL1111111111 0.1361 23 H -1.2003 -1.4024 1.3366 H 1 UNL1111111111 0.1592 24 H 4.8169 -0.2000 0.3796 H 1 UNL1111111111 0.2486 25 H 4.7749 0.5060 -1.1015 H 1 UNL1111111111 0.2696 26 H -0.3810 2.4618 0.8872 H 1 UNL1111111111 0.3312 27 H 2.1314 2.3002 -1.5798 H 1 UNL1111111111 0.3201 28 H 2.2805 -2.6732 -1.1200 H 1 UNL1111111111 0.3248 29 H -2.0122 -1.2847 -1.7213 H 1 UNL1111111111 0.3921 @BOND 1 1 6 1 2 1 7 1 3 1 8 2 4 1 9 2 5 2 14 1 6 2 15 1 7 3 12 1 8 3 26 1 9 4 11 1 10 4 27 1 11 5 15 1 12 5 28 1 13 6 16 1 14 7 29 1 15 10 13 1 16 10 24 1 17 10 25 1 18 11 12 1 19 11 13 1 20 11 18 1 21 12 14 1 22 12 17 1 23 13 15 1 24 13 19 1 25 14 16 1 26 14 20 1 27 15 21 1 28 16 22 1 29 16 23 1