@MOLECULE d-(-)-tagatose 24 23 0 0 0 SMALL GASTEIGER @ATOM 1 C 0.5850 0.6973 0.4413 C.3 1 UNL1111111111 -0.0079 2 C 1.9846 0.3369 -0.0305 C.2 1 UNL1111111111 0.3899 3 C 2.5210 -1.0348 0.2815 C.3 1 UNL1111111111 -0.1009 4 O 0.3608 2.0830 0.3627 O.3 1 UNL1111111111 -0.5320 5 H 0.4247 0.4535 1.5190 H 1 UNL1111111111 0.1832 6 C -0.4733 0.0116 -0.4590 C.3 1 UNL1111111111 0.0950 7 O 2.6328 1.1401 -0.6597 O.2 1 UNL1111111111 -0.4572 8 O 3.9155 -1.1102 0.1032 O.3 1 UNL1111111111 -0.5197 9 H 2.0505 -1.7986 -0.3807 H 1 UNL1111111111 0.1778 10 H 2.3647 -1.3310 1.3374 H 1 UNL1111111111 0.1653 11 C -1.8800 0.2690 0.1153 C.3 1 UNL1111111111 0.0528 12 O -0.2005 -1.3655 -0.5107 O.3 1 UNL1111111111 -0.5595 13 H -0.3838 0.3502 -1.5150 H 1 UNL1111111111 0.1549 14 H -2.0072 1.3346 0.4160 H 1 UNL1111111111 0.1563 15 C -2.9720 -0.1986 -0.8578 C.3 1 UNL1111111111 -0.0653 16 O -1.9329 -0.5062 1.3020 O.3 1 UNL1111111111 -0.5737 17 O -4.2086 -0.1985 -0.1759 O.3 1 UNL1111111111 -0.5425 18 H -2.8426 -1.2629 -1.1435 H 1 UNL1111111111 0.1663 19 H -3.0266 0.4199 -1.7679 H 1 UNL1111111111 0.1304 20 H -4.5225 0.7143 -0.0142 H 1 UNL1111111111 0.3176 21 H -2.8638 -0.7793 1.4790 H 1 UNL1111111111 0.3483 22 H 4.2173 -0.4327 -0.5484 H 1 UNL1111111111 0.3328 23 H 0.9853 2.5028 -0.2802 H 1 UNL1111111111 0.3406 24 H -0.6013 -1.8171 0.2736 H 1 UNL1111111111 0.3476 @BOND 1 1 2 1 2 2 3 1 3 1 4 1 4 1 5 1 5 1 6 1 6 2 7 2 7 3 8 1 8 3 9 1 9 3 10 1 10 6 11 1 11 6 12 1 12 6 13 1 13 11 14 1 14 11 15 1 15 11 16 1 16 15 17 1 17 15 18 1 18 15 19 1 19 17 20 1 20 16 21 1 21 8 22 1 22 4 23 1 23 12 24 1