@MOLECULE methyl 2,4-dihydroxy-3,6-dimethylbenzoate 26 26 0 0 0 SMALL GASTEIGER @ATOM 1 O 0.2002 -2.1221 -0.1600 O.3 1 UNL1111 -0.4676 2 O -3.6932 0.5334 0.0950 O.3 1 UNL1111 -0.4582 3 O 2.4168 -0.8864 0.3824 O.3 1 UNL1111 -0.4812 4 O 2.6180 1.1364 -0.5396 O.2 1 UNL1111 -0.5008 5 C -0.2365 1.5281 0.0636 C.ar 1 UNL1111 0.2370 6 C 0.4304 0.2837 -0.0251 C.ar 1 UNL1111 -0.4130 7 C -1.7445 -0.8770 -0.0432 C.ar 1 UNL1111 -0.2721 8 C -0.3407 -0.8950 -0.0663 C.ar 1 UNL1111 0.4143 9 C -2.3527 0.3769 0.0507 C.ar 1 UNL1111 0.3771 10 C -1.6222 1.5729 0.1085 C.ar 1 UNL1111 -0.3725 11 C 0.5308 2.8011 0.1070 C.3 1 UNL1111 -0.4708 12 C -2.5386 -2.1310 -0.1085 C.3 1 UNL1111 -0.4078 13 C 1.8842 0.2814 -0.1138 C.2 1 UNL1111 0.6534 14 C 3.8226 -1.0518 0.2526 C.3 1 UNL1111 -0.1495 15 H -2.1584 2.5155 0.1841 H 1 UNL1111 0.1885 16 H 1.2980 2.7946 0.8983 H 1 UNL1111 0.1758 17 H 1.0808 2.9620 -0.8400 H 1 UNL1111 0.1913 18 H -0.1021 3.6829 0.2711 H 1 UNL1111 0.1608 19 H -3.1266 -2.2930 0.8065 H 1 UNL1111 0.1471 20 H -3.2168 -2.1443 -0.9736 H 1 UNL1111 0.1460 21 H -1.8935 -3.0212 -0.2163 H 1 UNL1111 0.1792 22 H 1.1961 -2.1020 -0.0513 H 1 UNL1111 0.3614 23 H -4.1799 -0.3296 0.0538 H 1 UNL1111 0.3345 24 H 4.3492 -0.1938 0.6870 H 1 UNL1111 0.1464 25 H 4.0849 -1.1649 -0.8045 H 1 UNL1111 0.1368 26 H 4.0196 -1.9670 0.8234 H 1 UNL1111 0.1439 @BOND 1 1 8 1 2 1 22 1 3 2 9 1 4 2 23 1 5 3 13 1 6 3 14 1 7 4 13 2 8 5 6 ar 9 5 10 ar 10 5 11 1 11 6 8 ar 12 6 13 1 13 7 8 ar 14 7 9 ar 15 7 12 1 16 9 10 ar 17 10 15 1 18 11 16 1 19 11 17 1 20 11 18 1 21 12 19 1 22 12 20 1 23 12 21 1 24 14 24 1 25 14 25 1 26 14 26 1