@MOLECULE (4-amino-2,6-dimethylphenoxy)acetic acid 27 27 0 0 0 SMALL GASTEIGER @ATOM 1 C 0.3215 2.5334 0.2846 C.3 1 UNL111111111 -0.4551 2 C 1.0371 1.2340 0.1603 C.ar 1 UNL111111111 0.1033 3 C 2.4083 1.2043 -0.0719 C.ar 1 UNL111111111 -0.3446 4 C 3.0710 -0.0328 -0.1846 C.ar 1 UNL111111111 0.2816 5 C 0.9946 -1.2140 0.2070 C.ar 1 UNL111111111 0.1024 6 N 4.4240 -0.0614 -0.5072 N.pl3 1 UNL111111111 -0.6286 7 C 2.3657 -1.2406 -0.0282 C.ar 1 UNL111111111 -0.3452 8 C 0.2411 -2.4847 0.3881 C.3 1 UNL111111111 -0.4555 9 C 0.3447 0.0231 0.2777 C.ar 1 UNL111111111 -0.0054 10 O -1.0030 0.0539 0.5885 O.3 1 UNL111111111 -0.2914 11 C -1.7941 0.0276 -0.6019 C.3 1 UNL111111111 -0.1364 12 C -3.2194 0.0085 -0.1229 C.2 1 UNL111111111 0.6212 13 O -3.6836 0.1021 0.9765 O.2 1 UNL111111111 -0.4574 14 H 0.1140 2.9698 -0.7030 H 1 UNL111111111 0.1596 15 H -0.6419 2.4254 0.8107 H 1 UNL111111111 0.1771 16 H 0.9084 3.2708 0.8507 H 1 UNL111111111 0.1605 17 H 2.9628 2.1305 -0.1722 H 1 UNL111111111 0.1635 18 H 4.9597 0.7751 -0.4180 H 1 UNL111111111 0.2930 19 H 4.9320 -0.9112 -0.3882 H 1 UNL111111111 0.2930 20 H 2.8867 -2.1889 -0.0958 H 1 UNL111111111 0.1636 21 H 0.7631 -3.1686 1.0744 H 1 UNL111111111 0.1625 22 H -0.7618 -2.3182 0.8141 H 1 UNL111111111 0.1751 23 H 0.1149 -3.0145 -0.5672 H 1 UNL111111111 0.1597 24 H -1.5910 0.9293 -1.2135 H 1 UNL111111111 0.1641 25 H -1.5577 -0.8732 -1.2033 H 1 UNL111111111 0.1660 26 O -4.0286 -0.1383 -1.2133 O.3 1 UNL111111111 -0.5843 27 H -4.9906 -0.1562 -0.9957 H 1 UNL111111111 0.3578 @BOND 1 1 2 1 2 1 14 1 3 1 15 1 4 1 16 1 5 2 3 ar 6 2 9 ar 7 3 4 ar 8 3 17 1 9 4 6 1 10 4 7 ar 11 5 7 ar 12 5 8 1 13 5 9 ar 14 6 18 1 15 6 19 1 16 7 20 1 17 8 21 1 18 8 22 1 19 8 23 1 20 9 10 1 21 10 11 1 22 11 12 1 23 11 24 1 24 11 25 1 25 12 13 2 26 12 26 1 27 26 27 1