@MOLECULE 2-methylresorcinol 17 17 0 0 0 SMALL GASTEIGER @ATOM 1 O -2.3896 -0.6507 0.0028 O.3 1 UNL1111111111 -0.4667 2 O 2.3582 -0.6539 0.0030 O.3 1 UNL1111111111 -0.4728 3 C 0.0243 -0.7363 -0.0017 C.ar 1 UNL1111111111 -0.2186 4 C -1.1844 -0.0307 -0.0001 C.ar 1 UNL1111111111 0.3188 5 C 1.1905 0.0406 -0.0002 C.ar 1 UNL1111111111 0.3267 6 C 0.0706 -2.2208 -0.0029 C.3 1 UNL1111111111 -0.4184 7 C -1.2470 1.3693 -0.0004 C.ar 1 UNL1111111111 -0.3063 8 C 1.1714 1.4374 -0.0006 C.ar 1 UNL1111111111 -0.3704 9 C -0.0607 2.0911 -0.0012 C.ar 1 UNL1111111111 -0.0224 10 H -0.4122 -2.6458 -0.8949 H 1 UNL1111111111 0.1499 11 H 1.1084 -2.5981 -0.0079 H 1 UNL1111111111 0.1779 12 H -0.4040 -2.6471 0.8929 H 1 UNL1111111111 0.1500 13 H -2.2149 1.8618 0.0001 H 1 UNL1111111111 0.1790 14 H 2.0937 2.0046 -0.0003 H 1 UNL1111111111 0.1630 15 H -0.0911 3.1815 -0.0017 H 1 UNL1111111111 0.1510 16 H -2.3076 -1.6367 0.0029 H 1 UNL1111111111 0.3306 17 H 3.1449 -0.0561 0.0025 H 1 UNL1111111111 0.3287 @BOND 1 1 4 1 2 1 16 1 3 2 5 1 4 2 17 1 5 3 4 ar 6 3 5 ar 7 3 6 1 8 4 7 ar 9 5 8 ar 10 6 10 1 11 6 11 1 12 6 12 1 13 7 9 ar 14 7 13 1 15 8 9 ar 16 8 14 1 17 9 15 1