@MOLECULE (2s,3r)-2,3,4-trimethyl-2,3-dihydro-1-benzofuran-5,7-diol 28 29 0 0 0 SMALL GASTEIGER @ATOM 1 O -1.6753 -1.2001 -0.2438 O.3 1 UNL1111111111 -0.1284 2 O 0.5687 -3.0441 -0.2889 O.3 1 UNL1111111111 -0.3036 3 O 3.4592 0.5772 0.2296 O.3 1 UNL1111111111 -0.3066 4 C -1.5375 1.2188 -0.0051 C.3 1 UNL1111111111 -0.1183 5 C -2.4962 -0.0159 -0.0444 C.3 1 UNL1111111111 0.2607 6 C -0.1823 0.5674 0.0169 C.ar 1 UNL1111111111 0.0168 7 C -0.3660 -0.8122 -0.1294 C.ar 1 UNL1111111111 -0.2377 8 C -1.7207 2.1000 -1.2368 C.3 1 UNL1111111111 -0.8183 9 C 1.0902 1.0994 0.1598 C.ar 1 UNL1111111111 0.1285 10 C -3.2509 -0.2221 1.2572 C.3 1 UNL1111111111 -0.9214 11 C 0.7042 -1.7030 -0.1544 C.ar 1 UNL1111111111 0.0558 12 C 2.1618 0.1844 0.1173 C.ar 1 UNL1111111111 -0.0857 13 C 1.9989 -1.1945 -0.0348 C.ar 1 UNL1111111111 -0.2005 14 C 1.3301 2.5537 0.3553 C.3 1 UNL1111111111 -0.9992 15 H -1.7045 1.8173 0.9184 H 1 UNL1111111111 0.1993 16 H -3.1628 -0.0152 -0.9289 H 1 UNL1111111111 0.1132 17 H -1.5586 1.5330 -2.1636 H 1 UNL1111111111 0.2396 18 H -2.7270 2.5304 -1.2783 H 1 UNL1111111111 0.2297 19 H -1.0033 2.9296 -1.2442 H 1 UNL1111111111 0.2373 20 H -3.9546 0.5943 1.4500 H 1 UNL1111111111 0.2449 21 H -3.8215 -1.1605 1.2368 H 1 UNL1111111111 0.2829 22 H -2.5639 -0.2902 2.1115 H 1 UNL1111111111 0.2703 23 H 2.8617 -1.8573 -0.0560 H 1 UNL1111111111 0.2815 24 H 0.4035 3.0932 0.6032 H 1 UNL1111111111 0.2909 25 H 2.0263 2.7510 1.1839 H 1 UNL1111111111 0.2938 26 H 1.7340 3.0215 -0.5554 H 1 UNL1111111111 0.2826 27 H -0.3917 -3.2924 -0.3555 H 1 UNL1111111111 0.3693 28 H 3.5484 1.5580 0.2953 H 1 UNL1111111111 0.3227 @BOND 1 1 5 1 2 1 7 1 3 2 11 1 4 2 27 1 5 3 12 1 6 3 28 1 7 4 5 1 8 4 6 1 9 4 8 1 10 4 15 1 11 5 10 1 12 5 16 1 13 6 7 ar 14 6 9 ar 15 7 11 ar 16 8 17 1 17 8 18 1 18 8 19 1 19 9 12 ar 20 9 14 1 21 10 20 1 22 10 21 1 23 10 22 1 24 11 13 ar 25 12 13 ar 26 13 23 1 27 14 24 1 28 14 25 1 29 14 26 1