@MOLECULE acetopyrocatechol 19 19 0 0 0 SMALL GASTEIGER @ATOM 1 O -0.2776 -1.9346 -0.0165 O.3 1 UNL1111111111 -0.4978 2 O -2.8295 -1.0250 0.0038 O.3 1 UNL1111111111 -0.4446 3 O 2.2408 -1.3572 0.0193 O.2 1 UNL1111111111 -0.5199 4 C 0.6109 0.3213 -0.0012 C.ar 1 UNL1111111111 -0.2908 5 C -0.4378 -0.6010 -0.0055 C.ar 1 UNL1111111111 0.2535 6 C 0.2939 1.6928 0.0017 C.ar 1 UNL1111111111 -0.1016 7 C -1.7865 -0.1575 -0.0002 C.ar 1 UNL1111111111 0.1648 8 C 2.0005 -0.1603 0.0031 C.2 1 UNL1111111111 0.5384 9 C -1.0216 2.1190 0.0019 C.ar 1 UNL1111111111 -0.1800 10 C -2.0782 1.1946 0.0025 C.ar 1 UNL1111111111 -0.1557 11 C 3.1310 0.8186 -0.0111 C.3 1 UNL1111111111 -0.5368 12 H 1.0967 2.4293 0.0048 H 1 UNL1111111111 0.1532 13 H -1.2523 3.1829 0.0030 H 1 UNL1111111111 0.1583 14 H -3.1152 1.5285 0.0061 H 1 UNL1111111111 0.1763 15 H 3.1191 1.4655 0.8776 H 1 UNL1111111111 0.1792 16 H 3.0991 1.4641 -0.9002 H 1 UNL1111111111 0.1790 17 H 4.1042 0.2991 -0.0207 H 1 UNL1111111111 0.1869 18 H 0.7180 -2.1731 0.0100 H 1 UNL1111111111 0.3929 19 H -2.5047 -1.9667 0.0197 H 1 UNL1111111111 0.3446 @BOND 1 1 5 1 2 1 18 1 3 2 7 1 4 2 19 1 5 3 8 2 6 4 5 ar 7 4 6 ar 8 4 8 1 9 5 7 ar 10 6 9 ar 11 6 12 1 12 7 10 ar 13 8 11 1 14 9 10 ar 15 9 13 1 16 10 14 1 17 11 15 1 18 11 16 1 19 11 17 1