@MOLECULE 1-(3-acetyl-4,5-dihydroxy-7-methoxy-2-naphthyl)acetone 37 38 0 0 0 SMALL GASTEIGER @ATOM 1 O -3.6700 1.2433 -0.5022 O.2 1 UNL1111111111 -0.4857 2 C -2.7403 1.5968 0.1846 C.2 1 UNL1111111111 0.5545 3 C -2.8193 2.8368 1.0213 C.3 1 UNL1111111111 -0.5410 4 C -1.4870 0.8110 0.2531 C.ar 1 UNL1111111111 -0.3569 5 C -1.5013 -0.5722 0.5585 C.ar 1 UNL1111111111 0.1862 6 C -2.7793 -1.2921 0.8499 C.3 1 UNL1111111111 -0.4227 7 C -3.0519 -2.2951 -0.2632 C.2 1 UNL1111111111 0.5278 8 O -2.9179 -3.4749 -0.0602 O.2 1 UNL1111111111 -0.4712 9 C -3.4965 -1.7453 -1.5765 C.3 1 UNL1111111111 -0.5524 10 C -0.2719 1.4235 -0.0145 C.ar 1 UNL1111111111 0.4116 11 O -0.3469 2.7404 -0.2885 O.3 1 UNL1111111111 -0.4763 12 C 0.9649 0.7169 -0.0050 C.ar 1 UNL1111111111 -0.3130 13 C 0.9251 -0.6703 0.3220 C.ar 1 UNL1111111111 0.2101 14 C -0.3234 -1.2828 0.6012 C.ar 1 UNL1111111111 -0.3165 15 C 2.2423 1.2683 -0.2881 C.ar 1 UNL1111111111 0.4090 16 O 2.2597 2.5821 -0.6362 O.3 1 UNL1111111111 -0.5344 17 C 3.4189 0.5518 -0.2412 C.ar 1 UNL1111111111 -0.4753 18 C 3.3316 -0.8194 0.0916 C.ar 1 UNL1111111111 0.3470 19 C 2.1168 -1.4246 0.3662 C.ar 1 UNL1111111111 -0.3719 20 O 4.3885 -1.6591 0.1722 O.3 1 UNL1111111111 -0.2952 21 C 5.6791 -1.1318 -0.1063 C.3 1 UNL1111111111 -0.2052 22 H -3.8613 3.1357 1.1998 H 1 UNL1111111111 0.1729 23 H -2.3198 2.7183 1.9904 H 1 UNL1111111111 0.1711 24 H -2.3258 3.6770 0.5043 H 1 UNL1111111111 0.1907 25 H -2.7076 -1.8244 1.8251 H 1 UNL1111111111 0.1851 26 H -3.6500 -0.6112 0.9519 H 1 UNL1111111111 0.1874 27 H -3.1770 -0.6997 -1.7305 H 1 UNL1111111111 0.1989 28 H -3.1203 -2.3463 -2.4157 H 1 UNL1111111111 0.1773 29 H -4.5950 -1.7442 -1.6460 H 1 UNL1111111111 0.1828 30 H 0.5416 3.1353 -0.4966 H 1 UNL1111111111 0.3614 31 H -0.3342 -2.3472 0.8421 H 1 UNL1111111111 0.1864 32 H 3.1672 2.9621 -0.7073 H 1 UNL1111111111 0.3598 33 H 4.3706 1.0142 -0.4599 H 1 UNL1111111111 0.1764 34 H 2.0781 -2.4833 0.6144 H 1 UNL1111111111 0.1913 35 H 5.7387 -0.7596 -1.1335 H 1 UNL1111111111 0.1369 36 H 5.9519 -0.3615 0.6210 H 1 UNL1111111111 0.1352 37 H 6.3180 -2.0186 0.0166 H 1 UNL1111111111 0.1579 @BOND 1 1 2 2 2 2 3 1 3 2 4 1 4 3 22 1 5 3 23 1 6 3 24 1 7 4 5 ar 8 4 10 ar 9 5 6 1 10 5 14 ar 11 6 7 1 12 6 25 1 13 6 26 1 14 7 8 2 15 7 9 1 16 9 27 1 17 9 28 1 18 9 29 1 19 10 11 1 20 10 12 ar 21 11 30 1 22 12 13 ar 23 12 15 ar 24 13 14 ar 25 13 19 ar 26 14 31 1 27 15 16 1 28 15 17 ar 29 16 32 1 30 17 18 ar 31 17 33 1 32 18 19 ar 33 18 20 1 34 19 34 1 35 20 21 1 36 21 35 1 37 21 36 1 38 21 37 1