@MOLECULE (2e)-3-{2-hydroxy-4-[(2r,3r)-3-(hydroxymethyl)-5-methoxy-2,3-dihydro-1-benzofuran-2-yl]-5-methoxyphenyl}acrylaldehyde 46 48 0 0 0 SMALL GASTEIGER @ATOM 1 O -1.2648 1.3639 -0.9335 O.3 1 UNL1111111111 -0.3266 2 O -2.2293 -1.9615 1.8579 O.3 1 UNL1111111111 -0.5512 3 O 0.8309 -2.1265 -1.0779 O.3 1 UNL1111111111 -0.3124 4 O -6.5218 0.4144 0.2079 O.3 1 UNL1111111111 -0.3188 5 O 3.0949 2.4199 0.9148 O.3 1 UNL1111111111 -0.4569 6 O 8.1564 0.5045 -0.3003 O.2 1 UNL1111111111 -0.4090 7 C -1.6633 -0.9025 -0.1658 C.3 1 UNL1111111111 -0.1583 8 C -0.6858 0.0272 -0.9584 C.3 1 UNL1111111111 0.0992 9 C -2.9189 -0.0889 -0.1979 C.ar 1 UNL1111111111 -0.0568 10 C -2.5927 1.2139 -0.6128 C.ar 1 UNL1111111111 0.1463 11 C 0.7142 0.0976 -0.4511 C.ar 1 UNL1111111111 -0.0811 12 C -1.2199 -1.1423 1.2835 C.3 1 UNL1111111111 0.0029 13 C -4.2213 -0.4288 0.1010 C.ar 1 UNL1111111111 -0.2236 14 C 1.5118 -1.0698 -0.5513 C.ar 1 UNL1111111111 0.1693 15 C -3.5310 2.2264 -0.6938 C.ar 1 UNL1111111111 -0.1754 16 C 1.2903 1.2501 0.0454 C.ar 1 UNL1111111111 -0.1580 17 C -5.1842 0.5856 -0.0154 C.ar 1 UNL1111111111 0.1886 18 C -4.8544 1.8923 -0.3950 C.ar 1 UNL1111111111 -0.2092 19 C 2.8369 -1.0911 -0.1466 C.ar 1 UNL1111111111 -0.2320 20 C 2.6424 1.2319 0.4400 C.ar 1 UNL1111111111 0.2243 21 C 3.4185 0.0780 0.3646 C.ar 1 UNL1111111111 -0.1283 22 C 4.8150 0.0407 0.8064 C.2 1 UNL1111111111 -0.0821 23 C 1.5431 -3.3494 -1.1892 C.3 1 UNL1111111111 -0.1998 24 C -6.9462 -0.8604 0.6673 C.3 1 UNL1111111111 -0.2005 25 C 5.8359 0.3197 -0.0095 C.2 1 UNL1111111111 -0.2876 26 C 7.2421 0.2401 0.4426 C.2 1 UNL1111111111 0.3267 27 H -1.7871 -1.8831 -0.6758 H 1 UNL1111111111 0.1759 28 H -0.6838 -0.2528 -2.0417 H 1 UNL1111111111 0.1588 29 H -1.1361 -0.1942 1.8414 H 1 UNL1111111111 0.1260 30 H -0.2693 -1.7049 1.3306 H 1 UNL1111111111 0.1264 31 H -4.4702 -1.4377 0.4151 H 1 UNL1111111111 0.1772 32 H -3.2509 3.2331 -0.9799 H 1 UNL1111111111 0.1711 33 H 0.7258 2.1841 0.1200 H 1 UNL1111111111 0.2014 34 H -5.6422 2.6352 -0.4674 H 1 UNL1111111111 0.1716 35 H 3.4439 -1.9883 -0.2221 H 1 UNL1111111111 0.1680 36 H -2.2201 -1.8625 2.8310 H 1 UNL1111111111 0.3124 37 H 4.9579 -0.2488 1.8523 H 1 UNL1111111111 0.1583 38 H 4.0755 2.4286 1.0417 H 1 UNL1111111111 0.3264 39 H 1.8635 -3.7083 -0.2060 H 1 UNL1111111111 0.1325 40 H 2.3896 -3.2431 -1.8756 H 1 UNL1111111111 0.1351 41 H 0.7864 -4.0213 -1.6154 H 1 UNL1111111111 0.1556 42 H -6.7812 -1.6260 -0.0968 H 1 UNL1111111111 0.1325 43 H -8.0221 -0.6988 0.8187 H 1 UNL1111111111 0.1498 44 H -6.4658 -1.1292 1.6131 H 1 UNL1111111111 0.1336 45 H 5.6988 0.6048 -1.0549 H 1 UNL1111111111 0.1871 46 H 7.4370 -0.0692 1.4817 H 1 UNL1111111111 0.1103 @BOND 1 1 8 1 2 1 10 1 3 2 12 1 4 2 36 1 5 3 14 1 6 3 23 1 7 4 17 1 8 4 24 1 9 5 20 1 10 5 38 1 11 6 26 2 12 7 8 1 13 7 9 1 14 7 12 1 15 7 27 1 16 8 11 1 17 8 28 1 18 9 10 ar 19 9 13 ar 20 10 15 ar 21 11 14 ar 22 11 16 ar 23 12 29 1 24 12 30 1 25 13 17 ar 26 13 31 1 27 14 19 ar 28 15 18 ar 29 15 32 1 30 16 20 ar 31 16 33 1 32 17 18 ar 33 18 34 1 34 19 21 ar 35 19 35 1 36 20 21 ar 37 21 22 1 38 22 25 2 39 22 37 1 40 23 39 1 41 23 40 1 42 23 41 1 43 24 42 1 44 24 43 1 45 24 44 1 46 25 26 1 47 25 45 1 48 26 46 1