@MOLECULE n-[(7s)-4-(hydroxymethyl)-1,2,3,10-tetramethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl]acetamide 58 60 0 0 0 SMALL GASTEIGER @ATOM 1 O 0.1287 2.4070 -0.8346 O.3 1 UNL1111111111 -0.3365 2 O 4.4677 0.5877 0.2697 O.3 1 UNL1111111111 -0.3038 3 O 2.9023 2.4365 -1.2213 O.3 1 UNL1111111111 -0.3136 4 O 3.2578 -1.2576 3.2372 O.3 1 UNL1111111111 -0.5484 5 O -5.4377 0.8467 1.2737 O.3 1 UNL1111111111 -0.2916 6 O -4.5258 0.4713 -1.5216 O.2 1 UNL1111111111 -0.4341 7 O 0.2941 -4.0733 -1.7533 O.2 1 UNL1111111111 -0.5482 8 N 0.1564 -1.8707 -1.2705 N.am 1 UNL1111111111 -0.6221 9 C -0.8099 -2.1195 -0.1884 C.3 1 UNL1111111111 0.0909 10 C -0.1262 -2.5999 1.1147 C.3 1 UNL1111111111 -0.2916 11 C 0.4776 -1.5216 2.0221 C.3 1 UNL1111111111 -0.2846 12 C 1.1652 -0.4600 1.2242 C.ar 1 UNL1111111111 0.0979 13 C -1.6815 -0.8762 -0.0164 C.ar 1 UNL1111111111 0.0718 14 C 0.3384 0.4457 0.5400 C.ar 1 UNL1111111111 -0.1763 15 C -1.1221 0.2951 0.6326 C.ar 1 UNL1111111111 -0.0508 16 C 2.5504 -0.3629 1.1195 C.ar 1 UNL1111111111 -0.2110 17 C 0.9080 1.4481 -0.2431 C.ar 1 UNL1111111111 0.1760 18 C 3.1171 0.6526 0.3237 C.ar 1 UNL1111111111 0.2049 19 C -2.9216 -0.9365 -0.5394 C.ar 1 UNL1111111111 -0.3276 20 C 2.2990 1.5593 -0.3665 C.ar 1 UNL1111111111 -0.0093 21 C -1.8064 1.2252 1.3407 C.ar 1 UNL1111111111 -0.0694 22 C 3.4510 -1.3250 1.8353 C.3 1 UNL1111111111 0.0279 23 C -3.9122 0.1378 -0.5345 C.ar 1 UNL1111111111 0.4406 24 C -3.2158 1.2728 1.5963 C.ar 1 UNL1111111111 -0.2740 25 C 0.7001 -2.9464 -1.9526 C.2 1 UNL1111111111 0.6165 26 C -4.1742 0.7644 0.7900 C.ar 1 UNL1111111111 0.1326 27 C 1.7707 -2.6015 -2.9484 C.3 1 UNL1111111111 -0.5297 28 C -0.5461 1.9462 -2.0042 C.3 1 UNL1111111111 -0.1949 29 C 5.1781 1.6556 -0.3453 C.3 1 UNL1111111111 -0.1856 30 C 2.4313 3.7816 -1.1353 C.3 1 UNL1111111111 -0.1945 31 C -6.5054 0.6482 0.3509 C.3 1 UNL1111111111 -0.2060 32 H -1.4613 -2.9830 -0.5332 H 1 UNL1111111111 0.1698 33 H -0.8634 -3.1843 1.7011 H 1 UNL1111111111 0.1486 34 H 0.6638 -3.3297 0.8313 H 1 UNL1111111111 0.1644 35 H -0.3189 -1.0617 2.6489 H 1 UNL1111111111 0.1624 36 H 1.1649 -1.9968 2.7571 H 1 UNL1111111111 0.1793 37 H 0.5625 -0.9509 -1.3304 H 1 UNL1111111111 0.3173 38 H -3.2692 -1.8305 -1.0711 H 1 UNL1111111111 0.1895 39 H -1.2340 2.0406 1.8119 H 1 UNL1111111111 0.1693 40 H 3.2045 -2.3809 1.5988 H 1 UNL1111111111 0.1498 41 H 4.5265 -1.1572 1.6313 H 1 UNL1111111111 0.1367 42 H -3.5198 1.7929 2.5125 H 1 UNL1111111111 0.1823 43 H 2.6600 -2.1784 -2.4610 H 1 UNL1111111111 0.1765 44 H 1.4198 -1.8821 -3.6998 H 1 UNL1111111111 0.1747 45 H 2.0927 -3.5074 -3.4867 H 1 UNL1111111111 0.1849 46 H 3.3156 -0.3312 3.5438 H 1 UNL1111111111 0.3169 47 H 0.1787 1.7084 -2.7880 H 1 UNL1111111111 0.1312 48 H -1.1563 2.8154 -2.2813 H 1 UNL1111111111 0.1539 49 H -1.1896 1.0873 -1.7861 H 1 UNL1111111111 0.1428 50 H 6.2192 1.3927 -0.1154 H 1 UNL1111111111 0.1445 51 H 5.0053 1.6545 -1.4277 H 1 UNL1111111111 0.1466 52 H 4.9115 2.6202 0.0954 H 1 UNL1111111111 0.1396 53 H 2.1659 4.0670 -0.1146 H 1 UNL1111111111 0.1376 54 H 1.5682 3.8979 -1.8014 H 1 UNL1111111111 0.1474 55 H 3.2868 4.3626 -1.4969 H 1 UNL1111111111 0.1347 56 H -6.4604 1.3760 -0.4680 H 1 UNL1111111111 0.1558 57 H -6.5039 -0.3748 -0.0362 H 1 UNL1111111111 0.1379 58 H -7.3860 0.8258 0.9819 H 1 UNL1111111111 0.1502 @BOND 1 1 17 1 2 1 28 1 3 2 18 1 4 2 29 1 5 3 20 1 6 3 30 1 7 4 22 1 8 4 46 1 9 5 26 1 10 5 31 1 11 6 23 2 12 7 25 2 13 8 9 1 14 8 25 am 15 8 37 1 16 9 10 1 17 9 13 1 18 9 32 1 19 10 11 1 20 10 33 1 21 10 34 1 22 11 12 1 23 11 35 1 24 11 36 1 25 12 14 ar 26 12 16 ar 27 13 15 ar 28 13 19 ar 29 14 15 1 30 14 17 ar 31 15 21 ar 32 16 18 ar 33 16 22 1 34 17 20 ar 35 18 20 ar 36 19 23 ar 37 19 38 1 38 21 24 ar 39 21 39 1 40 22 40 1 41 22 41 1 42 23 26 ar 43 24 26 ar 44 24 42 1 45 25 27 1 46 27 43 1 47 27 44 1 48 27 45 1 49 28 47 1 50 28 48 1 51 28 49 1 52 29 50 1 53 29 51 1 54 29 52 1 55 30 53 1 56 30 54 1 57 30 55 1 58 31 56 1 59 31 57 1 60 31 58 1