@MOLECULE (1s,2r,3s)-1-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2,3-dimethyl-1,2,3,4-tetrahydronaphthalene 54 56 0 0 0 SMALL GASTEIGER @ATOM 1 O 3.3047 -2.0274 1.4187 O.3 1 UNL1111111111 -0.3419 2 O 4.4437 -1.1068 -1.0617 O.3 1 UNL1111111111 -0.3413 3 O -2.5691 -1.4685 -1.8277 O.3 1 UNL1111111111 -0.3436 4 O -4.4762 -2.0054 0.2656 O.3 1 UNL1111111111 -0.3396 5 C -0.2933 2.8904 0.6984 C.3 1 UNL1111111111 -0.0881 6 C -0.1504 2.9408 -0.8347 C.3 1 UNL1111111111 -0.0837 7 C -0.0743 1.4399 1.2054 C.3 1 UNL1111111111 -0.1268 8 C 1.2880 2.5496 -1.2227 C.3 1 UNL1111111111 -0.2934 9 C 1.1698 0.8222 0.6249 C.ar 1 UNL1111111111 -0.0337 10 C 1.7793 1.3185 -0.5300 C.ar 1 UNL1111111111 0.0111 11 C -1.6500 3.4180 1.1695 C.3 1 UNL1111111111 -0.4554 12 C -1.2534 0.5462 0.9064 C.ar 1 UNL1111111111 0.0164 13 C -0.4553 4.3344 -1.3938 C.3 1 UNL1111111111 -0.4579 14 C 1.6810 -0.3181 1.2525 C.ar 1 UNL1111111111 -0.1901 15 C 2.9061 0.6770 -1.0560 C.ar 1 UNL1111111111 -0.2264 16 C -1.3665 -0.1010 -0.3250 C.ar 1 UNL1111111111 -0.2046 17 C 2.7937 -0.9600 0.7222 C.ar 1 UNL1111111111 0.1140 18 C -2.2280 0.3435 1.8884 C.ar 1 UNL1111111111 -0.1787 19 C 3.4113 -0.4596 -0.4331 C.ar 1 UNL1111111111 0.1425 20 C -2.4566 -0.9314 -0.5690 C.ar 1 UNL1111111111 0.1339 21 C -3.3244 -0.4791 1.6435 C.ar 1 UNL1111111111 -0.1818 22 C -3.4410 -1.1184 0.4101 C.ar 1 UNL1111111111 0.1204 23 C 3.0952 -3.2669 0.7436 C.3 1 UNL1111111111 -0.1977 24 C 5.6406 -1.1466 -0.2876 C.3 1 UNL1111111111 -0.1982 25 C -2.3203 -2.8733 -1.8448 C.3 1 UNL1111111111 -0.1955 26 C -5.3925 -1.6433 -0.7653 C.3 1 UNL1111111111 -0.1991 27 H 0.5102 3.5262 1.1462 H 1 UNL1111111111 0.1358 28 H -0.8648 2.2113 -1.2881 H 1 UNL1111111111 0.1480 29 H 0.0568 1.5061 2.3204 H 1 UNL1111111111 0.1552 30 H 1.9785 3.3890 -0.9880 H 1 UNL1111111111 0.1543 31 H 1.3441 2.4204 -2.3237 H 1 UNL1111111111 0.1525 32 H -1.7471 4.4931 0.9870 H 1 UNL1111111111 0.1415 33 H -2.4780 2.9180 0.6513 H 1 UNL1111111111 0.1562 34 H -1.7914 3.2575 2.2436 H 1 UNL1111111111 0.1422 35 H 0.1278 5.1112 -0.8891 H 1 UNL1111111111 0.1416 36 H -0.2290 4.3908 -2.4643 H 1 UNL1111111111 0.1431 37 H -1.5151 4.5870 -1.2768 H 1 UNL1111111111 0.1466 38 H 1.2082 -0.7220 2.1473 H 1 UNL1111111111 0.1751 39 H 3.3932 1.0517 -1.9539 H 1 UNL1111111111 0.1709 40 H -0.6068 0.0220 -1.0991 H 1 UNL1111111111 0.1839 41 H -2.1359 0.8342 2.8553 H 1 UNL1111111111 0.1563 42 H -4.0880 -0.6365 2.4023 H 1 UNL1111111111 0.1661 43 H 2.0236 -3.4693 0.6505 H 1 UNL1111111111 0.1324 44 H 3.5722 -3.9904 1.4138 H 1 UNL1111111111 0.1417 45 H 3.5792 -3.2646 -0.2392 H 1 UNL1111111111 0.1417 46 H 6.3292 -1.6936 -0.9419 H 1 UNL1111111111 0.1436 47 H 5.4858 -1.6834 0.6548 H 1 UNL1111111111 0.1465 48 H 6.0038 -0.1318 -0.1007 H 1 UNL1111111111 0.1290 49 H -3.0292 -3.4047 -1.2008 H 1 UNL1111111111 0.1402 50 H -1.2882 -3.0759 -1.5415 H 1 UNL1111111111 0.1331 51 H -2.4762 -3.1328 -2.8979 H 1 UNL1111111111 0.1431 52 H -5.8710 -0.6891 -0.5270 H 1 UNL1111111111 0.1286 53 H -6.1198 -2.4628 -0.7367 H 1 UNL1111111111 0.1432 54 H -4.8947 -1.5964 -1.7402 H 1 UNL1111111111 0.1468 @BOND 1 1 17 1 2 1 23 1 3 2 19 1 4 2 24 1 5 3 20 1 6 3 25 1 7 4 22 1 8 4 26 1 9 5 6 1 10 5 7 1 11 5 11 1 12 5 27 1 13 6 8 1 14 6 13 1 15 6 28 1 16 7 9 1 17 7 12 1 18 7 29 1 19 8 10 1 20 8 30 1 21 8 31 1 22 9 10 ar 23 9 14 ar 24 10 15 ar 25 11 32 1 26 11 33 1 27 11 34 1 28 12 16 ar 29 12 18 ar 30 13 35 1 31 13 36 1 32 13 37 1 33 14 17 ar 34 14 38 1 35 15 19 ar 36 15 39 1 37 16 20 ar 38 16 40 1 39 17 19 ar 40 18 21 ar 41 18 41 1 42 20 22 ar 43 21 22 ar 44 21 42 1 45 23 43 1 46 23 44 1 47 23 45 1 48 24 46 1 49 24 47 1 50 24 48 1 51 25 49 1 52 25 50 1 53 25 51 1 54 26 52 1 55 26 53 1 56 26 54 1