@MOLECULE 1-methoxy-6,6,9-trimethyl-3-pentyl-6a,7,10,10a-tetrahydro-6h-benzo[c]chromene 56 58 0 0 0 SMALL USER_CHARGES @ATOM 1 O -0.6042 2.1249 0.4181 O.3 1 UNL111111111 -0.3684 2 O -0.4765 -2.6546 -0.2435 O.3 1 UNL111111111 -0.3672 3 C -2.7650 1.0811 0.1576 C.3 1 UNL111111111 -0.1815 4 C -2.1337 -0.2640 -0.2673 C.3 1 UNL111111111 -0.0709 5 C -1.8711 2.2568 -0.2612 C.3 1 UNL111111111 0.2986 6 C -4.1858 1.1703 -0.4145 C.3 1 UNL111111111 -0.2625 7 C -2.9172 -1.3841 0.4463 C.3 1 UNL111111111 -0.2972 8 C -0.6783 -0.2811 0.0719 C.ar 1 UNL111111111 -0.2491 9 C -4.3963 -1.2124 0.2914 C.2 1 UNL111111111 0.0420 10 C -0.0182 0.9067 0.4188 C.ar 1 UNL111111111 0.2909 11 C -1.5832 2.3391 -1.7590 C.3 1 UNL111111111 -0.4965 12 C -2.3749 3.5950 0.2862 C.3 1 UNL111111111 -0.4772 13 C -4.9665 -0.0633 -0.0920 C.2 1 UNL111111111 -0.2329 14 C 0.1010 -1.4403 0.0647 C.ar 1 UNL111111111 0.2668 15 C 1.3259 0.9311 0.8157 C.ar 1 UNL111111111 -0.3141 16 C -5.2034 -2.4289 0.6066 C.3 1 UNL111111111 -0.4580 17 C 2.0485 -0.2576 0.8369 C.ar 1 UNL111111111 0.1084 18 C 1.4425 -1.4521 0.4413 C.ar 1 UNL111111111 -0.3191 19 C 3.4891 -0.2513 1.2487 C.3 1 UNL111111111 -0.2907 20 C 4.3741 -0.0395 0.0099 C.3 1 UNL111111111 -0.2579 21 C 5.8568 -0.0336 0.3975 C.3 1 UNL111111111 -0.2734 22 C -0.3961 -2.9507 -1.6338 C.3 1 UNL111111111 -0.1858 23 C 6.7393 0.1747 -0.8406 C.3 1 UNL111111111 -0.2523 24 C 8.2200 0.1800 -0.4607 C.3 1 UNL111111111 -0.4412 25 H -2.8323 1.0926 1.2770 H 1 UNL111111111 0.1640 26 H -2.2550 -0.3975 -1.3720 H 1 UNL111111111 0.1449 27 H -4.1554 1.3082 -1.5154 H 1 UNL111111111 0.1451 28 H -4.7010 2.0651 -0.0108 H 1 UNL111111111 0.1426 29 H -2.6489 -1.4039 1.5234 H 1 UNL111111111 0.1619 30 H -2.6014 -2.3743 0.0551 H 1 UNL111111111 0.1711 31 H -2.4939 2.5222 -2.3366 H 1 UNL111111111 0.1536 32 H -0.8773 3.1516 -1.9743 H 1 UNL111111111 0.1618 33 H -1.1254 1.4151 -2.1326 H 1 UNL111111111 0.1606 34 H -2.6174 3.5252 1.3536 H 1 UNL111111111 0.1604 35 H -1.6046 4.3714 0.1853 H 1 UNL111111111 0.1631 36 H -3.2672 3.9326 -0.2485 H 1 UNL111111111 0.1535 37 H -6.0419 0.0367 -0.1994 H 1 UNL111111111 0.1423 38 H 1.7822 1.8767 1.0927 H 1 UNL111111111 0.1772 39 H -5.0389 -3.2150 -0.1444 H 1 UNL111111111 0.1549 40 H -6.2815 -2.2275 0.6339 H 1 UNL111111111 0.1491 41 H -4.9279 -2.8501 1.5841 H 1 UNL111111111 0.1575 42 H 1.9960 -2.3851 0.4309 H 1 UNL111111111 0.1718 43 H 3.6835 0.5441 1.9960 H 1 UNL111111111 0.1521 44 H 3.7590 -1.2007 1.7532 H 1 UNL111111111 0.1506 45 H 4.1037 0.9126 -0.4858 H 1 UNL111111111 0.1434 46 H 4.1757 -0.8338 -0.7343 H 1 UNL111111111 0.1401 47 H 6.0541 0.7628 1.1390 H 1 UNL111111111 0.1368 48 H 6.1248 -0.9837 0.8957 H 1 UNL111111111 0.1359 49 H 0.6490 -3.0105 -1.9536 H 1 UNL111111111 0.1299 50 H -0.9434 -2.2062 -2.2200 H 1 UNL111111111 0.1277 51 H -0.8800 -3.9322 -1.7009 H 1 UNL111111111 0.1450 52 H 6.4738 1.1263 -1.3388 H 1 UNL111111111 0.1345 53 H 6.5430 -0.6211 -1.5837 H 1 UNL111111111 0.1333 54 H 8.5178 -0.7659 0.0050 H 1 UNL111111111 0.1420 55 H 8.8555 0.3279 -1.3406 H 1 UNL111111111 0.1400 56 H 8.4487 0.9830 0.2489 H 1 UNL111111111 0.1424 @BOND 1 31 11 1 2 50 22 1 3 33 11 1 4 32 11 1 5 49 22 1 6 11 5 1 7 51 22 1 8 22 2 1 9 53 23 1 10 27 6 1 11 26 4 1 12 55 24 1 13 52 23 1 14 23 24 1 15 23 21 1 16 46 20 1 17 45 20 1 18 24 54 1 19 24 56 1 20 6 13 1 21 6 28 1 22 6 3 1 23 4 8 1 24 4 3 1 25 4 7 1 26 5 3 1 27 5 12 1 28 5 1 1 29 36 12 1 30 2 14 1 31 37 13 1 32 39 16 1 33 13 9 2 34 20 21 1 35 20 19 1 36 30 7 1 37 14 8 ar 38 14 18 ar 39 8 10 ar 40 3 25 1 41 35 12 1 42 12 34 1 43 9 7 1 44 9 16 1 45 21 48 1 46 21 47 1 47 1 10 1 48 10 15 ar 49 42 18 1 50 18 17 ar 51 7 29 1 52 16 40 1 53 16 41 1 54 15 17 ar 55 15 38 1 56 17 19 1 57 19 44 1 58 19 43 1