@MOLECULE 2,3-dimethoxy-6-[(2e,5e,7e,9r,10r,11e)-10-methoxy-3,7,9,11-tetramethyl-2,5,7,11-tetradecatetraen-1-yl]-5-methyl-4-pyridinol 73 73 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O 4.5160 -0.5215 1.4883 O.3 1 UNL1 -0.3896 2 O -1.1678 -0.1704 -2.3501 O.3 1 UNL1 -0.3399 3 O -2.2392 -2.7794 -1.7750 O.3 1 UNL1 -0.2860 4 O -3.6345 -2.9624 0.6877 O.2 1 UNL1 -0.5172 5 N -2.1057 0.6126 -0.4883 N.ar 1 UNL1 -0.4391 6 C 4.1060 0.2516 -0.6902 C.3 1 UNL1 -0.1073 7 C 4.1138 -1.0125 0.2145 C.3 1 UNL1 0.0873 8 C 2.7446 -1.6411 0.2773 C.2 1 UNL1 -0.0973 9 C 3.1844 1.2742 -0.1065 C.2 1 UNL1 -0.1621 10 C 5.5214 0.8296 -0.7951 C.3 1 UNL1 -0.4438 11 C 2.1088 1.7967 -0.7174 C.2 1 UNL1 -0.0138 12 C 1.8490 -1.2231 1.1797 C.2 1 UNL1 -0.1362 13 C 2.5074 -2.7252 -0.7172 C.3 1 UNL1 -0.4418 14 C 0.4772 -1.7839 1.3400 C.3 1 UNL1 -0.2608 15 C 1.2546 2.7323 0.0164 C.2 1 UNL1 -0.1559 16 C 1.6954 1.4621 -2.1120 C.3 1 UNL1 -0.4429 17 C -3.0875 1.8338 1.4032 C.3 1 UNL1 -0.2834 18 C -0.4953 4.4805 0.2433 C.3 1 UNL1 -0.3047 19 C -2.8764 0.5350 0.6678 C.ar 1 UNL1 0.2083 20 C 4.8527 -1.5403 2.4096 C.3 1 UNL1 -0.2024 21 C -1.7956 3.7280 0.3634 C.2 1 UNL1 0.0536 22 C 0.4369 3.6223 -0.5595 C.2 1 UNL1 -0.1609 23 C -1.9140 2.7467 1.2684 C.2 1 UNL1 -0.2408 24 C -3.4189 -0.6496 1.0693 C.ar 1 UNL1 -0.2370 25 C -0.3022 -1.0733 2.4479 C.3 1 UNL1 -0.4370 26 C -3.1952 -1.8902 0.3161 C.ar 1 UNL1 0.4725 27 C -1.8785 -0.5248 -1.2472 C.ar 1 UNL1 0.3555 28 C -2.8482 4.1186 -0.6139 C.3 1 UNL1 -0.4658 29 C -2.3978 -1.7428 -0.8977 C.ar 1 UNL1 -0.1651 30 C -4.2673 -0.7577 2.2845 C.3 1 UNL1 -0.4090 31 C -0.4905 -1.2292 -3.0259 C.3 1 UNL1 -0.1661 32 C -1.7314 -3.9700 -1.1705 C.3 1 UNL1 -0.2160 33 H 3.7675 -0.0686 -1.7065 H 1 UNL1 0.1415 34 H 4.8781 -1.7360 -0.1471 H 1 UNL1 0.1198 35 H 3.4496 1.5662 0.9131 H 1 UNL1 0.1614 36 H 5.9253 1.0610 0.2001 H 1 UNL1 0.1623 37 H 6.2090 0.1261 -1.2734 H 1 UNL1 0.1386 38 H 5.5257 1.7578 -1.3771 H 1 UNL1 0.1466 39 H 2.1047 -0.4124 1.8678 H 1 UNL1 0.1619 40 H 2.8998 -2.4612 -1.7084 H 1 UNL1 0.1453 41 H 3.0007 -3.6579 -0.4058 H 1 UNL1 0.1526 42 H 1.4402 -2.9540 -0.8423 H 1 UNL1 0.1535 43 H -0.0828 -1.6996 0.3825 H 1 UNL1 0.1510 44 H 0.5302 -2.8715 1.5576 H 1 UNL1 0.1465 45 H 1.3090 2.6459 1.1055 H 1 UNL1 0.1511 46 H 2.0084 2.2489 -2.8124 H 1 UNL1 0.1535 47 H 2.1283 0.5166 -2.4651 H 1 UNL1 0.1491 48 H 0.6032 1.3541 -2.1940 H 1 UNL1 0.1611 49 H -3.2763 1.6275 2.4832 H 1 UNL1 0.1747 50 H -4.0287 2.3067 1.0424 H 1 UNL1 0.1680 51 H -0.6381 5.4686 -0.2375 H 1 UNL1 0.1525 52 H -0.0746 4.7125 1.2440 H 1 UNL1 0.1589 53 H 4.0029 -2.2071 2.5898 H 1 UNL1 0.1289 54 H 5.7229 -2.1055 2.0634 H 1 UNL1 0.1176 55 H 5.0967 -0.9788 3.3196 H 1 UNL1 0.1423 56 H 0.3744 3.7529 -1.6361 H 1 UNL1 0.1472 57 H -1.0981 2.5245 1.9581 H 1 UNL1 0.1610 58 H -0.4378 -0.0101 2.2188 H 1 UNL1 0.1428 59 H -1.3023 -1.5120 2.5672 H 1 UNL1 0.1548 60 H 0.2098 -1.1481 3.4123 H 1 UNL1 0.1403 61 H -1.6583 1.4885 -0.7565 H 1 UNL1 0.3423 62 H -3.6690 3.3918 -0.6860 H 1 UNL1 0.1595 63 H -2.4385 4.2363 -1.6285 H 1 UNL1 0.1614 64 H -3.2988 5.0844 -0.3362 H 1 UNL1 0.1627 65 H -5.1558 -0.1152 2.2260 H 1 UNL1 0.1450 66 H -3.7135 -0.5012 3.1981 H 1 UNL1 0.1448 67 H -4.6364 -1.7919 2.4240 H 1 UNL1 0.1815 68 H 0.1481 -0.6779 -3.7272 H 1 UNL1 0.1433 69 H -1.2187 -1.8527 -3.5600 H 1 UNL1 0.1552 70 H 0.1059 -1.8275 -2.3303 H 1 UNL1 0.1416 71 H -1.5154 -4.6009 -2.0382 H 1 UNL1 0.1342 72 H -2.5075 -4.4289 -0.5417 H 1 UNL1 0.1671 73 H -0.8333 -3.7735 -0.5830 H 1 UNL1 0.1206 @BOND 1 68 31 1 2 69 31 1 3 31 2 1 4 31 70 1 5 46 16 1 6 47 16 1 7 2 27 1 8 48 16 1 9 16 11 1 10 71 32 1 11 3 32 1 12 3 29 1 13 40 13 1 14 33 6 1 15 56 22 1 16 63 28 1 17 38 10 1 18 37 10 1 19 27 29 ar 20 27 5 ar 21 32 73 1 22 32 72 1 23 29 26 ar 24 42 13 1 25 10 6 1 26 10 36 1 27 61 5 1 28 11 9 2 29 11 15 1 30 13 41 1 31 13 8 1 32 6 9 1 33 6 7 1 34 62 28 1 35 28 64 1 36 28 21 1 37 22 15 2 38 22 18 1 39 5 19 ar 40 51 18 1 41 34 7 1 42 9 35 1 43 15 45 1 44 7 8 1 45 7 1 1 46 18 21 1 47 18 52 1 48 8 12 2 49 26 4 2 50 26 24 ar 51 21 23 2 52 43 14 1 53 19 24 ar 54 19 17 1 55 50 17 1 56 24 30 1 57 12 14 1 58 12 39 1 59 23 17 1 60 23 57 1 61 14 44 1 62 14 25 1 63 17 49 1 64 1 20 1 65 54 20 1 66 58 25 1 67 65 30 1 68 30 67 1 69 30 66 1 70 20 53 1 71 20 55 1 72 25 59 1 73 25 60 1