@MOLECULE n-hydroxy-2-[4-(3-{4-[(2s)-2-hydroxy-3,3-dimethylbutoxy]-3-methylphenyl}-3-pentanyl)-2-methylphenoxy]acetamide 72 73 0 0 0 SMALL GASTEIGER @ATOM 1 C -2.7638 -0.5611 0.9396 C.ar 1 UNL111111111 -0.1972 2 C -3.9768 -0.1358 0.4043 C.ar 1 UNL111111111 0.1514 3 C -4.1097 1.0868 -0.2585 C.ar 1 UNL111111111 -0.0022 4 C -2.9793 1.8990 -0.3637 C.ar 1 UNL111111111 -0.1896 5 C -1.7473 1.5003 0.1609 C.ar 1 UNL111111111 0.0041 6 C -1.6542 0.2674 0.8196 C.ar 1 UNL111111111 -0.1666 7 C -0.5481 2.4271 0.1065 C.3 1 UNL111111111 0.0442 8 C 0.7727 1.6924 0.0045 C.ar 1 UNL111111111 -0.0497 9 C -0.5906 3.3973 -1.1119 C.3 1 UNL111111111 -0.2622 10 C -0.6500 3.3106 1.3871 C.3 1 UNL111111111 -0.2619 11 C -0.4991 2.5237 2.6868 C.3 1 UNL111111111 -0.4404 12 C -0.6162 2.6828 -2.4610 C.3 1 UNL111111111 -0.4407 13 C 0.8574 0.4963 -0.7256 C.ar 1 UNL111111111 -0.1540 14 C 2.0633 -0.1698 -0.8817 C.ar 1 UNL111111111 -0.0444 15 C 3.2211 0.3942 -0.3062 C.ar 1 UNL111111111 0.2053 16 C 2.1654 -1.4479 -1.6354 C.3 1 UNL111111111 -0.4283 17 C 3.1664 1.5845 0.4071 C.ar 1 UNL111111111 -0.2801 18 C 1.9351 2.2266 0.5545 C.ar 1 UNL111111111 -0.1285 19 O -5.1260 -0.8637 0.6251 O.3 1 UNL111111111 -0.3803 20 O -8.8361 -1.9633 0.4766 O.3 1 UNL111111111 -0.2941 21 C -5.1671 -2.0978 -0.0859 C.3 1 UNL111111111 -0.1238 22 C -6.6467 -2.3972 -0.2752 C.2 1 UNL111111111 0.5168 23 N -7.4738 -2.0205 0.7876 N.am 1 UNL111111111 -0.3716 24 O -7.0639 -3.0585 -1.1994 O.2 1 UNL111111111 -0.4947 25 C 6.8643 -1.9885 0.4811 C.3 1 UNL111111111 0.0691 26 C 5.5377 -2.6997 0.7742 C.3 1 UNL111111111 -0.4605 27 C 7.4581 -1.4378 1.7849 C.3 1 UNL111111111 -0.4651 28 C 7.8530 -2.9829 -0.1454 C.3 1 UNL111111111 -0.4603 29 C 5.5812 0.1989 -0.0921 C.3 1 UNL111111111 -0.1103 30 O 4.3374 -0.3524 -0.5241 O.3 1 UNL111111111 -0.3328 31 C 6.6094 -0.8584 -0.5487 C.3 1 UNL111111111 0.1142 32 O 7.8000 -0.1812 -0.8801 O.3 1 UNL111111111 -0.5490 33 C -5.4198 1.5217 -0.8110 C.3 1 UNL111111111 -0.4404 34 H -2.6948 -1.5138 1.4578 H 1 UNL111111111 0.1646 35 H -3.0754 2.8630 -0.8626 H 1 UNL111111111 0.1632 36 H -0.7035 -0.0443 1.2556 H 1 UNL111111111 0.1686 37 H -1.4647 4.0693 -1.0247 H 1 UNL111111111 0.1347 38 H 0.2985 4.0580 -1.0655 H 1 UNL111111111 0.1425 39 H 0.1082 4.1145 1.3440 H 1 UNL111111111 0.1363 40 H -1.6306 3.8262 1.3831 H 1 UNL111111111 0.1408 41 H -1.3583 1.8631 2.8584 H 1 UNL111111111 0.1517 42 H 0.3989 1.8942 2.6795 H 1 UNL111111111 0.1518 43 H -0.4267 3.1949 3.5491 H 1 UNL111111111 0.1395 44 H -1.4196 1.9391 -2.5138 H 1 UNL111111111 0.1492 45 H -0.7647 3.3921 -3.2820 H 1 UNL111111111 0.1409 46 H 0.3278 2.1561 -2.6524 H 1 UNL111111111 0.1540 47 H -0.0413 0.0846 -1.1889 H 1 UNL111111111 0.1652 48 H 2.9041 -1.3695 -2.4496 H 1 UNL111111111 0.1640 49 H 2.5062 -2.2641 -0.9794 H 1 UNL111111111 0.1598 50 H 1.2125 -1.7572 -2.0822 H 1 UNL111111111 0.1499 51 H 4.0540 2.0266 0.8453 H 1 UNL111111111 0.1593 52 H 1.9030 3.1647 1.1077 H 1 UNL111111111 0.1540 53 H -9.0657 -2.8926 0.1572 H 1 UNL111111111 0.3106 54 H -4.6600 -2.0257 -1.0672 H 1 UNL111111111 0.1675 55 H -4.6742 -2.8737 0.5302 H 1 UNL111111111 0.1605 56 H -7.2864 -1.1894 1.3357 H 1 UNL111111111 0.3206 57 H 5.0710 -3.0727 -0.1450 H 1 UNL111111111 0.1508 58 H 5.6821 -3.5535 1.4438 H 1 UNL111111111 0.1461 59 H 4.8112 -2.0272 1.2472 H 1 UNL111111111 0.1561 60 H 6.7864 -0.7258 2.2750 H 1 UNL111111111 0.1455 61 H 7.6356 -2.2494 2.5018 H 1 UNL111111111 0.1533 62 H 8.4221 -0.9458 1.6220 H 1 UNL111111111 0.1385 63 H 8.7817 -2.4836 -0.4483 H 1 UNL111111111 0.1551 64 H 8.1142 -3.7827 0.5540 H 1 UNL111111111 0.1441 65 H 7.4350 -3.4553 -1.0414 H 1 UNL111111111 0.1483 66 H 5.7617 1.1605 -0.6069 H 1 UNL111111111 0.1478 67 H 5.5637 0.3490 0.9976 H 1 UNL111111111 0.1305 68 H 6.2974 -1.2871 -1.5330 H 1 UNL111111111 0.1608 69 H 8.2928 0.0876 -0.0801 H 1 UNL111111111 0.3127 70 H -5.9816 2.1109 -0.0689 H 1 UNL111111111 0.1637 71 H -5.3100 2.1446 -1.7092 H 1 UNL111111111 0.1568 72 H -6.0585 0.6681 -1.0851 H 1 UNL111111111 0.1640 @BOND 1 1 2 ar 2 1 6 ar 3 1 34 1 4 2 3 ar 5 3 4 ar 6 3 33 1 7 4 35 1 8 5 4 ar 9 5 7 1 10 6 5 ar 11 6 36 1 12 7 10 1 13 8 13 ar 14 8 7 1 15 9 7 1 16 9 37 1 17 9 38 1 18 10 11 1 19 10 39 1 20 10 40 1 21 11 41 1 22 11 42 1 23 11 43 1 24 12 9 1 25 12 44 1 26 12 45 1 27 12 46 1 28 13 47 1 29 14 16 1 30 14 13 ar 31 15 14 ar 32 16 48 1 33 16 49 1 34 16 50 1 35 17 15 ar 36 17 18 ar 37 17 51 1 38 18 8 ar 39 18 52 1 40 19 2 1 41 19 21 1 42 20 23 1 43 20 53 1 44 21 54 1 45 21 55 1 46 22 21 1 47 22 24 2 48 23 22 am 49 23 56 1 50 25 31 1 51 26 25 1 52 26 57 1 53 26 58 1 54 26 59 1 55 27 25 1 56 27 60 1 57 27 61 1 58 27 62 1 59 28 25 1 60 28 63 1 61 28 64 1 62 28 65 1 63 29 30 1 64 29 66 1 65 29 67 1 66 30 15 1 67 31 29 1 68 31 32 1 69 31 68 1 70 32 69 1 71 33 70 1 72 33 71 1 73 33 72 1