@MOLECULE 4-(1-hydroxy-2-{[4-(2-methoxyphenyl)-2-methyl-2-butanyl]amino}ethyl)phenol 51 52 0 0 0 SMALL GASTEIGER @ATOM 1 O -1.9800 -3.0244 0.7067 O.3 1 UNL1111111111 -0.5731 2 O 0.7104 1.3938 1.3338 O.3 1 UNL1111111111 -0.3609 3 O -5.2881 2.0255 -0.9773 O.3 1 UNL1111111111 -0.4795 4 N 0.8216 -2.4746 0.4152 N.3 1 UNL1111111111 -0.5806 5 C 2.0356 -2.6155 -0.4222 C.3 1 UNL1111111111 0.2675 6 C 2.5907 -1.2262 -0.8299 C.3 1 UNL1111111111 -0.2868 7 C 2.8043 -0.2980 0.3774 C.3 1 UNL1111111111 -0.2802 8 C 1.7753 -3.4314 -1.7110 C.3 1 UNL1111111111 -0.5140 9 C 3.0729 -3.3664 0.4392 C.3 1 UNL1111111111 -0.4735 10 C -0.2726 -1.6977 -0.2052 C.3 1 UNL1111111111 -0.1255 11 C -1.4676 -1.7013 0.7731 C.3 1 UNL1111111111 0.1466 12 C 2.6717 1.1337 -0.0260 C.ar 1 UNL1111111111 -0.0402 13 C -2.4954 -0.7004 0.3271 C.ar 1 UNL1111111111 -0.1566 14 C 1.6567 1.9432 0.4957 C.ar 1 UNL1111111111 0.1760 15 C 3.5494 1.7047 -0.9505 C.ar 1 UNL1111111111 -0.1571 16 C -2.3786 0.6270 0.7405 C.ar 1 UNL1111111111 -0.0682 17 C -3.5346 -1.0863 -0.5235 C.ar 1 UNL1111111111 -0.0706 18 C 1.4949 3.2754 0.1140 C.ar 1 UNL1111111111 -0.2057 19 C 3.4054 3.0344 -1.3404 C.ar 1 UNL1111111111 -0.1658 20 C 2.3776 3.8173 -0.8151 C.ar 1 UNL1111111111 -0.1432 21 C -3.3012 1.5798 0.3190 C.ar 1 UNL1111111111 -0.3087 22 C -4.4735 -0.1563 -0.9523 C.ar 1 UNL1111111111 -0.2540 23 C -4.3380 1.1673 -0.5203 C.ar 1 UNL1111111111 0.2945 24 C 1.0583 1.5097 2.7095 C.3 1 UNL1111111111 -0.1895 25 H 3.5412 -1.3621 -1.3763 H 1 UNL1111111111 0.1361 26 H 1.8989 -0.7497 -1.5502 H 1 UNL1111111111 0.1484 27 H 0.4700 -3.3884 0.7060 H 1 UNL1111111111 0.2725 28 H 2.0586 -0.5559 1.1686 H 1 UNL1111111111 0.1933 29 H 3.7936 -0.4843 0.8359 H 1 UNL1111111111 0.1420 30 H 1.3334 -4.4053 -1.4804 H 1 UNL1111111111 0.1492 31 H 2.7039 -3.6117 -2.2592 H 1 UNL1111111111 0.1494 32 H 1.0877 -2.9117 -2.3853 H 1 UNL1111111111 0.1522 33 H 4.0456 -3.4044 -0.0577 H 1 UNL1111111111 0.1447 34 H 2.7591 -4.3942 0.6436 H 1 UNL1111111111 0.1431 35 H 3.2053 -2.8672 1.4071 H 1 UNL1111111111 0.1583 36 H -0.5957 -2.0973 -1.1894 H 1 UNL1111111111 0.1332 37 H 0.0702 -0.6473 -0.3554 H 1 UNL1111111111 0.1635 38 H -1.1286 -1.5222 1.8202 H 1 UNL1111111111 0.1366 39 H 4.3508 1.1001 -1.3717 H 1 UNL1111111111 0.1542 40 H -2.7644 -3.1185 1.2786 H 1 UNL1111111111 0.3179 41 H -1.5497 0.9274 1.3863 H 1 UNL1111111111 0.1672 42 H -3.6015 -2.1239 -0.8582 H 1 UNL1111111111 0.1654 43 H 0.6848 3.8650 0.5332 H 1 UNL1111111111 0.1623 44 H 4.0970 3.4628 -2.0626 H 1 UNL1111111111 0.1501 45 H 2.2662 4.8525 -1.1316 H 1 UNL1111111111 0.1497 46 H -3.2093 2.6130 0.6313 H 1 UNL1111111111 0.1583 47 H -5.2922 -0.4313 -1.6107 H 1 UNL1111111111 0.1735 48 H 0.2557 0.9537 3.2102 H 1 UNL1111111111 0.1484 49 H 2.0287 1.0462 2.9109 H 1 UNL1111111111 0.1303 50 H 1.0574 2.5602 3.0138 H 1 UNL1111111111 0.1233 51 H -5.1411 2.9484 -0.6621 H 1 UNL1111111111 0.3261 @BOND 1 1 11 1 2 1 40 1 3 2 14 1 4 2 24 1 5 3 23 1 6 3 51 1 7 4 5 1 8 4 10 1 9 4 27 1 10 5 6 1 11 5 8 1 12 5 9 1 13 6 7 1 14 6 25 1 15 6 26 1 16 7 12 1 17 7 28 1 18 7 29 1 19 8 30 1 20 8 31 1 21 8 32 1 22 9 33 1 23 9 34 1 24 9 35 1 25 10 11 1 26 10 36 1 27 10 37 1 28 11 13 1 29 11 38 1 30 12 14 ar 31 12 15 ar 32 13 16 ar 33 13 17 ar 34 14 18 ar 35 15 19 ar 36 15 39 1 37 16 21 ar 38 16 41 1 39 17 22 ar 40 17 42 1 41 18 20 ar 42 18 43 1 43 19 20 ar 44 19 44 1 45 20 45 1 46 21 23 ar 47 21 46 1 48 22 23 ar 49 22 47 1 50 24 48 1 51 24 49 1 52 24 50 1