@MOLECULE n-{2-[4-(1,3-benzodioxol-5-yl)-2-(2-methyl-2-propanyl)phenoxy]ethyl}-n-methylglycine 55 57 0 0 0 SMALL GASTEIGER @ATOM 1 O -2.0565 0.3068 -0.6474 O.3 1 UNL1111111111 -0.3592 2 O 6.3881 0.1423 1.8003 O.3 1 UNL1111111111 -0.3431 3 O 7.5199 -0.9835 0.0647 O.3 1 UNL1111111111 -0.3444 4 O -7.4231 -0.9943 1.8832 O.3 1 UNL1111111111 -0.5675 5 O -7.6757 -2.2120 0.0316 O.2 1 UNL1111111111 -0.4981 6 N -5.0890 -0.3393 0.0839 N.3 1 UNL1111111111 -0.3905 7 C -0.4603 2.5192 -0.2438 C.3 1 UNL1111111111 0.1388 8 C 0.1068 1.1196 -0.3514 C.ar 1 UNL1111111111 -0.1023 9 C 0.6313 3.5764 0.0170 C.3 1 UNL1111111111 -0.4622 10 C -1.4555 2.5838 0.9290 C.3 1 UNL1111111111 -0.4663 11 C -1.1602 2.8814 -1.5667 C.3 1 UNL1111111111 -0.4630 12 C -0.7347 0.0032 -0.5672 C.ar 1 UNL1111111111 0.2364 13 C 1.4693 0.8704 -0.2557 C.ar 1 UNL1111111111 -0.1133 14 C 1.9921 -0.4262 -0.3650 C.ar 1 UNL1111111111 -0.0797 15 C -0.2358 -1.2940 -0.6673 C.ar 1 UNL1111111111 -0.2972 16 C 1.1377 -1.5059 -0.5647 C.ar 1 UNL1111111111 -0.0865 17 C 3.4435 -0.6204 -0.2772 C.ar 1 UNL1111111111 0.0113 18 C -2.9575 -0.7192 -1.0717 C.3 1 UNL1111111111 -0.0516 19 C -4.3119 0.0109 -1.1268 C.3 1 UNL1111111111 -0.1294 20 C 4.1325 -0.0949 0.8390 C.ar 1 UNL1111111111 -0.1993 21 C 4.1149 -1.2914 -1.2981 C.ar 1 UNL1111111111 -0.1640 22 C 5.4923 -0.2765 0.8475 C.ar 1 UNL1111111111 0.1333 23 C 6.1711 -0.9523 -0.1936 C.ar 1 UNL1111111111 0.1188 24 C 5.5096 -1.4739 -1.2779 C.ar 1 UNL1111111111 -0.1824 25 C -6.5286 -0.0485 -0.0845 C.3 1 UNL1111111111 -0.1876 26 C -4.5584 0.3174 1.2946 C.3 1 UNL1111111111 -0.2810 27 C 7.6814 -0.2902 1.3221 C.3 1 UNL1111111111 0.1582 28 C -7.2507 -1.2195 0.5545 C.2 1 UNL1111111111 0.6504 29 H 1.3583 3.6161 -0.8009 H 1 UNL1111111111 0.1474 30 H 0.1899 4.5753 0.1042 H 1 UNL1111111111 0.1462 31 H 1.1680 3.3786 0.9509 H 1 UNL1111111111 0.1485 32 H -0.9851 2.2526 1.8608 H 1 UNL1111111111 0.1494 33 H -1.8232 3.6034 1.0790 H 1 UNL1111111111 0.1439 34 H -2.3295 1.9468 0.7575 H 1 UNL1111111111 0.1546 35 H -1.5207 3.9144 -1.5542 H 1 UNL1111111111 0.1439 36 H -0.4755 2.7725 -2.4147 H 1 UNL1111111111 0.1481 37 H -2.0235 2.2358 -1.7591 H 1 UNL1111111111 0.1524 38 H 2.1731 1.6909 -0.1023 H 1 UNL1111111111 0.1651 39 H -0.8952 -2.1423 -0.8168 H 1 UNL1111111111 0.1638 40 H 1.5385 -2.5164 -0.6360 H 1 UNL1111111111 0.1561 41 H -2.9613 -1.5472 -0.3385 H 1 UNL1111111111 0.1558 42 H -2.6486 -1.0892 -2.0633 H 1 UNL1111111111 0.1308 43 H -4.8679 -0.3328 -2.0274 H 1 UNL1111111111 0.1490 44 H -4.1447 1.1060 -1.2409 H 1 UNL1111111111 0.1416 45 H 3.6061 0.4161 1.6390 H 1 UNL1111111111 0.1808 46 H 3.5497 -1.6788 -2.1457 H 1 UNL1111111111 0.1641 47 H 6.0258 -1.9937 -2.0777 H 1 UNL1111111111 0.1725 48 H -6.8542 0.9089 0.3808 H 1 UNL1111111111 0.1593 49 H -6.8217 -0.0026 -1.1582 H 1 UNL1111111111 0.1657 50 H -5.1269 -0.0374 2.1735 H 1 UNL1111111111 0.1622 51 H -3.5059 0.0118 1.4382 H 1 UNL1111111111 0.1624 52 H -4.5964 1.4166 1.2727 H 1 UNL1111111111 0.1230 53 H 8.0858 -1.0063 2.0504 H 1 UNL1111111111 0.1411 54 H 8.2865 0.6075 1.1352 H 1 UNL1111111111 0.1401 55 H -7.8616 -1.7401 2.3599 H 1 UNL1111111111 0.3535 @BOND 1 1 12 1 2 1 18 1 3 2 22 1 4 2 27 1 5 3 23 1 6 3 27 1 7 4 28 1 8 4 55 1 9 5 28 2 10 6 19 1 11 6 25 1 12 6 26 1 13 7 8 1 14 7 9 1 15 7 10 1 16 7 11 1 17 8 12 ar 18 8 13 ar 19 9 29 1 20 9 30 1 21 9 31 1 22 10 32 1 23 10 33 1 24 10 34 1 25 11 35 1 26 11 36 1 27 11 37 1 28 12 15 ar 29 13 14 ar 30 13 38 1 31 14 16 ar 32 14 17 1 33 15 16 ar 34 15 39 1 35 16 40 1 36 17 20 ar 37 17 21 ar 38 18 19 1 39 18 41 1 40 18 42 1 41 19 43 1 42 19 44 1 43 20 22 ar 44 20 45 1 45 21 24 ar 46 21 46 1 47 22 23 ar 48 23 24 ar 49 24 47 1 50 25 28 1 51 25 48 1 52 25 49 1 53 26 50 1 54 26 51 1 55 26 52 1 56 27 53 1 57 27 54 1