@MOLECULE 3-{2-[(cyclobutylmethyl)(2-phenylethyl)amino]ethyl}phenol 50 52 0 0 0 SMALL GASTEIGER @ATOM 1 O -6.1419 0.6824 1.2592 O.3 1 UNL1111111111 -0.4771 2 N 0.3713 -0.8616 0.2496 N.3 1 UNL1111111111 -0.4427 3 C 1.0044 -3.2298 0.2079 C.3 1 UNL1111111111 -0.1067 4 C 0.7426 -4.6745 0.7262 C.3 1 UNL1111111111 -0.3000 5 C 0.4345 -3.6333 -1.1832 C.3 1 UNL1111111111 -0.2718 6 C 0.1768 -5.0707 -0.6636 C.3 1 UNL1111111111 -0.2780 7 C 0.1966 -2.1590 0.9446 C.3 1 UNL1111111111 -0.1219 8 C -0.7990 0.0246 0.4403 C.3 1 UNL1111111111 -0.0937 9 C 1.6355 -0.1920 0.6299 C.3 1 UNL1111111111 -0.0976 10 C -1.8341 -0.3123 -0.6583 C.3 1 UNL1111111111 -0.3060 11 C 2.1299 0.6141 -0.5934 C.3 1 UNL1111111111 -0.2984 12 C -3.0082 0.6010 -0.5147 C.ar 1 UNL1111111111 0.0873 13 C 3.4338 1.2653 -0.2625 C.ar 1 UNL1111111111 0.0140 14 C -4.0722 0.2267 0.3021 C.ar 1 UNL1111111111 -0.2838 15 C -3.0294 1.8366 -1.1737 C.ar 1 UNL1111111111 -0.2557 16 C 3.4592 2.5511 0.2820 C.ar 1 UNL1111111111 -0.1811 17 C 4.6322 0.5816 -0.4800 C.ar 1 UNL1111111111 -0.1775 18 C -5.1442 1.1121 0.4425 C.ar 1 UNL1111111111 0.3077 19 C -4.1114 2.6974 -1.0181 C.ar 1 UNL1111111111 -0.0554 20 C 4.6749 3.1480 0.6071 C.ar 1 UNL1111111111 -0.1342 21 C 5.8463 1.1811 -0.1537 C.ar 1 UNL1111111111 -0.1350 22 C -5.1885 2.3479 -0.2045 C.ar 1 UNL1111111111 -0.3322 23 C 5.8699 2.4643 0.3902 C.ar 1 UNL1111111111 -0.1678 24 H 2.0726 -2.9659 0.1693 H 1 UNL1111111111 0.1375 25 H -0.4601 -3.0793 -1.4779 H 1 UNL1111111111 0.1471 26 H 1.1546 -3.5608 -1.9997 H 1 UNL1111111111 0.1366 27 H 1.6445 -5.2157 1.0186 H 1 UNL1111111111 0.1382 28 H 0.0243 -4.7478 1.5442 H 1 UNL1111111111 0.1376 29 H 0.7450 -5.8478 -1.1779 H 1 UNL1111111111 0.1351 30 H -0.8742 -5.3667 -0.6552 H 1 UNL1111111111 0.1364 31 H 0.5003 -2.1207 2.0126 H 1 UNL1111111111 0.1163 32 H -0.8806 -2.4388 0.9354 H 1 UNL1111111111 0.1427 33 H -0.4941 1.0888 0.3341 H 1 UNL1111111111 0.1415 34 H -1.2610 -0.0708 1.4450 H 1 UNL1111111111 0.1213 35 H 1.5308 0.4723 1.5128 H 1 UNL1111111111 0.1206 36 H 2.4030 -0.9499 0.8980 H 1 UNL1111111111 0.1391 37 H -2.1339 -1.3769 -0.5902 H 1 UNL1111111111 0.1565 38 H -1.3552 -0.2186 -1.6547 H 1 UNL1111111111 0.1679 39 H 1.3671 1.3572 -0.8969 H 1 UNL1111111111 0.1548 40 H 2.2198 -0.0665 -1.4657 H 1 UNL1111111111 0.1659 41 H -4.0846 -0.7249 0.8256 H 1 UNL1111111111 0.1776 42 H -2.1958 2.1224 -1.8097 H 1 UNL1111111111 0.1594 43 H 2.5285 3.0873 0.4530 H 1 UNL1111111111 0.1515 44 H 4.6165 -0.4200 -0.9045 H 1 UNL1111111111 0.1537 45 H -4.1199 3.6563 -1.5362 H 1 UNL1111111111 0.1458 46 H 4.6914 4.1499 1.0312 H 1 UNL1111111111 0.1461 47 H 6.7785 0.6465 -0.3241 H 1 UNL1111111111 0.1460 48 H -6.0309 3.0164 -0.0810 H 1 UNL1111111111 0.1586 49 H 6.8184 2.9307 0.6440 H 1 UNL1111111111 0.1472 50 H -6.8776 1.3361 1.3265 H 1 UNL1111111111 0.3265 @BOND 1 1 18 1 2 1 50 1 3 2 7 1 4 2 8 1 5 2 9 1 6 3 4 1 7 3 5 1 8 3 7 1 9 3 24 1 10 4 6 1 11 4 27 1 12 4 28 1 13 5 6 1 14 5 25 1 15 5 26 1 16 6 29 1 17 6 30 1 18 7 31 1 19 7 32 1 20 8 10 1 21 8 33 1 22 8 34 1 23 9 11 1 24 9 35 1 25 9 36 1 26 10 12 1 27 10 37 1 28 10 38 1 29 11 13 1 30 11 39 1 31 11 40 1 32 12 14 ar 33 12 15 ar 34 13 16 ar 35 13 17 ar 36 14 18 ar 37 14 41 1 38 15 19 ar 39 15 42 1 40 16 20 ar 41 16 43 1 42 17 21 ar 43 17 44 1 44 18 22 ar 45 19 22 ar 46 19 45 1 47 20 23 ar 48 20 46 1 49 21 23 ar 50 21 47 1 51 22 48 1 52 23 49 1