@MOLECULE 8-[2-(dimethylamino)ethyl]-4-phenyl-1-thia-4,8-diazaspiro[4.5]decan-3-one 47 49 0 0 0 SMALL GASTEIGER @ATOM 1 S 1.0950 -2.7032 0.5007 S.3 1 UNL1111111111 -0.0554 2 O 4.2521 -1.0349 -0.9188 O.2 1 UNL1111111111 -0.4787 3 N -2.0208 -0.2850 0.3414 N.3 1 UNL1111111111 -0.4390 4 N 2.1680 -0.4038 -0.2361 N.am 1 UNL1111111111 -0.5567 5 N -5.6500 0.3706 -0.1979 N.3 1 UNL1111111111 -0.3993 6 C 0.8140 -0.8804 0.0921 C.3 1 UNL1111111111 0.2473 7 C -0.1124 -0.7673 -1.1267 C.3 1 UNL1111111111 -0.3171 8 C 0.2304 -0.1653 1.3116 C.3 1 UNL1111111111 -0.3258 9 C -1.5610 -1.1447 -0.7753 C.3 1 UNL1111111111 -0.1027 10 C -1.2340 -0.5675 1.5649 C.3 1 UNL1111111111 -0.0968 11 C -3.4751 -0.4365 0.5745 C.3 1 UNL1111111111 -0.1194 12 C 2.6799 -2.7756 -0.3975 C.3 1 UNL1111111111 -0.4145 13 C 3.1466 -1.3532 -0.5548 C.2 1 UNL1111111111 0.5934 14 C 2.5227 0.9716 -0.1131 C.ar 1 UNL1111111111 0.2149 15 C -4.1917 0.5907 -0.3426 C.3 1 UNL1111111111 -0.1260 16 C 3.7099 1.3113 0.5542 C.ar 1 UNL1111111111 -0.1884 17 C 1.7059 1.9753 -0.6483 C.ar 1 UNL1111111111 -0.2220 18 C 4.0665 2.6492 0.6821 C.ar 1 UNL1111111111 -0.1120 19 C 2.0731 3.3101 -0.5033 C.ar 1 UNL1111111111 -0.1106 20 C -6.3674 0.7336 -1.4388 C.3 1 UNL1111111111 -0.2780 21 C -6.1934 1.1293 0.9493 C.3 1 UNL1111111111 -0.2790 22 C 3.2494 3.6511 0.1601 C.ar 1 UNL1111111111 -0.1770 23 H 0.2471 -1.3783 -1.9752 H 1 UNL1111111111 0.1561 24 H -0.1014 0.2823 -1.4983 H 1 UNL1111111111 0.1688 25 H 0.2614 0.9361 1.1421 H 1 UNL1111111111 0.1793 26 H 0.8393 -0.3372 2.2195 H 1 UNL1111111111 0.1620 27 H -2.2114 -0.9527 -1.6577 H 1 UNL1111111111 0.1401 28 H -1.6490 -2.2297 -0.5528 H 1 UNL1111111111 0.1275 29 H -1.3089 -1.6238 1.8976 H 1 UNL1111111111 0.1232 30 H -1.6378 0.0575 2.3935 H 1 UNL1111111111 0.1416 31 H -3.8567 -1.4581 0.3664 H 1 UNL1111111111 0.1357 32 H -3.7242 -0.2228 1.6337 H 1 UNL1111111111 0.1357 33 H 2.5714 -3.2694 -1.3821 H 1 UNL1111111111 0.1941 34 H 3.4261 -3.3681 0.1695 H 1 UNL1111111111 0.2001 35 H -3.8654 1.6187 -0.0837 H 1 UNL1111111111 0.1319 36 H -3.8821 0.4248 -1.3953 H 1 UNL1111111111 0.1387 37 H 4.3577 0.5319 0.9548 H 1 UNL1111111111 0.1742 38 H 0.7897 1.7236 -1.1809 H 1 UNL1111111111 0.1662 39 H 4.9918 2.9125 1.1932 H 1 UNL1111111111 0.1522 40 H 1.4354 4.0898 -0.9175 H 1 UNL1111111111 0.1505 41 H -7.4429 0.5305 -1.3047 H 1 UNL1111111111 0.1451 42 H -6.0170 0.0835 -2.2577 H 1 UNL1111111111 0.1444 43 H -6.2474 1.7827 -1.7457 H 1 UNL1111111111 0.1183 44 H -7.2535 0.8580 1.0854 H 1 UNL1111111111 0.1450 45 H -6.1227 2.2223 0.8476 H 1 UNL1111111111 0.1191 46 H -5.6615 0.8312 1.8672 H 1 UNL1111111111 0.1426 47 H 3.5329 4.6951 0.2666 H 1 UNL1111111111 0.1504 @BOND 1 1 6 1 2 1 12 1 3 2 13 2 4 3 9 1 5 3 10 1 6 3 11 1 7 4 6 1 8 4 13 am 9 4 14 1 10 5 15 1 11 5 20 1 12 5 21 1 13 6 7 1 14 6 8 1 15 7 9 1 16 7 23 1 17 7 24 1 18 8 10 1 19 8 25 1 20 8 26 1 21 9 27 1 22 9 28 1 23 10 29 1 24 10 30 1 25 11 15 1 26 11 31 1 27 11 32 1 28 12 13 1 29 12 33 1 30 12 34 1 31 14 16 ar 32 14 17 ar 33 15 35 1 34 15 36 1 35 16 18 ar 36 16 37 1 37 17 19 ar 38 17 38 1 39 18 22 ar 40 18 39 1 41 19 22 ar 42 19 40 1 43 20 41 1 44 20 42 1 45 20 43 1 46 21 44 1 47 21 45 1 48 21 46 1 49 22 47 1