@MOLECULE 2-[(4-methylphenyl)sulfanyl]-1-(1-piperidinyl)ethanone 36 37 0 0 0 SMALL GASTEIGER @ATOM 1 C -4.9272 1.3431 0.7264 C.3 1 UNL1111111111 -0.2593 2 N -2.8780 -0.0262 -0.8499 N.am 1 UNL1111111111 -0.4884 3 O -2.0343 -1.9263 0.0355 O.2 1 UNL1111111111 -0.4984 4 S 0.7672 -1.3522 0.3132 S.3 1 UNL1111111111 0.1310 5 C -4.9082 -0.1841 0.5900 C.3 1 UNL1111111111 -0.3046 6 C -4.2325 -0.6027 -0.7295 C.3 1 UNL1111111111 -0.0741 7 C -2.8976 1.4415 -0.7614 C.3 1 UNL1111111111 -0.0765 8 C -3.5133 1.9184 0.5692 C.3 1 UNL1111111111 -0.3072 9 C -1.8378 -0.7719 -0.2765 C.2 1 UNL1111111111 0.5829 10 C -0.4842 -0.1080 -0.1972 C.3 1 UNL1111111111 -0.4506 11 C 2.3027 -0.4846 0.1517 C.ar 1 UNL1111111111 -0.0987 12 C 3.4500 -1.2831 0.1319 C.ar 1 UNL1111111111 -0.1376 13 C 4.7056 -0.6921 0.0424 C.ar 1 UNL1111111111 -0.1736 14 C 4.8287 0.6986 -0.0351 C.ar 1 UNL1111111111 0.0344 15 C 3.6793 1.4896 -0.0165 C.ar 1 UNL1111111111 -0.1752 16 C 2.4192 0.9010 0.0801 C.ar 1 UNL1111111111 -0.1616 17 C 6.1754 1.3255 -0.1555 C.3 1 UNL1111111111 -0.4539 18 H -5.6014 1.7828 -0.0323 H 1 UNL1111111111 0.1369 19 H -5.3462 1.6310 1.7084 H 1 UNL1111111111 0.1374 20 H -4.3664 -0.6386 1.4425 H 1 UNL1111111111 0.1553 21 H -5.9344 -0.5900 0.6322 H 1 UNL1111111111 0.1429 22 H -4.8276 -0.2596 -1.6035 H 1 UNL1111111111 0.1388 23 H -4.1683 -1.7143 -0.7979 H 1 UNL1111111111 0.1677 24 H -1.8799 1.8575 -0.9011 H 1 UNL1111111111 0.1352 25 H -3.5036 1.8223 -1.6175 H 1 UNL1111111111 0.1481 26 H -3.5405 3.0219 0.5994 H 1 UNL1111111111 0.1411 27 H -2.8804 1.6018 1.4186 H 1 UNL1111111111 0.1462 28 H -0.5089 0.7203 0.5368 H 1 UNL1111111111 0.1778 29 H -0.2069 0.3202 -1.1817 H 1 UNL1111111111 0.1878 30 H 3.3805 -2.3718 0.1834 H 1 UNL1111111111 0.1642 31 H 5.5971 -1.3163 0.0286 H 1 UNL1111111111 0.1547 32 H 3.7644 2.5725 -0.0757 H 1 UNL1111111111 0.1512 33 H 1.5457 1.5493 0.1037 H 1 UNL1111111111 0.1484 34 H 6.4948 1.3618 -1.2088 H 1 UNL1111111111 0.1629 35 H 6.1944 2.3565 0.2233 H 1 UNL1111111111 0.1562 36 H 6.9449 0.7680 0.3969 H 1 UNL1111111111 0.1585 @BOND 1 1 5 1 2 1 8 1 3 1 18 1 4 1 19 1 5 2 6 1 6 2 7 1 7 2 9 am 8 3 9 2 9 4 10 1 10 4 11 1 11 5 6 1 12 5 20 1 13 5 21 1 14 6 22 1 15 6 23 1 16 7 8 1 17 7 24 1 18 7 25 1 19 8 26 1 20 8 27 1 21 9 10 1 22 10 28 1 23 10 29 1 24 11 12 ar 25 11 16 ar 26 12 13 ar 27 12 30 1 28 13 14 ar 29 13 31 1 30 14 15 ar 31 14 17 1 32 15 16 ar 33 15 32 1 34 16 33 1 35 17 34 1 36 17 35 1 37 17 36 1