@MOLECULE 1-{4-[(2-hydroxyethyl)carbamoyl]benzyl}-1-methylpiperidinium 20 18 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O 3.5344 2.8346 -0.1504 O.2 1 UNL1 -0.3873 2 O 6.8149 -2.5758 0.8427 O.2 1 UNL1 -0.4309 3 N -2.6122 -1.6125 0.0634 N.1 1 UNL1 -0.6470 4 N 4.4365 0.7709 -0.3093 N.am 1 UNL1 -0.6408 5 C -6.9931 -1.2686 -1.2868 C.1 2 UNL2 0.5004 6 C -4.6786 1.9437 1.9819 C.3 2 UNL2 0.5118 7 C -6.4172 -0.4724 -0.4561 C.1 2 UNL2 -0.8358 8 C -5.2532 1.1247 1.1714 C.1 2 UNL2 -0.8437 9 C -2.0754 -0.7830 -0.8390 C.3 1 UNL1 0.4164 10 C -5.8414 0.3308 0.3577 C.1 2 UNL2 0.6673 11 C -3.1900 -2.3980 0.7760 C.1 1 UNL1 0.4576 12 C -0.7456 -0.2382 -0.5471 C.ar 1 UNL1 -0.0276 13 C 0.5098 -0.7999 -0.7855 C.ar 1 UNL1 -0.1083 14 C -0.3757 1.0597 -0.2006 C.ar 1 UNL1 -0.0948 15 C 1.6676 -0.2836 -0.7091 C.ar 1 UNL1 0.0227 16 C 0.7815 1.5808 -0.1206 C.ar 1 UNL1 0.0420 17 C 2.0360 1.0165 -0.3571 C.ar 1 UNL1 -0.0898 18 C 3.3549 1.6510 -0.2624 C.2 1 UNL1 0.6653 19 C 5.3841 0.0514 -0.3264 C.1 1 UNL1 0.3938 20 C 5.9228 -1.8783 0.9682 C.2 1 UNL1 0.4286 @BOND 1 5 7 3 2 9 12 1 3 9 3 1 4 13 15 ar 5 13 12 ar 6 15 17 ar 7 12 14 ar 8 7 10 1 9 17 18 1 10 17 16 ar 11 19 4 3 12 4 18 am 13 18 1 2 14 14 16 ar 15 3 11 3 16 10 8 3 17 2 20 2 18 8 6 1