@MOLECULE n-benzyl-n,n-dimethyl-1-tridecanaminium 23 23 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 N -3.7984 0.8807 -0.0005 N.pl3 1 UNL1 -0.4164 2 C -2.4443 0.6505 0.0320 C.1 1 UNL1 0.0322 3 C -1.2407 0.4646 0.0635 C.1 1 UNL1 -0.0516 4 C -6.8426 -2.2020 -0.8179 C.3 2 UNL2 0.3947 5 C 0.0983 0.2863 0.0917 C.1 1 UNL1 0.0150 6 C -4.6624 0.0028 0.5632 C.3 1 UNL1 0.1916 7 C -4.2992 1.9967 -0.6061 C.3 1 UNL1 0.2371 8 C 1.3136 0.1499 0.1110 C.1 1 UNL1 -0.0052 9 C 2.6556 0.0283 0.1215 C.1 1 UNL1 0.0237 10 C 3.8805 -0.0553 0.1210 C.1 1 UNL1 -0.0219 11 C -7.7045 -1.5828 0.1641 C.ar 2 UNL2 -0.2434 12 C 5.2195 -0.1214 0.1087 C.1 1 UNL1 0.0344 13 C 6.4551 -0.1583 0.0862 C.1 1 UNL1 -0.0419 14 C 7.7825 -0.1778 0.0525 C.1 1 UNL1 0.1000 15 C 9.0335 -0.1782 0.0131 C.1 1 UNL1 -0.1953 16 C -7.0721 -0.7739 -0.9156 C.ar 2 UNL2 -0.2654 17 C -8.4793 -0.9299 1.0455 C.ar 2 UNL2 0.0515 18 C 10.3380 -0.1677 -0.0335 C.1 1 UNL1 0.3087 19 C 11.6097 -0.1509 -0.0817 C.1 1 UNL1 -0.6312 20 C -7.3296 0.5430 -0.9287 C.ar 2 UNL2 0.0434 21 C -8.6733 0.3800 0.9545 C.ar 2 UNL2 0.0059 22 C -8.1118 1.1010 -0.0127 C.ar 2 UNL2 0.0145 23 C 12.9031 -0.1319 -0.1319 C.3 1 UNL1 0.4195 @BOND 1 20 16 ar 2 20 22 ar 3 16 4 1 4 16 11 ar 5 4 11 1 6 7 1 1 7 23 19 1 8 19 18 3 9 18 15 1 10 22 21 ar 11 1 2 1 12 1 6 1 13 15 14 3 14 2 3 3 15 14 13 1 16 3 5 1 17 13 12 3 18 5 8 3 19 12 10 1 20 8 9 1 21 10 9 3 22 11 17 ar 23 21 17 ar