@MOLECULE benzyltrimethylammonium 11 11 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 N -2.5868 0.0180 0.1051 N.3 1 UNL1 -0.5900 2 C -0.1878 -0.1261 -0.3717 C.3 1 UNL1 -0.0099 3 C -3.8915 -0.0983 -0.3495 C.3 1 UNL1 0.2732 4 C -2.4121 0.3906 1.4190 C.3 1 UNL1 0.2255 5 C -1.5714 -0.2367 -0.7964 C.3 1 UNL1 0.3178 6 C 0.6003 1.0102 -0.3770 C.2 1 UNL1 -0.1466 7 C 0.6867 -1.1536 -0.0832 C.2 1 UNL1 -0.1289 8 C 1.8248 1.3037 -0.1786 C.2 1 UNL1 0.0369 9 C 1.9261 -1.2889 0.1767 C.2 1 UNL1 0.0355 10 C 2.9985 0.7569 0.1294 C.2 1 UNL1 -0.0122 11 C 3.0431 -0.5789 0.3087 C.2 1 UNL1 -0.0015 @BOND 1 5 2 1 2 5 1 1 3 6 2 1 4 6 8 2 5 2 7 1 6 3 1 1 7 8 10 1 8 7 9 2 9 1 4 1 10 10 11 2 11 9 11 1