@MOLECULE beta-picolylamine 16 16 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 N -2.7654 0.0159 -0.6597 N.3 1 UNL1 -0.6166 2 N 1.5604 1.2013 -0.0921 N.ar 1 UNL1 -0.3623 3 C -0.4775 -0.0234 0.3089 C.ar 1 UNL1 -0.1506 4 C -1.9567 0.0026 0.5751 C.3 1 UNL1 -0.1094 5 C 0.2107 -1.2291 0.1696 C.ar 1 UNL1 -0.0966 6 C 0.2422 1.1736 0.1726 C.ar 1 UNL1 0.0370 7 C 1.5757 -1.2074 -0.1047 C.ar 1 UNL1 -0.2345 8 C 2.2149 0.0334 -0.2292 C.ar 1 UNL1 0.0498 9 H -2.2707 -0.8776 1.1842 H 1 UNL1 0.1560 10 H -2.2403 0.8960 1.1806 H 1 UNL1 0.1567 11 H -0.3138 -2.1783 0.2760 H 1 UNL1 0.1587 12 H -0.2415 2.1519 0.2787 H 1 UNL1 0.1730 13 H 2.1374 -2.1303 -0.2183 H 1 UNL1 0.1679 14 H 3.2870 0.1117 -0.4445 H 1 UNL1 0.1740 15 H -2.6138 -0.8122 -1.2134 H 1 UNL1 0.2479 16 H -2.5616 0.8226 -1.2283 H 1 UNL1 0.2490 @BOND 1 16 1 1 2 15 1 1 3 1 4 1 4 14 8 1 5 8 7 ar 6 8 2 ar 7 13 7 1 8 7 5 ar 9 2 6 ar 10 5 11 1 11 5 3 ar 12 6 12 1 13 6 3 ar 14 3 4 1 15 4 10 1 16 4 9 1