@MOLECULE 2-pyrimidinamine 12 12 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 N -0.2441 1.2192 -0.0001 N.ar 1 UNL1 -0.5199 2 N -0.2438 -1.2198 -0.0001 N.ar 1 UNL1 -0.5197 3 N -2.2466 0.0002 0.0002 N.pl3 1 UNL1 -0.5769 4 C -0.8816 -0.0004 -0.0001 C.ar 1 UNL1 0.5203 5 C 1.8268 0.0003 0.0001 C.ar 1 UNL1 -0.4251 6 C 1.0970 1.1968 0.0000 C.ar 1 UNL1 0.1702 7 C 1.0974 -1.1964 0.0000 C.ar 1 UNL1 0.1701 8 H 2.9077 0.0005 0.0003 H 1 UNL1 0.1817 9 H 1.5879 2.1796 -0.0000 H 1 UNL1 0.1743 10 H 1.5889 -2.1790 0.0000 H 1 UNL1 0.1743 11 H -2.7502 -0.8637 -0.0001 H 1 UNL1 0.3254 12 H -2.7492 0.8647 -0.0001 H 1 UNL1 0.3254 @BOND 1 1 4 ar 2 1 6 ar 3 2 4 ar 4 2 7 ar 5 11 3 1 6 4 3 1 7 12 3 1 8 6 9 1 9 6 5 ar 10 7 10 1 11 7 5 ar 12 5 8 1