@MOLECULE (6z)-3,9-dimethyl-6-(methylimino)-3,6,7,9-tetrahydro-8h-purin-8-one 14 13 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O 3.3014 -1.6326 0.0151 O.2 1 UNL1 -0.2576 2 N 1.7561 1.4446 0.0028 N.1 1 UNL1 -0.5809 3 N -0.4349 2.1813 -0.0313 N.1 1 UNL1 -0.5578 4 N 0.9389 -1.2738 -0.0015 N.2 1 UNL1 -0.4798 5 N -2.4156 0.1817 0.0290 N.1 1 UNL1 -0.5645 6 N -1.6733 -2.0058 -0.0177 N.1 1 UNL1 -0.5391 7 C 0.4213 1.1160 -0.0144 C.2 1 UNL1 0.3225 8 C 0.0065 -0.2420 -0.0054 C.2 1 UNL1 0.0963 9 C 2.1765 -1.3208 0.0106 C.1 1 UNL1 0.5794 10 C -1.3466 -0.6773 -0.0013 C.3 1 UNL1 0.3843 11 C 2.8880 1.8173 0.0214 C.1 1 UNL1 0.4084 12 C -3.3799 0.8791 0.0707 C.1 1 UNL1 0.3932 13 C -1.1177 3.1576 -0.0425 C.1 1 UNL1 0.3983 14 C -1.9131 -3.1710 -0.0375 C.1 1 UNL1 0.3973 @BOND 1 13 3 3 2 14 6 3 3 3 7 1 4 6 10 1 5 7 8 2 6 7 2 1 7 8 4 1 8 8 10 1 9 4 9 2 10 10 5 1 11 2 11 3 12 9 1 2 13 5 12 3