@MOLECULE n-methylcytosine 16 16 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O -1.9255 -1.7768 0.0000 O.2 1 UNL1 -0.4568 2 N 2.1912 0.3493 0.0288 N.pl3 1 UNL1 -0.5353 3 N 0.0768 -0.7426 0.0122 N.ar 1 UNL1 -0.6090 4 N -1.9845 0.5463 -0.0067 N.ar 1 UNL1 -0.5360 5 C 0.8204 0.4144 0.0072 C.ar 1 UNL1 0.5082 6 C 0.1578 1.6513 -0.0041 C.ar 1 UNL1 -0.5631 7 C 2.9288 -0.9101 -0.0258 C.3 1 UNL1 -0.2337 8 C -1.3914 -0.6977 0.0014 C.ar 1 UNL1 0.7000 9 C -1.2508 1.6473 -0.0082 C.ar 1 UNL1 0.2443 10 H 2.7244 1.2035 -0.0176 H 1 UNL1 0.3285 11 H 0.5117 -1.6586 0.0246 H 1 UNL1 0.3248 12 H 0.7018 2.5815 -0.0077 H 1 UNL1 0.1839 13 H 2.7110 -1.5417 0.8567 H 1 UNL1 0.1559 14 H 4.0156 -0.7082 -0.0230 H 1 UNL1 0.1608 15 H 2.7011 -1.4828 -0.9445 H 1 UNL1 0.1531 16 H -1.8124 2.5962 -0.0147 H 1 UNL1 0.1743 @BOND 1 15 7 1 2 7 14 1 3 7 2 1 4 7 13 1 5 10 2 1 6 16 9 1 7 9 4 ar 8 9 6 ar 9 12 6 1 10 4 8 ar 11 6 5 ar 12 1 8 2 13 8 3 ar 14 5 3 ar 15 5 2 1 16 3 11 1