@MOLECULE 6-amino-3-methyl-5-nitroso-2,4(1h,3h)-pyrimidinedione 18 18 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O -0.4638 -2.2032 0.0531 O.2 1 UNL1 -0.4329 2 O 2.9419 0.8342 -0.0139 O.2 1 UNL1 -0.4879 3 O -2.9512 -1.0995 -0.0395 O.2 1 UNL1 -0.1314 4 N 1.2434 -0.7313 0.0032 N.ar 1 UNL1 -0.5287 5 N 0.8259 1.6254 0.0059 N.ar 1 UNL1 -0.5944 6 N -1.3448 2.5170 0.0145 N.pl3 1 UNL1 -0.5822 7 N -2.4519 -0.0204 -0.0173 N.2 1 UNL1 0.0451 8 C -0.5420 1.4148 0.0076 C.ar 1 UNL1 0.5500 9 C -0.1640 -1.0377 0.0214 C.ar 1 UNL1 0.6254 10 C -1.0484 0.1055 0.0041 C.ar 1 UNL1 -0.4574 11 C 1.7673 0.5418 -0.0053 C.ar 1 UNL1 0.7102 12 C 2.1956 -1.8533 -0.0281 C.3 1 UNL1 -0.2127 13 H 1.2270 2.5619 0.0097 H 1 UNL1 0.3397 14 H 2.3189 -2.2203 -1.0629 H 1 UNL1 0.1550 15 H 1.8130 -2.6883 0.5914 H 1 UNL1 0.1738 16 H 3.1841 -1.5503 0.3621 H 1 UNL1 0.1667 17 H -0.9953 3.4502 0.0059 H 1 UNL1 0.3128 18 H -2.3487 2.3884 0.0127 H 1 UNL1 0.3490 @BOND 1 14 12 1 2 3 7 2 3 12 4 1 4 12 16 1 5 12 15 1 6 7 10 1 7 2 11 2 8 11 4 ar 9 11 5 ar 10 4 9 ar 11 10 8 ar 12 10 9 ar 13 17 6 1 14 5 8 ar 15 5 13 1 16 8 6 1 17 18 6 1 18 9 1 2