@MOLECULE n-(5-iodo-2-pyridinyl)acetamide 18 18 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 I -2.6106 0.1225 0.0000 I 1 UNL1 0.0148 2 O 4.2277 1.5068 -0.0008 O.2 1 UNL1 -0.3900 3 N 3.5731 -0.7012 -0.0001 N.am 1 UNL1 -0.5863 4 N 1.6794 0.7258 0.0003 N.ar 1 UNL1 -0.3947 5 C 2.1861 -0.5329 0.0000 C.ar 1 UNL1 0.3995 6 C 1.3557 -1.6821 -0.0003 C.ar 1 UNL1 -0.3411 7 C -0.0205 -1.5027 -0.0002 C.ar 1 UNL1 -0.0286 8 C 4.5289 0.3476 -0.0002 C.2 1 UNL1 0.5985 9 C -0.5337 -0.2073 0.0001 C.ar 1 UNL1 -0.2318 10 C 0.3481 0.8821 0.0004 C.ar 1 UNL1 0.1087 11 C 5.9457 -0.1630 0.0007 C.3 1 UNL1 -0.5367 12 H 3.9067 -1.6602 0.0001 H 1 UNL1 0.3148 13 H 1.7820 -2.6788 -0.0005 H 1 UNL1 0.1730 14 H -0.6739 -2.3788 -0.0004 H 1 UNL1 0.1679 15 H 0.0114 1.9308 0.0008 H 1 UNL1 0.1897 16 H 6.1714 -0.7624 0.8920 H 1 UNL1 0.1756 17 H 6.6477 0.6887 -0.0000 H 1 UNL1 0.1911 18 H 6.1710 -0.7642 -0.8896 H 1 UNL1 0.1756 @BOND 1 18 11 1 2 2 8 2 3 13 6 1 4 14 7 1 5 6 7 ar 6 6 5 ar 7 7 9 ar 8 8 3 am 9 8 11 1 10 3 5 1 11 3 12 1 12 1 9 1 13 17 11 1 14 5 4 ar 15 9 10 ar 16 4 10 ar 17 10 15 1 18 11 16 1