@MOLECULE 2-iodoisonicotinohydrazide 17 17 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 I -2.3627 0.3545 0.0671 I 1 UNL1 0.0727 2 O 3.3645 1.3281 -1.0666 O.2 1 UNL1 -0.4981 3 N 4.1893 0.1136 0.6401 N.am 1 UNL1 -0.4685 4 N -0.4234 -1.8218 -0.0569 N.ar 1 UNL1 -0.3533 5 N 5.3870 0.8592 0.6921 N.3 1 UNL1 -0.3910 6 C 1.9436 -0.3686 -0.1686 C.ar 1 UNL1 -0.0498 7 C 0.7251 0.3060 -0.1005 C.ar 1 UNL1 -0.1907 8 C 1.9790 -1.7614 -0.1918 C.ar 1 UNL1 -0.2222 9 C 3.1910 0.4401 -0.2571 C.2 1 UNL1 0.5310 10 C -0.4286 -0.4834 -0.0435 C.ar 1 UNL1 0.0972 11 C 0.7620 -2.4553 -0.1353 C.ar 1 UNL1 0.0675 12 H 0.6906 1.3964 -0.1099 H 1 UNL1 0.1949 13 H 2.9201 -2.3027 -0.2679 H 1 UNL1 0.1804 14 H 0.7163 -3.5518 -0.1534 H 1 UNL1 0.1829 15 H 4.1013 -0.5163 1.4242 H 1 UNL1 0.3404 16 H 5.8985 0.7124 -0.1842 H 1 UNL1 0.2540 17 H 5.1668 1.8596 0.7388 H 1 UNL1 0.2526 @BOND 1 2 9 2 2 13 8 1 3 9 6 1 4 9 3 am 5 8 6 ar 6 8 11 ar 7 16 5 1 8 6 7 ar 9 14 11 1 10 11 4 ar 11 12 7 1 12 7 10 ar 13 4 10 ar 14 10 1 1 15 3 5 1 16 3 15 1 17 5 17 1