@MOLECULE 2,6-dinitrobenzonitrile 17 17 0 0 0 SMALL GASTEIGER @ATOM 1 O -3.4969 0.5057 0.0001 O.2 1 UNL1111111111 -0.3798 2 O 3.4951 0.5081 -0.0002 O.2 1 UNL1111111111 -0.3804 3 O -2.5059 -1.4088 -0.0003 O.2 1 UNL1111111111 -0.3431 4 O 2.5097 -1.4085 0.0000 O.2 1 UNL1111111111 -0.3425 5 N -2.4984 -0.1939 -0.0000 N.pl3 1 UNL1111111111 0.6122 6 N 2.4980 -0.1938 -0.0001 N.pl3 1 UNL1111111111 0.6121 7 N 0.0001 -2.8225 0.0001 N.1 1 UNL1111111111 -0.1105 8 C -0.0006 -0.2402 0.0001 C.ar 1 UNL1111111111 0.0981 9 C -1.2014 0.4892 0.0000 C.ar 1 UNL1111111111 -0.0829 10 C 1.2006 0.4884 0.0001 C.ar 1 UNL1111111111 -0.0828 11 C -1.2052 1.8876 -0.0000 C.ar 1 UNL1111111111 -0.0475 12 C 1.2046 1.8870 0.0001 C.ar 1 UNL1111111111 -0.0475 13 C -0.0001 2.5830 0.0001 C.ar 1 UNL1111111111 -0.1580 14 C -0.0003 -1.6656 0.0003 C.1 1 UNL1111111111 0.0722 15 H -2.1607 2.4327 -0.0001 H 1 UNL1111111111 0.1999 16 H 2.1602 2.4319 0.0001 H 1 UNL1111111111 0.2000 17 H 0.0002 3.6760 0.0001 H 1 UNL1111111111 0.1807 @BOND 1 1 5 2 2 2 6 2 3 3 5 2 4 4 6 2 5 5 9 1 6 6 10 1 7 7 14 3 8 8 9 ar 9 8 10 ar 10 8 14 1 11 9 11 ar 12 10 12 ar 13 11 13 ar 14 11 15 1 15 12 13 ar 16 12 16 1 17 13 17 1