@MOLECULE 1(5h)-phenazinone 23 25 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O -2.5252 2.2296 -0.0002 O.2 1 UNL1 -0.3873 2 N 0.3795 -1.5895 0.0001 N.ar 1 UNL1 -0.4237 3 N 0.0347 1.2039 0.0001 N.ar 1 UNL1 -0.2244 4 C -0.9067 -1.0535 0.0001 C.ar 1 UNL1 0.1963 5 C 1.4966 -0.7635 0.0000 C.ar 1 UNL1 0.1785 6 C -0.9985 0.4197 0.0001 C.ar 1 UNL1 0.0013 7 C 1.3065 0.6430 0.0001 C.ar 1 UNL1 -0.0157 8 C -2.0146 -1.8491 0.0001 C.ar 1 UNL1 -0.3705 9 C 2.7995 -1.3013 -0.0002 C.ar 1 UNL1 -0.2634 10 C -2.3806 1.0324 -0.0000 C.ar 1 UNL1 0.4675 11 C 2.4289 1.4954 0.0002 C.ar 1 UNL1 -0.0382 12 C -3.3179 -1.2482 -0.0001 C.ar 1 UNL1 0.0114 13 C -3.4972 0.0894 -0.0000 C.ar 1 UNL1 -0.3527 14 C 3.8810 -0.4398 -0.0003 C.ar 1 UNL1 -0.0503 15 C 3.7001 0.9541 -0.0000 C.ar 1 UNL1 -0.2187 16 H 0.4992 -2.5945 0.0004 H 1 UNL1 0.3228 17 H -1.9500 -2.9306 0.0000 H 1 UNL1 0.1676 18 H 2.9483 -2.3775 -0.0004 H 1 UNL1 0.1652 19 H 2.2639 2.5772 0.0006 H 1 UNL1 0.1816 20 H -4.1744 -1.9286 -0.0001 H 1 UNL1 0.1512 21 H -4.4855 0.5455 -0.0001 H 1 UNL1 0.1813 22 H 4.8954 -0.8438 -0.0005 H 1 UNL1 0.1558 23 H 4.5729 1.6052 0.0002 H 1 UNL1 0.1643 @BOND 1 22 14 1 2 18 9 1 3 14 9 ar 4 14 15 ar 5 1 10 2 6 9 5 ar 7 12 20 1 8 12 13 ar 9 12 8 ar 10 21 13 1 11 5 7 ar 12 5 2 ar 13 10 13 ar 14 10 6 ar 15 15 11 ar 16 15 23 1 17 17 8 1 18 4 2 ar 19 4 6 ar 20 4 8 ar 21 7 3 ar 22 7 11 ar 23 2 16 1 24 6 3 ar 25 11 19 1