@MOLECULE 3-methyl-3-hydroxy-1-(p-isopropylcarbamoylphenyl)triazene 17 19 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O -3.5769 1.6186 0.4050 O.2 1 UNL1 -0.3747 2 O 5.7230 -1.1216 0.6018 O.3 1 UNL1 -0.2144 3 N -3.6377 -0.6034 -0.0357 N.am 1 UNL1 -0.4396 4 N 2.9036 0.5105 -0.5573 N.pl3 1 UNL1 -0.1745 5 N 3.6535 -0.2930 0.0487 N.3 1 UNL1 0.0174 6 N 4.9373 -0.3243 -0.4004 N.4 1 UNL1 -0.2275 7 C -5.0354 -0.9100 0.0382 C.2 1 UNL1 -0.7665 8 C -3.8637 -1.8797 -0.2978 C.3 1 UNL1 0.5569 9 C -6.2882 -0.6844 0.2178 C.2 1 UNL1 0.4198 10 C -2.9658 0.6144 0.1531 C.2 1 UNL1 0.6120 11 C -1.5114 0.5213 0.0109 C.ar 1 UNL1 -0.0856 12 C -0.6534 -0.5749 -0.0827 C.ar 1 UNL1 0.0291 13 C -0.5924 1.5704 -0.0580 C.ar 1 UNL1 0.0785 14 C 0.6113 -0.6085 -0.1938 C.ar 1 UNL1 -0.0886 15 C 0.6716 1.5468 -0.1826 C.ar 1 UNL1 -0.0945 16 C 1.5294 0.4461 -0.2779 C.ar 1 UNL1 0.2513 17 C 6.0770 0.1246 0.4335 C.3 1 UNL1 0.5009 @BOND 1 4 16 1 2 4 5 1 3 6 5 1 4 6 17 1 5 6 2 1 6 8 3 1 7 8 7 1 8 16 14 ar 9 16 15 ar 10 14 12 ar 11 15 13 ar 12 12 11 ar 13 13 11 ar 14 3 7 1 15 3 10 am 16 11 10 1 17 7 9 2 18 10 1 2 19 17 2 1