%chk=000055654.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000055654

0 1
 O  -0.3616000       2.015800      9.9999997E-05
 O    1.790200       2.861100      6.9999998E-04
 N    1.468300      -1.649600      1.9999999E-04
 N    2.836000      0.1160000     -1.3000000E-03
 C   0.6682000     -0.5450000      5.0000002E-04
 C  -0.7651000     -0.4177000      6.9999998E-04
 C    1.530800      0.5243000       0.000000    
 C   -1.256100      0.8984000      3.9999999E-04
 C    2.764800      -1.199900     -6.9999998E-04
 C   -1.662700      -1.482200      1.9999999E-04
 C    1.051200       1.884200     -9.9999997E-05
 C    1.106300      -3.046800      6.9999998E-04
 C   -2.621100       1.167100     -3.0000001E-04
 C   -3.036600      -1.221200     -3.9999999E-04
 C   -3.512600      9.5500000E-02 -6.9999998E-04
 H    3.613400      -1.870900     -1.3000000E-03
 H   -1.358900      -2.519500      9.9999997E-05
 H    2.014600      -3.656500      1.0000000E-03
 H   0.5376000      -3.263000      0.9078000    
 H   0.5378000      -3.263600     -0.9064000    
 H   -2.991100       2.187200     -6.9999998E-04
 H   -3.742400      -2.047500     -7.9999998E-04
 H   -4.583000      0.2817000     -1.3000000E-03


%chk=000055654-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000055654

0 1
O -0.395680 2.012559 -0.000438
O 1.701326 2.987930 0.000023
N 1.517498 -1.686493 0.000035
N 2.887490 0.146875 0.000293
C 0.671479 -0.572566 -0.000164
C -0.770067 -0.449150 -0.000295
C 1.542609 0.547012 -0.000512
C -1.249303 0.902022 -0.000248
C 2.834083 -1.191254 0.000463
C -1.736116 -1.497377 -0.000229
C 1.070662 1.922211 -0.001267
C 1.156568 -3.110265 0.000149
C -2.631209 1.191078 -0.000139
C -3.111891 -1.210886 -0.000154
C -3.561144 0.135306 -0.000098
H 3.695624 -1.856047 0.000858
H -1.411098 -2.541192 -0.000235
H 2.082502 -3.706907 0.000811
H 0.573605 -3.370241 0.900415
H 0.574583 -3.370693 -0.900622
H -2.942737 2.239437 -0.000121
H -3.837504 -2.030471 -0.000104
H -4.633280 0.357013 -0.000022


