%chk=000085212.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085212

0 1
 O   0.4866000       1.469400      0.3638000    
 O   -2.295600       1.070700      0.3272000    
 N  -0.6390000     -0.4897000     -0.2057000    
 N    2.770500      0.4668000     -0.8127000    
 C    1.780100     -0.4746000     -0.2965000    
 C   0.4988000      0.2950000      1.1000000E-03
 C    2.299100      -1.144900      0.9694000    
 C   -1.950300     -5.2299999E-02 -2.9999999E-02
 C   -2.950100      -1.140500     -0.3166000    
 H    1.593800      -1.233600      -1.064200    
 H    3.232500      -1.684300      0.7759000    
 H    1.567600      -1.864700       1.353000    
 H    2.484200     -0.4147000       1.765800    
 H  -0.5029000      -1.454200     -0.4989000    
 H    2.962400       1.189600     -0.1201000    
 H    2.402000      0.9416000      -1.635800    
 H   -3.963800     -0.7335000     -0.2639000    
 H   -2.785400      -1.546700      -1.318600    
 H   -2.846500      -1.939100      0.4231000    


%chk=000085212-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000085212

0 1
O 0.490896 1.576274 0.285409
O -2.393604 1.064518 0.412296
N -0.671125 -0.418766 -0.229192
N 2.919249 0.460924 -0.769819
C 1.822119 -0.409508 -0.334910
C 0.495438 0.373689 -0.065167
C 2.226981 -1.153242 0.963707
C -2.031488 -0.062658 0.009361
C -3.000044 -1.213764 -0.269991
H 1.643896 -1.160769 -1.131777
H 3.158008 -1.714735 0.781755
H 1.442697 -1.853493 1.303746
H 2.409701 -0.426203 1.776011
H -0.512784 -1.378120 -0.552085
H 3.130869 1.184209 -0.070789
H 2.757364 0.894021 -1.686737
H -4.029253 -0.847186 -0.148817
H -2.878708 -1.608157 -1.295926
H -2.836213 -2.046734 0.439224


