%chk=000071909.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000071909

0 1
 O    1.135800      0.3770000      0.6914000    
 O  -3.8600001E-02  -2.356800     -0.9426000    
 O   -3.988700      -1.631900      0.7260000    
 O    2.753700       1.455900     -0.6649000    
 O    4.144200     -0.9106000     -0.7687000    
 O    3.156600      -1.305300       1.242600    
 N   -1.917500       2.157700     -0.2095000    
 C   -1.027000     -0.4716000      0.1185000    
 C  -0.1556000      0.5917000      0.3270000    
 C   -2.343200     -0.2217000     -0.2540000    
 C  -0.6456000       1.875800      0.1515000    
 C  -0.5472000      -1.876300      0.2945000    
 C   -2.735400       1.098900     -0.4034000    
 C   -3.319500      -1.321400     -0.4908000    
 C   0.2481000       3.053800      0.3626000    
 C    2.117100      0.2322000     -0.3349000    
 C    3.162700     -0.7472000      0.1547000    
 H   0.2512000      -1.931200       1.042800    
 H   -1.330800      -2.550700      0.6535000    
 H   -3.749500       1.359600     -0.6903000    
 H   -4.077000      -1.011700      -1.220200    
 H   -2.865900      -2.228700     -0.8996000    
 H   0.8906000       2.921600       1.238800    
 H   0.8650000       3.225600     -0.5235000    
 H  -0.3463000       3.958100      0.5338000    
 H    1.665300     -0.1846000      -1.242700    
 H   0.2800000      -3.262400     -0.7879000    
 H   -4.232200     -0.7999000       1.166400    
 H    3.350800       1.686800      6.6799998E-02
 H    4.836900      -1.533000     -0.4600000    


%chk=000071909-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000071909

0 1
O 1.197753 0.342959 0.519701
O 0.175459 -2.279613 -1.009943
O -3.757175 -2.003559 0.856272
O 2.777849 1.229303 -1.096927
O 4.177937 -0.408942 0.503924
O 2.859379 -2.234889 -0.059380
N -1.921044 2.251040 -0.132646
C -1.075799 -0.472481 0.069625
C -0.171496 0.610512 0.200548
C -2.439960 -0.152608 -0.193489
C -0.605708 1.963293 0.113897
C -0.589675 -1.905733 0.201856
C -2.792196 1.214386 -0.290714
C -3.502226 -1.219836 -0.375416
C 0.341994 3.125059 0.296795
C 2.101984 0.065187 -0.627118
C 3.053655 -0.998644 -0.054425
H 0.048966 -1.991172 1.103185
H -1.442118 -2.594705 0.310318
H -3.830438 1.499349 -0.504943
H -4.440563 -0.754137 -0.739513
H -3.187958 -1.981852 -1.107035
H 0.923119 3.022629 1.231033
H 1.070470 3.170840 -0.532694
H -0.239068 4.059358 0.320872
H 1.524964 -0.345739 -1.469424
H 1.074297 -2.611615 -0.734818
H -4.013755 -1.378574 1.581380
H 3.445268 1.519031 -0.419971
H 4.774085 -1.089147 0.916949


