%chk=000062733.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000062733

0 1
 O    4.786600      9.0800002E-02   1.656400    
 O  -0.7129000      0.3204000      -2.023500    
 O   -2.956300      -2.670600      0.9859000    
 O   -1.680600      -2.236400     -0.8445000    
 N   0.2468000      0.3899000      0.1165000    
 C   -2.141200      0.6140000     -0.2109000    
 C    1.629500      0.2425000     -0.1540000    
 C   -2.923900     -0.4706000      0.1851000    
 C  -0.8189000      0.4211000     -0.7918000    
 C    2.527700      0.2393000      0.8993000    
 C   -2.620500       1.914400     -5.3300001E-02
 C    2.051200      0.1068000      -1.465600    
 C    3.889500      9.5799997E-02  0.6329000    
 C   -4.185900     -0.2545000      0.7390000    
 C   -3.882500       2.130300      0.5004000    
 C    3.412700     -3.6499999E-02  -1.732000    
 C    4.331900     -4.2199999E-02 -0.6828000    
 C   -4.665100       1.045900      0.8965000    
 C   -2.451300      -1.840700      3.3900000E-02
 C    6.163200     -5.9700001E-02   1.312500    
 H   1.0600000E-02  0.4885000       1.102000    
 H    2.187300      0.3468000       1.925900    
 H   -2.020400       2.768100     -0.3581000    
 H    1.404600      0.1010000      -2.330000    
 H   -4.825900      -1.077800       1.045300    
 H   -4.256000       3.142700      0.6225000    
 H    3.757700     -0.1440000      -2.756600    
 H    5.373900     -0.1575000     -0.9608000    
 H   -5.649000       1.214400       1.324700    
 H    6.733500     -4.1800000E-02   2.247100    
 H    6.520000      0.7784000      0.7043000    
 H    6.356200      -1.028200      0.8389000    
 H   -2.633100      -3.590400      0.8773000    


%chk=000062733-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000062733

0 1
O 4.676872 -1.013477 1.314742
O -0.596779 1.553250 -1.802123
O -2.856567 -2.423583 1.796414
O -0.806682 -1.409868 1.681814
N 0.285821 0.314792 -0.026924
C -2.191093 0.697471 -0.197948
C 1.675274 0.377013 -0.326690
C -2.776742 -0.295468 0.672074
C -0.757563 0.867249 -0.738354
C 2.535206 -0.308407 0.568626
C -3.068717 1.672122 -0.749107
C 2.221067 1.075708 -1.441825
C 3.931089 -0.298951 0.360108
C -4.183101 -0.268737 0.918869
C -4.446893 1.704676 -0.468722
C 3.617265 1.068449 -1.626810
C 4.490525 0.392083 -0.744107
C -5.014648 0.720731 0.370135
C -2.036386 -1.371805 1.388262
C 6.130849 -1.040080 1.150688
H 0.031246 -0.265517 0.796708
H 2.137356 -0.855202 1.430183
H -2.620710 2.394786 -1.437143
H 1.554509 1.597060 -2.128582
H -4.607119 -1.043926 1.561203
H -5.072634 2.487037 -0.911214
H 4.039849 1.604622 -2.484161
H 5.569567 0.408985 -0.920987
H -6.086884 0.720263 0.590673
H 6.503784 -1.641877 1.992675
H 6.562561 -0.021271 1.201267
H 6.421519 -1.517489 0.194352
H -2.302440 -3.080439 2.298404


