%chk=000072647.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072647

0 1
 O    1.643100       1.688900      0.2037000    
 O    4.465400      8.5600004E-02 -0.3109000    
 O   -3.597200     -0.4769000      -1.580300    
 O   -4.432900      1.3800000E-02  0.4708000    
 N   -2.118900      0.9066000       1.442200    
 C   0.8199000      0.7273000     -0.4733000    
 C   0.3282000     -0.3952000      0.3994000    
 C    2.293500      0.8516000     -0.7604000    
 C    1.279700      -1.595500      0.2860000    
 C   -1.092700     -0.8067000      1.5799999E-02
 C    2.703500      -1.215100      0.6821000    
 C    3.261300     -9.3000002E-02 -0.1637000    
 C   -2.073700      0.3639000      8.4600002E-02
 C   -3.479300     -5.5500001E-02 -0.2959000    
 H   0.1634000       1.056200      -1.264800    
 H   0.3344000     -6.2500000E-02   1.445700    
 H    2.580000       1.304100      -1.702500    
 H    1.281100      -1.975300     -0.7443000    
 H   0.9327000      -2.411000      0.9315000    
 H   -1.433300      -1.622900      0.6673000    
 H   -1.094900      -1.214900      -1.003900    
 H    3.355700      -2.087400      0.5650000    
 H    2.738800     -0.8980000       1.730100    
 H   -1.807900       1.178500     -0.5948000    
 H   -2.427000      0.1884000       2.096400    
 H   -2.802500       1.660700       1.493200    
 H   -4.520600     -0.7233000      -1.801300    


%chk=000072647-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000072647

0 1
O 1.907355 1.728054 0.045640
O 4.210295 -0.762456 -1.207397
O -3.420288 0.167247 -1.810839
O -4.449481 -0.714276 0.080085
N -2.361638 0.462481 1.722980
C 0.894067 0.774243 -0.527036
C 0.327515 -0.263248 0.447588
C 2.326064 0.724290 -1.018612
C 1.287861 -1.465053 0.656096
C -1.067262 -0.752281 -0.017673
C 2.778145 -1.035250 0.776649
C 3.217683 -0.385618 -0.527363
C -2.183570 0.297491 0.277615
C -3.472095 -0.137401 -0.443456
H 0.173891 1.273883 -1.191880
H 0.181714 0.251239 1.418642
H 2.597622 1.166664 -1.984589
H 1.187593 -2.174300 -0.190800
H 0.990225 -2.013778 1.569096
H -1.323946 -1.685249 0.521601
H -1.054769 -0.991663 -1.098532
H 3.433659 -1.897304 0.984533
H 2.880767 -0.300496 1.598869
H -1.877733 1.267251 -0.156265
H -2.835772 -0.337035 2.159174
H -2.799315 1.348062 1.995186
H -4.248786 -0.153098 -2.261612


%chk=000072647-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000072647

0 1
O 1.907355 1.728054 0.045640
O 4.210295 -0.762456 -1.207397
O -3.420288 0.167247 -1.810839
O -4.449481 -0.714276 0.080085
N -2.361638 0.462481 1.722980
C 0.894067 0.774243 -0.527036
C 0.327515 -0.263248 0.447588
C 2.326064 0.724290 -1.018612
C 1.287861 -1.465053 0.656096
C -1.067262 -0.752281 -0.017673
C 2.778145 -1.035250 0.776649
C 3.217683 -0.385618 -0.527363
C -2.183570 0.297491 0.277615
C -3.472095 -0.137401 -0.443456
H 0.173891 1.273883 -1.191880
H 0.181714 0.251239 1.418642
H 2.597622 1.166664 -1.984589
H 1.187593 -2.174300 -0.190800
H 0.990225 -2.013778 1.569096
H -1.323946 -1.685249 0.521601
H -1.054769 -0.991663 -1.098532
H 3.433659 -1.897304 0.984533
H 2.880767 -0.300496 1.598869
H -1.877733 1.267251 -0.156265
H -2.835772 -0.337035 2.159174
H -2.799315 1.348062 1.995186
H -4.248786 -0.153098 -2.261612


