%chk=000131725.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000131725

0 1
 O  -0.2868000       2.074300      0.1716000    
 O   0.9785000      -2.069600      9.3699999E-02
 N   -4.981800     -0.8731000     -0.5398000    
 N   -1.027900     -0.1008000      0.2055000    
 N    1.277400      0.3217000      7.7799998E-02
 N    3.112500      -1.064200     -2.2800000E-02
 C   -4.576700      0.4298000      -1.098900    
 C   -4.734100     -0.6968000      0.9030000    
 C   -5.142900       1.462400     -0.1182000    
 C   -5.247400      0.7136000       1.212400    
 C   -3.034500      0.4368000      -1.113900    
 C   -3.208400     -0.8090000       1.100100    
 C   -2.427600      0.2389000      0.2867000    
 C   -6.371700      -1.209200     -0.8381000    
 C  -2.8000001E-02  0.8698000      0.1521000    
 C    2.462200       1.108900      1.3700000E-02
 C    1.696900      -1.078800      5.4600000E-02
 C    3.566900      0.2577000     -4.6799999E-02
 C    3.974800      -2.218900     -6.9899999E-02
 C    2.637300       2.482300      4.6000001E-03
 C    4.865300      0.7303000     -0.1170000    
 C    3.682000      -3.047900      -1.313700    
 C    3.822700      -3.051600       1.197000    
 C    3.943900       2.980300     -6.6799998E-02
 C    5.047400       2.113000     -0.1269000    
 H   -4.942900      0.5872000      -2.119700    
 H   -5.228600      -1.458700       1.516100    
 H   -6.141500       1.787800     -0.4331000    
 H   -4.516800       2.356800     -3.5500001E-02
 H   -4.677300       1.208300       2.005400    
 H   -6.295900      0.6820000       1.531700    
 H   -2.680700     -0.3575000      -1.786200    
 H   -2.670800       1.380100      -1.540700    
 H   -2.959000     -0.7030000       2.163500    
 H   -2.887500      -1.819700      0.8118000    
 H   -2.499400       1.194400      0.8218000    
 H   -6.627300      -2.176800     -0.3922000    
 H   -6.507300      -1.317100      -1.920000    
 H   -7.094800     -0.4699000     -0.4789000    
 H  -0.7766000      -1.077700      9.9100001E-02
 H    5.020600      -1.905000     -0.1280000    
 H    1.813000       3.182500      4.9400002E-02
 H    5.730300      8.0799997E-02 -0.1642000    
 H    4.388100      -3.881300      -1.395700    
 H    2.672700      -3.471700      -1.302500    
 H    3.776100      -2.438600      -2.219500    
 H    4.017700      -2.444400       2.087900    
 H    4.533200      -3.885300       1.197300    
 H    2.818000      -3.474700       1.297400    
 H    4.108400       4.054800     -7.5700000E-02
 H    6.051200       2.525600     -0.1815000    


%chk=000131725-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000131725

0 1
O -0.269279 2.081523 0.200685
O 0.961958 -2.039754 0.059703
N -5.056960 -0.930374 -0.501957
N -0.986958 -0.150142 0.205278
N 1.325083 0.350489 0.102062
N 3.125034 -1.020348 -0.022810
C -4.568051 0.333893 -1.147068
C -4.721992 -0.671965 0.937127
C -5.066718 1.493915 -0.207041
C -5.167725 0.814615 1.201757
C -3.022631 0.256417 -1.200089
C -3.192244 -0.857746 1.100946
C -2.425778 0.172213 0.233892
C -6.493088 -1.206378 -0.739726
C -0.040469 0.837067 0.170974
C 2.480539 1.180239 0.062814
C 1.728007 -1.023415 0.047306
C 3.607842 0.309923 -0.015080
C 3.948141 -2.259112 -0.098118
C 2.635977 2.577809 0.088183
C 4.918922 0.816365 -0.069163
C 3.639953 -3.043276 -1.393828
C 3.763248 -3.117375 1.173801
C 3.956758 3.085768 0.033075
C 5.078612 2.222863 -0.044015
H -4.973959 0.414612 -2.170829
H -5.253766 -1.393385 1.582162
H -6.051343 1.868832 -0.538730
H -4.370264 2.351137 -0.212864
H -4.523704 1.306383 1.952582
H -6.202652 0.847000 1.586130
H -2.739959 -0.647933 -1.770261
H -2.603346 1.139639 -1.717570
H -2.896795 -0.745727 2.161632
H -2.938786 -1.886686 0.780468
H -2.506648 1.171451 0.699540
H -6.772367 -2.140220 -0.219672
H -6.655724 -1.361685 -1.821291
H -7.189489 -0.402031 -0.399868
H -0.664713 -1.132382 0.151735
H 4.996311 -1.909685 -0.138058
H 1.761400 3.226636 0.147264
H 5.790474 0.157331 -0.128764
H 4.304575 -3.922911 -1.464127
H 2.594241 -3.392984 -1.392106
H 3.801855 -2.412729 -2.285945
H 4.015059 -2.539994 2.080942
H 4.426119 -3.999927 1.127828
H 2.720293 -3.466092 1.253714
H 4.110465 4.169798 0.050622
H 6.087444 2.647139 -0.085244


