%chk=000129346.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000129346

0 1
 O  -0.7772000     -0.4361000     -0.7088000    
 O   0.6664000       1.254500      -1.416400    
 O   -3.612000       2.292400      0.4710000    
 O  -0.8121000       3.126200      9.8700002E-02
 O   -3.704200     -0.4302000       1.484600    
 O   -2.903300      -2.870900      0.6617000    
 O   -1.702600      -2.748300      -1.272000    
 N    1.684100      0.2981000      -1.460300    
 C   -2.466900       1.455700      0.6408000    
 C   -2.897000      9.3999999E-03  0.3936000    
 C   -1.370900       1.886200     -0.3346000    
 C   -1.682500     -0.9041000      0.2845000    
 C  -0.2481000      0.8505000     -0.3980000    
 C   -2.073400      -2.256700     -0.2165000    
 C    2.494500      2.9100001E-02 -0.3479000    
 C    2.068700     -8.6300001E-02  -2.808500    
 C    2.831000      -1.289200     -2.2800000E-02
 C    2.974100       1.076400      0.4457000    
 C    3.637800      -1.557100       1.083200    
 C    3.780800      0.8086000       1.551600    
 C    4.112600     -0.5081000       1.870300    
 H   -2.130900       1.597300       1.675600    
 H   -3.515600     -4.5899998E-02 -0.5106000    
 H   -1.792200       2.054500      -1.333500    
 H   -1.152100      -1.033000       1.236200    
 H   0.2523000      0.8271000      0.5787000    
 H   -4.290700       1.987400       1.097400    
 H   -1.540600       3.767600      0.1586000    
 H   -3.167000     -0.3863000       2.294000    
 H    2.346200      -1.143800      -2.859600    
 H    2.917600      0.5163000      -3.147000    
 H    1.239300      6.8800002E-02  -3.506800    
 H   -3.173200      -3.761000      0.3499000    
 H    2.462500      -2.119900     -0.6195000    
 H    2.729300       2.109100      0.2092000    
 H    3.894400      -2.582600       1.332800    
 H    4.151400       1.625300       2.164100    
 H    4.740400     -0.7167000       2.731600    


%chk=000129346-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000129346

0 1
O -1.254097 -0.664964 -0.788984
O 0.788234 0.476037 -0.697385
O -3.144391 2.601287 1.019236
O -0.306454 2.333200 1.229115
O -4.571836 0.131851 0.835100
O -4.598670 -2.067913 -0.774271
O -2.685388 -2.738328 -1.912303
N 1.778802 -0.635100 -0.475688
C -2.502447 1.291448 0.892775
C -3.352170 0.327002 0.052662
C -1.114004 1.556809 0.289852
C -2.530484 -0.982690 -0.152607
C -0.393863 0.219679 0.056300
C -3.208103 -2.013330 -1.055233
C 3.014603 -0.077419 -0.007764
C 1.781382 -1.504038 -1.674580
C 4.242714 -0.749361 -0.264966
C 3.016152 1.098851 0.794489
C 5.445151 -0.260183 0.290673
C 4.228876 1.577919 1.328905
C 5.450921 0.904297 1.090113
H -2.375802 0.834442 1.900105
H -3.572298 0.774035 -0.939452
H -1.225997 2.085656 -0.678865
H -2.385615 -1.454884 0.848419
H -0.155406 -0.300534 1.006772
H -4.057077 2.454427 1.378432
H -0.843269 3.127806 1.486009
H -5.116792 -0.566463 0.381499
H 2.277083 -2.454834 -1.412775
H 2.299479 -1.044747 -2.541230
H 0.735078 -1.720139 -1.934657
H -5.027345 -2.761645 -1.344635
H 4.268037 -1.648933 -0.886819
H 2.079990 1.634903 0.973859
H 6.381803 -0.792081 0.087119
H 4.216767 2.488616 1.938923
H 6.387334 1.283623 1.512859


