%chk=000082565.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000082565

0 1
 O    1.132200     -0.3618000      0.2830000    
 O  -3.0400001E-02   1.642500      0.5554000    
 O    4.751200       1.581200      0.2782000    
 O    4.546200      -1.112800     -0.7935000    
 O    2.267300       3.066100     -0.2682000    
 O    2.968800      -3.269400     -0.4238000    
 O    1.246000      -2.810800      0.9967000    
 O   -5.557100     -0.5480000      -1.456200    
 O   -5.746200     -0.9434000      0.6949000    
 N   -5.098400     -0.5106000     -0.2888000    
 C    3.570800       1.035900     -0.3129000    
 C    3.542100     -0.4635000     -1.5300000E-02
 C    2.340800       1.741600      0.2589000    
 C    2.185800      -1.059100     -0.3718000    
 C    1.055100       1.004300     -0.1164000    
 C    2.057000      -2.451200      0.1562000    
 C   -1.275000       1.113600      0.3483000    
 C   -1.797800       1.063800     -0.9403000    
 C   -2.008300      0.6293000       1.427000    
 C   -3.066700      0.5246000      -1.152100    
 C   -3.277100      9.0000004E-02   1.215100    
 C   -3.806300      3.7599999E-02 -7.4500002E-02
 H    3.649300       1.224100      -1.390900    
 H    3.785700     -0.6388000       1.039800    
 H    2.424400       1.833200       1.349000    
 H    1.996200      -1.085000      -1.452100    
 H   0.9010000       1.070700      -1.201600    
 H    5.511600       1.106300     -9.8999999E-02
 H    4.342100     -0.9653000      -1.732700    
 H    3.100700       3.514400     -4.3800000E-02
 H   -1.244200       1.454600      -1.789000    
 H   -1.599200      0.6677000       2.432700    
 H    2.901700      -4.189000     -8.8799998E-02
 H   -3.448700      0.5038000      -2.169500    
 H   -3.824300     -0.2798000       2.078500    


%chk=000082565-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000082565

0 1
O 1.621339 -1.103084 0.623764
O -0.140121 0.274851 1.059190
O 4.021897 2.124640 -0.581938
O 4.958799 -0.540177 -1.076527
O 1.177510 2.393844 -0.559285
O 4.643512 -3.012943 0.009940
O 2.698908 -3.576965 1.155409
O -5.798547 1.619906 -1.599917
O -6.450629 0.527715 0.295040
N -5.540810 0.998917 -0.494531
C 3.156801 0.950232 -0.685071
C 3.846330 -0.315610 -0.157643
C 1.883819 1.296096 0.098410
C 2.797051 -1.469937 -0.172253
C 0.929011 0.089505 0.107537
C 3.305747 -2.782972 0.427075
C -1.455172 0.464798 0.601846
C -1.766492 1.176737 -0.585186
C -2.473971 -0.045654 1.443643
C -3.115293 1.344724 -0.946423
C -3.820382 0.132027 1.088092
C -4.126261 0.817820 -0.111554
H 2.892314 0.765220 -1.750884
H 4.200101 -0.157907 0.882713
H 2.147783 1.552144 1.144167
H 2.523177 -1.665776 -1.236026
H 0.528125 -0.104536 -0.912102
H 4.872160 1.917416 -1.048458
H 5.382644 -1.408684 -0.838276
H 1.821540 3.141464 -0.662269
H -0.967523 1.640614 -1.170774
H -2.187179 -0.582093 2.351911
H 4.962538 -3.882402 0.374229
H -3.399308 1.892167 -1.848824
H -4.633121 -0.255297 1.707474


