%chk=000083533.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000083533

0 1
 O   -2.291800     -0.3985000      0.9638000    
 O   -1.848400      0.1508000      -1.952100    
 O   -4.146400       1.985600      0.1328000    
 O   -3.859600      -2.691700      0.7526000    
 O   0.6769000       2.365500      0.6673000    
 O    4.834600       1.040800      0.2010000    
 N  -0.1546000      0.2480000      0.2511000    
 N    2.214200      0.7436000      0.2532000    
 N    3.706100     -0.9647000     -0.1778000    
 C   -2.198300       1.048100     -0.9049000    
 C   -3.657500      0.8383000     -0.5584000    
 C   -1.516100      0.6671000      0.3999000    
 C   -3.626600     -0.3370000      0.4202000    
 C   -3.924700      -1.678000     -0.2356000    
 C   0.1452000      -1.079200     -4.5400001E-02
 C   0.9082000       1.184000      0.4047000    
 C    1.391200      -1.529200     -0.1957000    
 C    2.427100     -0.5003000     -2.1600001E-02
 C    4.826000     -0.1603000     -5.5500001E-02
 C    6.094500     -0.9329000     -0.2996000    
 H   -1.944700       2.067100      -1.212900    
 H   -4.306500      0.6600000      -1.420700    
 H   -1.564800       1.501900       1.109400    
 H   -4.305500     -0.1850000       1.267600    
 H   -3.188700      -1.922800      -1.007000    
 H   -4.925700      -1.682200     -0.6779000    
 H   -2.354400      0.4116000      -2.740500    
 H   -3.657600       2.087200      0.9662000    
 H  -0.6867000      -1.763100     -0.1681000    
 H   -4.057200      -3.535400      0.3114000    
 H    1.629200      -2.556900     -0.4315000    
 H    3.845700      -1.948300     -0.3969000    
 H    6.959400     -0.2942000     -9.9299997E-02
 H    6.129100      -1.264800      -1.341100    
 H    6.138700      -1.802000      0.3630000    


%chk=000083533-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000083533

0 1
O -2.561490 -0.086818 1.282866
O -1.919974 1.058857 -1.874095
O -4.799692 1.641849 0.327748
O -2.710974 -2.769506 0.199469
O 0.257752 2.306629 -0.681403
O 4.761132 0.703365 -1.077566
N -0.359325 0.305378 0.352358
N 1.928635 0.679597 -0.370168
N 3.527157 -1.062468 -0.083247
C -2.483225 1.464706 -0.598127
C -3.886114 0.806694 -0.456183
C -1.700855 0.916129 0.660044
C -3.588527 -0.518847 0.270672
C -3.094710 -1.631616 -0.655964
C -0.060982 -0.983840 0.726384
C 0.634935 1.162500 -0.266591
C 1.221975 -1.476572 0.554271
C 2.212009 -0.573052 0.017005
C 4.706402 -0.450354 -0.601698
C 5.915221 -1.389196 -0.521649
H -2.567860 2.562821 -0.526945
H -4.361364 0.694316 -1.440929
H -1.523304 1.716035 1.399805
H -4.440342 -0.874162 0.872487
H -2.247993 -1.281615 -1.277621
H -3.936452 -1.906116 -1.326395
H -1.102370 1.616297 -2.005632
H -4.496196 1.643129 1.273313
H -0.884523 -1.570959 1.143898
H -2.505623 -3.549935 -0.373568
H 1.455423 -2.503849 0.843241
H 3.653764 -2.017034 0.262497
H 6.809937 -0.833103 -0.835360
H 5.785659 -2.256505 -1.196075
H 6.072193 -1.769652 0.504859


