%chk=000029332.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000029332

0 1
 O   -3.500900     -0.5982000     -0.3205000    
 O   -2.655000       1.405400      0.4491000    
 O    3.507000      0.7929000     -0.9000000    
 O    1.797700      -2.303000     -0.3782000    
 O    2.351800       1.758500      0.7034000    
 O    1.587300      -1.166400       1.493400    
 N    2.489900      0.9316000     -0.2081000    
 N    1.597300      -1.259900      0.2589000    
 C  -5.1000002E-03  0.6208000     -0.1257000    
 C    1.338400      9.1000004E-03 -0.5144000    
 C   -1.175300     -0.3281000     -0.4018000    
 C   -2.504300      0.2899000     -2.9899999E-02
 C   -4.828800     -0.1525000     -2.6200000E-02
 H  -2.5599999E-02  0.8986000      0.9371000    
 H  -0.1544000       1.554800     -0.6837000    
 H    1.384500     -0.2291000      -1.582800    
 H   -1.070900      -1.249800      0.1805000    
 H   -1.200700     -0.5785000      -1.468300    
 H   -5.066900      0.7406000     -0.6118000    
 H   -4.932400      4.7600001E-02   1.044400    
 H   -5.524100     -0.9494000     -0.3033000    


%chk=000029332-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000029332

0 1
O -3.525032 -0.654269 -0.110230
O -2.713032 1.530039 -0.127681
O 3.623149 0.746945 -0.696328
O 1.587738 -2.320014 -0.663061
O 2.281723 1.970328 0.695179
O 1.952435 -1.342894 1.375666
N 2.504887 1.015009 -0.124167
N 1.671300 -1.313352 0.126465
C -0.013704 0.571531 0.015509
C 1.332633 0.068203 -0.491488
C -1.161887 -0.383770 -0.375776
C -2.513233 0.295798 -0.186051
C -4.906293 -0.120715 0.026090
H 0.033369 0.707532 1.109325
H -0.201204 1.569226 -0.419567
H 1.388565 -0.077915 -1.581389
H -1.149368 -1.321177 0.206366
H -1.089235 -0.680628 -1.441475
H -5.148845 0.528367 -0.831555
H -4.996729 0.458649 0.959693
H -5.547736 -1.011994 0.046576


