%chk=000034434.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000034434

0 1
 O   0.2410000      5.3700000E-02 -0.5398000    
 O   -2.455400      -1.679300       2.049600    
 O   -4.065900       2.180400      -1.543600    
 O   1.5799999E-02 -0.6162000       1.681400    
 O    1.794500      -3.576500      -1.447500    
 O   4.5400001E-02  -2.262800      -1.264000    
 N    1.857500       2.098300      0.2761000    
 N    1.279100      -2.466600      -1.175000    
 C    2.402100      0.9026000     -1.8900000E-02
 C    1.591600     -0.1496000     -0.4363000    
 C    3.790000      0.6717000      8.1299998E-02
 C    2.122500      -1.403100     -0.7503000    
 C    4.324400     -0.5890000     -0.2346000    
 C   -1.918900      1.4900000E-02  0.4387000    
 C    3.490600      -1.623400     -0.6495000    
 C    4.606400       1.730600      0.5015000    
 C   -2.838000     -0.7219000       1.158200    
 C  -0.4660000     -0.2284000      0.6275000    
 C   -2.303100      0.9861000     -0.4648000    
 C   -3.663100       1.230000     -0.6563000    
 C   -4.198000     -0.4779000      0.9667000    
 C    4.048200       2.963700      0.8061000    
 C   -4.610400      0.4979000      5.9300002E-02
 C    2.680200       3.094100      0.6779000    
 C   -2.299300      -3.005100       1.548400    
 C   -5.471300       2.375800      -1.692300    
 H    5.394200     -0.7715000     -0.1588000    
 H    3.945700      -2.581900     -0.8836000    
 H    5.682100       1.599900      0.5938000    
 H   -1.582800       1.578300      -1.022100    
 H   -4.941100      -1.044300       1.521800    
 H    4.664400       3.793100       1.132500    
 H   -5.681600      0.6357000     -4.0500000E-02
 H    2.187800       4.034600      0.9022000    
 H   -1.492400      -3.050300      0.8131000    
 H   -3.233600      -3.361800       1.103200    
 H   -2.041700      -3.658400       2.386600    
 H   -5.963300       1.478800      -2.083400    
 H   -5.610700       3.166800      -2.436500    
 H   -5.929200       2.728200     -0.7618000    


%chk=000034434-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000034434

0 1
O 0.145869 -0.450662 -0.509140
O -3.058897 -1.941913 2.040862
O -3.770773 2.326302 -1.579271
O -0.076667 -0.864390 1.785978
O 2.240821 -3.651263 -2.030067
O 0.465230 -3.165872 -0.685030
N 1.481099 1.794598 0.371441
N 1.608098 -2.879116 -1.207204
C 2.239777 0.705576 -0.025332
C 1.537351 -0.487959 -0.423090
C 3.685416 0.717482 -0.056991
C 2.274168 -1.611556 -0.828755
C 4.394361 -0.445426 -0.502681
C -2.044364 -0.255733 0.442537
C 3.702150 -1.586385 -0.891071
C 4.339212 1.921500 0.362522
C -3.124680 -0.853647 1.171057
C -0.624299 -0.566149 0.710100
C -2.323126 0.786543 -0.482455
C -3.629017 1.282452 -0.647858
C -4.429147 -0.326798 1.005118
C 3.570644 3.011832 0.772816
C -4.690549 0.733574 0.120464
C 2.141467 2.901645 0.757280
C -2.038918 -2.996251 1.874691
C -5.114911 2.869260 -1.779282
H 5.489192 -0.429346 -0.532272
H 4.217221 -2.483373 -1.243958
H 5.433695 1.971156 0.356000
H -1.502391 1.241734 -1.041293
H -5.237372 -0.794298 1.575148
H 4.036729 3.945695 1.100907
H -5.714215 1.107100 0.023723
H 1.520659 3.748334 1.071760
H -1.140322 -2.756072 2.464493
H -1.758708 -3.120494 0.812420
H -2.520204 -3.912675 2.250175
H -5.813326 2.094582 -2.152944
H -4.996569 3.656182 -2.538490
H -5.517003 3.311030 -0.846007


