%chk=000056021.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000056021

0 1
 O   -2.217300      -2.730200     -8.6400002E-02
 O    1.509500       1.357300       1.409600    
 N    5.638800      0.3377000     -0.2881000    
 N    2.074100     -0.5840000      0.2742000    
 N  -0.5905000      -1.151500      0.3133000    
 C   -2.458200      0.9259000     -3.8300000E-02
 C   -1.120500       1.208000      0.2624000    
 C    4.212000      0.2572000     -0.5735000    
 C    3.496100     -0.5166000      0.5239000    
 C   -2.860400     -0.4199000     -0.1635000    
 C  -0.2419000      0.1479000      0.4256000    
 C    1.162500      0.3697000      0.7395000    
 C   -1.886900      -1.403400      2.2600001E-02
 C   -3.409700       1.943100     -0.2186000    
 C  -0.6245000       2.611600      0.4098000    
 C   -4.198300     -0.7240000     -0.4647000    
 C   -4.736600       1.629400     -0.5178000    
 C    6.328800       1.113600      -1.320600    
 C    6.221600      -1.001800     -0.1865000    
 C   -5.130100      0.2989000     -0.6405000    
 C   -1.168400      -3.668500      0.1174000    
 H    4.021400     -0.2138000      -1.547500    
 H    3.788500       1.268700     -0.6258000    
 H    3.662700     -5.3300001E-02   1.503100    
 H    3.816500      -1.560900      0.5770000    
 H    1.725200      -1.367900     -0.2702000    
 H   -3.179800       2.997900     -0.1175000    
 H   0.3529000       2.746000     -6.6699997E-02
 H   -1.239000       3.355000     -0.1015000    
 H  -0.5698000       2.891800       1.466600    
 H   -4.533300      -1.753500     -0.5660000    
 H   -5.465200       2.424100     -0.6505000    
 H    5.915600       2.126700      -1.381200    
 H    6.249100      0.6483000      -2.309800    
 H    7.390800       1.224100      -1.074900    
 H    7.314800     -0.9373000     -0.1232000    
 H    5.976600      -1.632300      -1.049000    
 H    5.917800      -1.511100      0.7332000    
 H   -6.163400      5.7599999E-02 -0.8721000    
 H  -0.3770000      -3.544500     -0.6296000    
 H   -1.588000      -4.671800     -3.0000000E-03
 H  -0.7641000      -3.594200       1.132600    


%chk=000056021-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000056021

0 1
O -1.984172 -2.632363 -0.274445
O 1.773214 1.941129 0.703883
N 5.722794 -0.034309 -0.347922
N 2.039025 -0.363294 0.553532
N -0.472124 -0.867735 0.120970
C -2.578967 1.013692 0.009098
C -1.217018 1.471991 0.252694
C 4.258403 -0.011681 -0.553417
C 3.489604 -0.324406 0.758218
C -2.848671 -0.391277 -0.173306
C -0.206987 0.496077 0.297341
C 1.269973 0.780014 0.534401
C -1.712557 -1.280101 -0.099122
C -3.689935 1.915958 -0.059495
C -0.963196 2.954757 0.444328
C -4.174037 -0.858252 -0.412591
C -4.987084 1.445640 -0.295430
C 6.455331 0.838407 -1.286894
C 6.284632 -1.398040 -0.308213
C -5.235358 0.051788 -0.473581
C -0.838938 -3.557161 -0.197910
H 3.931474 -0.724124 -1.354392
H 3.959318 1.001917 -0.873808
H 3.728995 0.467255 1.488501
H 3.809686 -1.294857 1.178067
H 1.524382 -1.235600 0.386628
H -3.520077 2.987945 0.074263
H 0.104258 3.145878 0.616855
H -1.287638 3.525815 -0.446914
H -1.538795 3.340764 1.307691
H -4.336405 -1.931552 -0.545073
H -5.821769 2.153819 -0.344185
H 6.064897 1.868615 -1.217724
H 6.382462 0.509177 -2.355167
H 7.526069 0.860694 -1.012925
H 7.357732 -1.350591 -0.049530
H 6.186934 -1.941589 -1.283932
H 5.781783 -2.001143 0.467895
H -6.255651 -0.301467 -0.657238
H -0.096662 -3.322736 -0.980983
H -1.277175 -4.552773 -0.359201
H -0.355348 -3.496279 0.792833


