%chk=000060196.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000060196

0 1
 O    2.244700      -1.325700      0.8917000    
 O   -2.712400     -0.5103000     -0.1109000    
 O    1.405400       1.196800      8.1200004E-02
 N    5.940100       2.364700      -1.022900    
 C  -0.3170000      -2.140200     -0.2984000    
 C   0.7225000      -3.097600      0.2918000    
 C   -1.732000      -2.694700     -0.1443000    
 C    2.140000      -2.549700      0.1789000    
 C   -2.768700      -1.769800     -0.7661000    
 C    3.148300     -0.4093000      0.4190000    
 C    2.721400      0.8508000      1.5000000E-02
 C   -3.875800      0.2128000     -5.9500001E-02
 C    4.492700     -0.7577000      0.3495000    
 C    3.650500       1.774200     -0.4644000    
 C    5.000700       1.431500     -0.5371000    
 C    5.421800      0.1656000     -0.1302000    
 C   -4.813000      8.1500001E-02  -1.077600    
 C   -4.105000       1.070600       1.010000    
 C   -5.996100      0.8186000      -1.025300    
 C   -5.288200       1.807400       1.062200    
 C   -6.233800       1.681400      4.4599999E-02
 C   0.9537000       1.798800       1.292700    
 H  -9.7400002E-02  -1.972800      -1.359800    
 H  -0.2482000      -1.168400      0.2030000    
 H   0.6670000      -4.068000     -0.2146000    
 H   0.4876000      -3.262100       1.350700    
 H   -1.950200      -2.818800      0.9235000    
 H   -1.800000      -3.682400     -0.6146000    
 H    2.843300      -3.270300      0.6114000    
 H    2.393100      -2.413900     -0.8807000    
 H   -3.747200      -2.251100     -0.6410000    
 H   -2.564300      -1.635400      -1.834600    
 H    4.835200      -1.737100      0.6711000    
 H    3.316600       2.759600     -0.7812000    
 H    6.471400     -0.1128000     -0.1804000    
 H   -4.654400     -0.5570000      -1.941100    
 H   -3.370600       1.171900       1.804000    
 H   -6.729900      0.7259000      -1.820700    
 H   -5.473000       2.479800       1.894900    
 H   -7.154300       2.256300      8.4399998E-02
 H    6.919300       2.117100      -1.074600    
 H    5.635800       3.283300      -1.316800    
 H  -0.1167000       2.000600       1.196000    
 H    1.106400       1.122400       2.139700    
 H    1.474700       2.745300       1.467900    


%chk=000060196-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000060196

0 1
O 2.046868 -0.895320 0.460927
O -3.188038 -0.790811 0.185136
O 2.106313 1.816403 1.373327
N 6.351750 2.582349 -0.814507
C -0.576087 -2.177707 -0.256219
C 0.675341 -2.883076 0.309851
C -1.885080 -2.828793 0.240073
C 1.994564 -2.241686 -0.130495
C -3.148243 -2.173933 -0.324508
C 3.164966 -0.089665 0.141290
C 3.164956 1.251258 0.634565
C -4.257137 0.027022 -0.213168
C 4.256928 -0.516749 -0.648106
C 4.224255 2.121538 0.312384
C 5.312140 1.697545 -0.499645
C 5.317869 0.357202 -0.969986
C -5.319924 -0.393769 -1.052369
C -4.225146 1.353465 0.287552
C -6.346645 0.522846 -1.381218
C -5.254902 2.252865 -0.049535
C -6.324185 1.844556 -0.885888
C 1.647674 1.092906 2.575552
H -0.545648 -2.210022 -1.365864
H -0.561834 -1.111729 0.030636
H 0.689292 -3.944728 -0.014229
H 0.636283 -2.887860 1.417250
H -1.928970 -2.786430 1.346057
H -1.904718 -3.902107 -0.042663
H 2.861280 -2.838047 0.225404
H 2.048018 -2.162517 -1.237571
H -4.059109 -2.714865 0.007108
H -3.125978 -2.159135 -1.435127
H 4.286624 -1.538474 -1.038388
H 4.175647 3.141873 0.708317
H 6.145885 -0.002751 -1.591865
H -5.358725 -1.412651 -1.448670
H -3.389158 1.652260 0.927637
H -7.166919 0.194885 -2.030178
H -5.222615 3.276850 0.339419
H -7.122658 2.547226 -1.146216
H 7.131394 2.282960 -1.391026
H 6.332841 3.543141 -0.488306
H 0.874838 1.740989 3.017327
H 1.226471 0.109670 2.310869
H 2.483521 0.964816 3.291465


