%chk=000161704.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000161704

0 1
 O   -3.095400       1.227200     -0.3807000    
 O   -2.634100      -2.100000       1.110000    
 O   3.4299999E-02   2.208900     -3.1700000E-02
 O    1.144800      -1.153800      -2.089200    
 C   -2.993400      0.1809000      0.5966000    
 C   -2.050600       1.344900      0.5984000    
 C   -2.523400      -1.132600      6.4300001E-02
 C  -0.6965000       1.227200      2.2200000E-02
 C  -0.2662000     -0.1123000     -0.4778000    
 C   -1.111600      -1.155900     -0.4470000    
 C    1.128800     -0.2162000      -1.013900    
 C    2.086700     -0.7049000      3.2699998E-02
 C    3.205200     -9.8499998E-02  0.4760000    
 C    4.065700     -0.7576000       1.521400    
 C    3.705700       1.242500      1.8900000E-02
 H   -3.785400      0.1191000       1.329300    
 H   -2.179900       2.085200       1.379400    
 H   -3.196000      -1.454100     -0.7381000    
 H  -0.7760000      -2.124100     -0.8135000    
 H    1.427300      0.7343000      -1.460200    
 H   -2.033700      -1.836100       1.828600    
 H    1.846900      -1.682900      0.4515000    
 H    2.044700      -1.166200      -2.458700    
 H    5.077300     -0.9162000       1.133700    
 H    4.129800     -0.1255000       2.413100    
 H    3.673500      -1.731400       1.832900    
 H    3.799400       1.918400      0.8758000    
 H    3.057100       1.735200     -0.7071000    
 H    4.693000       1.135700     -0.4428000    


%chk=000161704-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000161704

0 1
O -3.003392 1.395914 -0.396297
O -2.679906 -2.124678 1.086735
O 0.367422 1.969316 0.478964
O 1.042141 -1.361655 -2.117610
C -2.975859 0.267813 0.594281
C -1.949330 1.362397 0.704850
C -2.583890 -1.088515 0.022995
C -0.538970 1.113995 0.236843
C -0.266079 -0.151375 -0.496126
C -1.214835 -1.132180 -0.613139
C 1.136299 -0.318621 -1.069714
C 2.122192 -0.751627 0.000294
C 3.209673 -0.061446 0.452555
C 4.103087 -0.659183 1.527017
C 3.606027 1.329045 -0.004928
H -3.820117 0.249719 1.295483
H -2.053681 2.160237 1.449009
H -3.352268 -1.406595 -0.703650
H -0.963945 -2.035314 -1.180342
H 1.447686 0.644777 -1.517457
H -1.895200 -2.028983 1.687299
H 1.901603 -1.743521 0.423236
H 1.964475 -1.637065 -2.351030
H 5.144889 -0.758501 1.163563
H 4.141430 0.002733 2.414751
H 3.754157 -1.653842 1.853815
H 3.323785 2.072681 0.765025
H 3.109066 1.640150 -0.937097
H 4.701540 1.395525 -0.145225


