%chk=000021717.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000021717

0 1
 O  -0.5294000      -3.456800      0.1508000    
 O   -2.337400      -2.311200     -0.5929000    
 C   0.9651000      -1.018500     -0.2310000    
 C  -0.4605000      -1.070300      0.3621000    
 C    1.910000      1.1700000E-02  0.4026000    
 C    3.309200     -7.1900003E-02 -0.2142000    
 C   -1.226900      0.2258000      0.1716000    
 C    4.247500      0.9704000      0.3941000    
 C   -1.229000      -2.312000     -7.4000001E-02
 C   -1.108200      0.9060000      -1.025500    
 C   -2.023900      0.6918000       1.200000    
 C    5.646800      0.8696000     -0.1914000    
 C   -1.812600       2.097100      -1.200800    
 C   -2.728300       1.882900       1.024500    
 C   -2.622700       2.585400     -0.1758000    
 H   0.9395000     -0.8896000      -1.319400    
 H    1.433400      -2.002100     -8.9000002E-02
 H  -0.3317000      -1.201600       1.447700    
 H    1.973000     -0.1668000       1.482700    
 H    1.515500       1.024300      0.2644000    
 H    3.244000      8.2599998E-02  -1.298100    
 H    3.721200      -1.075800     -5.4699998E-02
 H    4.302600      0.8330000       1.480300    
 H    3.852700       1.977000      0.2139000    
 H  -0.5100000      0.5430000      -1.853400    
 H   -2.115600      0.1514000       2.137400    
 H    5.631800       1.032600      -1.273700    
 H    6.083200     -0.1155000      2.0000001E-03
 H    6.300500       1.624500      0.2568000    
 H   -1.735600       2.641300      -2.137600    
 H   -3.360100       2.262700       1.822100    
 H   -3.172500       3.511900     -0.3129000    
 H   -1.024200      -4.250700     -0.1444000    


%chk=000021717-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000021717

0 1
O -1.837147 -3.126070 0.537782
O -1.157602 -2.610055 -1.619156
C 1.069237 -1.116674 -0.317467
C -0.365398 -1.220277 0.281561
C 1.949930 -0.077398 0.407252
C 3.376686 0.002965 -0.181034
C -1.165517 0.084149 0.131593
C 4.271524 1.038130 0.538203
C -1.126634 -2.355426 -0.394072
C -1.502690 0.584098 -1.153050
C -1.557497 0.817427 1.278321
C 5.695645 1.116665 -0.052987
C -2.210308 1.798940 -1.283651
C -2.264035 2.035132 1.148277
C -2.591528 2.530815 -0.134301
H 0.991130 -0.869234 -1.392926
H 1.552058 -2.113056 -0.258946
H -0.295554 -1.465521 1.356267
H 2.013244 -0.333883 1.485980
H 1.471489 0.920322 0.349795
H 3.315131 0.260110 -1.259123
H 3.857789 -0.996286 -0.126875
H 4.330335 0.782138 1.615978
H 3.790219 2.035760 0.481857
H -1.224940 0.012592 -2.046440
H -1.309873 0.434673 2.275853
H 5.665620 1.400491 -1.121986
H 6.209550 0.139382 0.019418
H 6.314297 1.863756 0.477521
H -2.468265 2.173096 -2.280916
H -2.558641 2.592578 2.044613
H -3.140691 3.473419 -0.237491
H -2.350164 -3.830558 0.054351


