%chk=000029628.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000029628

0 1
 O   -1.925200     -0.8255000       1.206100    
 O   -2.106900      -1.185800      -1.135300    
 O    1.914700     -0.6288000     -0.2827000    
 C  -0.3175000      0.2480000     -0.2892000    
 C    1.172400      0.5697000     -0.4546000    
 C   -1.134700       1.547400     -0.4256000    
 C  -0.5732000     -0.3781000       1.094600    
 C  -0.7644000     -0.7568000      -1.367800    
 C  -0.7102000       2.563500      0.6220000    
 C    1.438300       1.150800      -1.829600    
 C   -2.241700      -1.756200      0.1685000    
 C    3.194900     -0.3747000      0.2806000    
 C   -1.532200       3.836700      0.5019000    
 C   -3.692200      -2.172100      0.3450000    
 C    3.101500     -0.4188000       1.797100    
 C    4.176200      -1.419600     -0.2311000    
 H    1.491300       1.285200      0.3075000    
 H   -2.202600       1.331500     -0.2853000    
 H   -1.068800       1.975900      -1.431200    
 H   6.7199998E-02  -1.255600       1.251900    
 H  -0.3563000      0.2849000       1.934100    
 H  -0.7609000     -0.3125000      -2.367600    
 H  -0.1222000      -1.645000      -1.401300    
 H   0.3322000       2.869700      0.5080000    
 H  -0.8458000       2.198800       1.642200    
 H   0.9127000       2.087000      -2.026700    
 H    2.506500       1.380100      -1.929100    
 H    1.238300      0.4405000      -2.637300    
 H   -1.602400      -2.644500      0.2550000    
 H    3.578000      0.6058000     -3.0099999E-02
 H   -1.405800       4.295700     -0.4840000    
 H   -2.597400       3.633300      0.6525000    
 H   -1.217800       4.565200       1.256300    
 H   -3.992100      -2.886600     -0.4278000    
 H   -3.855500      -2.616200       1.332000    
 H   -4.354700      -1.302800      0.2629000    
 H    4.081800     -0.2675000       2.259900    
 H    2.423800      0.3521000       2.177300    
 H    2.701000      -1.380900       2.135800    
 H    5.179500      -1.260600      0.1757000    
 H    4.233000      -1.383600      -1.324500    
 H    3.845700      -2.430400      3.2699998E-02


%chk=000029628-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000029628

0 1
O -1.926094 -0.822445 1.264819
O -2.098736 -1.186881 -1.112996
O 1.960630 -0.631374 -0.316535
C -0.294445 0.326356 -0.253494
C 1.225310 0.657838 -0.382678
C -1.182126 1.599174 -0.405015
C -0.532014 -0.355206 1.127006
C -0.711295 -0.719023 -1.332170
C -0.900693 2.768740 0.566988
C 1.617935 1.405015 -1.672786
C -2.234655 -1.793434 0.211050
C 3.334501 -0.544477 0.237685
C -1.872965 3.946579 0.333735
C -3.673474 -2.243115 0.383311
C 3.301199 -0.533391 1.779531
C 4.087954 -1.755025 -0.327945
H 1.514059 1.276685 0.496230
H -2.232913 1.278134 -0.279143
H -1.097793 1.972258 -1.446495
H 0.164195 -1.212044 1.234823
H -0.377660 0.344828 1.964862
H -0.723548 -0.281890 -2.344064
H -0.014768 -1.581639 -1.308979
H 0.140607 3.133035 0.452333
H -1.000984 2.424423 1.614933
H 1.153181 2.405737 -1.719863
H 2.713577 1.544410 -1.713890
H 1.318781 0.834633 -2.568755
H -1.499291 -2.632921 0.288701
H 3.812730 0.391631 -0.126964
H -1.785619 4.334938 -0.698852
H -2.920804 3.625288 0.481893
H -1.672326 4.782946 1.028388
H -3.935152 -2.977887 -0.396019
H -3.809592 -2.701401 1.376901
H -4.345530 -1.373596 0.294758
H 4.324534 -0.441403 2.188943
H 2.705833 0.313160 2.167767
H 2.856768 -1.471594 2.157396
H 5.125023 -1.783927 0.053141
H 4.114187 -1.714357 -1.430211
H 3.579974 -2.689580 -0.029540


