%chk=000104940.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000104940

0 1
 O   -3.946100      0.9068000      0.4639000    
 O   -5.036400     -0.9011000     -0.6527000    
 O   5.7999998E-02  -1.493700      0.2915000    
 O   0.1440000       3.375300      0.2334000    
 O    2.306900       1.921200      0.1362000    
 O    4.490500      0.4880000      3.3799998E-02
 C   -2.904200      -1.316100      0.4402000    
 C   -4.224800     -0.5149000      0.4819000    
 C   -1.920500     -0.2106000      0.3713000    
 C   -2.582100       1.008100      0.3965000    
 C  -0.5362000     -0.2598000      0.3040000    
 C   -3.078200      -2.105100     -0.7975000    
 C   0.1651000      0.9473000      0.2558000    
 C   -1.903800       2.212400      0.3506000    
 C  -0.5103000       2.180100      0.2785000    
 C   -4.266900      -1.827700      -1.318700    
 C    1.634100      0.9021000      0.1815000    
 C    2.253100     -0.4323000      0.1620000    
 C    1.427400      -1.554900      0.2180000    
 C    3.641000     -0.5754000      8.8600002E-02
 C    1.993500      -2.831200      0.2005000    
 C    4.200900      -1.853000      7.1300000E-02
 C    3.379000      -2.978900      0.1272000    
 C   0.3894000       3.930300      -1.056900    
 C    4.826600      0.9832000      -1.260900    
 H   -2.776200      -1.936100       1.332700    
 H   -4.795500     -0.7353000       1.392800    
 H   -2.367100      -2.808400      -1.203100    
 H   -2.442300       3.154300      0.3701000    
 H   -4.714400      -2.232100      -2.209000    
 H    1.362200      -3.714800      0.2437000    
 H    5.278800      -1.981000      1.5799999E-02
 H    3.818400      -3.972200      0.1138000    
 H  -0.5417000       4.325400      -1.474900    
 H   0.8155000       3.188400      -1.740000    
 H    1.100000       4.754000     -0.9466000    
 H    5.326800       1.947900      -1.139700    
 H    3.935700       1.125200      -1.881100    
 H    5.515400      0.2918000      -1.756100    


%chk=000104940-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000104940

0 1
O -4.002948 0.797627 0.647933
O -5.208339 -1.043812 -0.375701
O 0.067073 -1.492532 0.101098
O 0.005288 3.484797 0.188851
O 2.346202 1.973037 -0.398973
O 4.673831 0.383528 0.072463
C -2.922867 -1.418205 0.428853
C -4.284565 -0.671598 0.699971
C -1.939943 -0.264666 0.337611
C -2.625336 0.957127 0.433949
C -0.553516 -0.237502 0.159621
C -3.199865 -2.110152 -0.907502
C 0.182445 0.985920 0.044686
C -1.977576 2.199559 0.356833
C -0.578803 2.213087 0.154384
C -4.466288 -1.834627 -1.299086
C 1.656847 0.933491 -0.136067
C 2.292124 -0.414441 -0.009411
C 1.472032 -1.575901 0.103021
C 3.716416 -0.638283 0.047189
C 1.975991 -2.885109 0.226995
C 4.229665 -1.945783 0.200583
C 3.369413 -3.063106 0.281305
C 0.437859 4.081623 -1.093679
C 5.003946 1.063569 -1.198675
H -2.660660 -2.136451 1.224769
H -4.801504 -0.851331 1.652462
H -2.460575 -2.693639 -1.452825
H -2.514730 3.144059 0.459365
H -5.031530 -2.120999 -2.184551
H 1.275619 -3.721252 0.297935
H 5.315830 -2.058617 0.261946
H 3.787901 -4.068818 0.390863
H -0.420523 4.137811 -1.791508
H 1.271075 3.501825 -1.521608
H 0.778381 5.094255 -0.831083
H 5.835821 1.738509 -0.947389
H 4.138657 1.644503 -1.555348
H 5.332753 0.319698 -1.950879


