%chk=000104756.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000104756

0 1
 O   -4.218900      -2.307400     -0.3663000    
 O   -4.793200      6.1400000E-02 -0.1509000    
 O   -3.111000       1.692700      0.2844000    
 O   0.2390000      -1.612700      0.4131000    
 O    1.406700       3.039000     -0.5009000    
 O    1.842200      -3.255100      0.4786000    
 O    4.609900      -2.231600     -3.7500001E-02
 C   -3.042600      -1.515700     -0.5644000    
 C   -2.620800     -0.6951000      0.6018000    
 C   -4.380500      -1.031600      -1.001500    
 C   -3.685600      0.4294000      0.6966000    
 C   -1.417200      0.1224000      0.3337000    
 C   -1.769100       1.449300      0.1636000    
 C  -8.8600002E-02 -0.2512000      0.2307000    
 C   0.8960000      0.7052000     -4.9500000E-02
 C  -0.8304000       2.425900     -0.1189000    
 C    2.273000      0.2449000     -0.1471000    
 C   0.5126000       2.046800     -0.2240000    
 C    3.451400       1.114700     -0.4384000    
 C    2.547700      -1.048200      2.9600000E-02
 C    4.638700      0.1533000     -0.4339000    
 C    1.550800      -2.076200      0.3229000    
 C    4.003200      -1.175700     -0.1336000    
 C    1.986600       3.715600      0.6118000    
 H   -2.298400      -1.846200      -1.268900    
 H   -2.550000      -1.272200       1.528700    
 H   -4.617800      -1.003700      -2.055300    
 H   -4.057100      0.5433000       1.721700    
 H   -1.131200       3.460000     -0.2545000    
 H    3.373300       1.616500      -1.408000    
 H    3.629400       1.851300      0.3450000    
 H    5.362300      0.4079000      0.3458000    
 H    5.129300      0.1199000      -1.410900    
 H    2.956100       4.121000      0.3096000    
 H    2.119100       3.058900       1.478300    
 H    1.339700       4.551600      0.8964000    


%chk=000104756-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000104756

0 1
O -4.420596 -2.113656 -0.431524
O -4.500769 0.359186 -0.452332
O -2.970761 1.704814 0.829445
O 0.224539 -1.700246 0.210378
O 1.738201 2.936022 0.107282
O 1.648288 -3.504354 -0.076471
O 4.635701 -2.634457 -0.487750
C -3.007685 -1.537113 -0.548900
C -2.608216 -0.738098 0.692191
C -4.155529 -0.828931 -1.171856
C -3.697582 0.401535 0.779335
C -1.334992 0.063492 0.516918
C -1.618630 1.438552 0.585792
C -0.011540 -0.335762 0.293119
C 1.043893 0.636588 0.156320
C -0.647093 2.448461 0.458631
C 2.371259 0.122692 -0.061037
C 0.684852 2.033778 0.246343
C 3.660059 0.915111 -0.232497
C 2.618744 -1.253302 -0.139911
C 4.767025 -0.147413 -0.432051
C 1.592130 -2.272754 -0.019526
C 4.066022 -1.521385 -0.367609
C 1.435527 4.373349 0.187611
H -2.274938 -2.158288 -1.067945
H -2.602420 -1.380434 1.588374
H -4.452707 -0.784098 -2.219730
H -4.374726 0.395655 1.642822
H -0.938719 3.497231 0.523948
H 3.568978 1.610320 -1.085422
H 3.831292 1.556971 0.649582
H 5.547963 -0.104933 0.347749
H 5.281775 -0.052575 -1.404657
H 2.404633 4.874213 0.053200
H 1.010682 4.632574 1.174977
H 0.739941 4.675654 -0.617000


