%chk=000097448.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097448

0 1
 O   0.3605000       2.042600      0.8656000    
 O   -1.418900      -2.912100     -5.7300001E-02
 C   0.8018000     -0.2851000      0.8892000    
 C    2.188300     -3.7599999E-02   1.400300    
 C   -1.426100      0.6898000      0.1498000    
 C   -1.897200     -0.6011000     -9.3999997E-02
 C  -5.4600000E-02  0.9090000      0.6522000    
 C   0.3345000      -1.515900      0.6505000    
 C   -1.031100      -1.768300      0.1472000    
 C    3.026100      0.7032000      0.4030000    
 C   -2.259700       1.790500     -8.2999997E-02
 C   -3.199200     -0.7942000     -0.5701000    
 C    3.764800      0.1884000     -0.5987000    
 C   -3.557300       1.595000     -0.5574000    
 C   -4.026100      0.3054000     -0.8006000    
 C    4.586300      0.9894000      -1.568900    
 C    3.807800      -1.299200     -0.8279000    
 H    2.133000      0.5596000       2.320200    
 H    2.678100     -0.9669000       1.713100    
 H   0.9506000      -2.392700      0.8235000    
 H    3.030700       1.786600      0.5177000    
 H   -1.918300       2.806000      9.8499998E-02
 H   -3.586700      -1.790300     -0.7667000    
 H   -4.203000       2.449700     -0.7376000    
 H   -5.036600      0.1562000      -1.169900    
 H    5.641000      0.7036000      -1.503400    
 H    4.517100       2.062900      -1.364800    
 H    4.239700      0.8206000      -2.593400    
 H    3.235200      -1.895000     -0.1168000    
 H    3.421500      -1.530700      -1.826600    
 H    4.844100      -1.651200     -0.7757000    


%chk=000097448-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000097448

0 1
O 0.245126 2.089094 1.096712
O -1.488229 -2.901301 -0.382922
C 0.729477 -0.254162 0.816040
C 2.153530 -0.012651 1.286252
C -1.569252 0.745221 0.228473
C -2.025698 -0.548095 -0.157338
C -0.175583 0.943605 0.733583
C 0.259561 -1.491466 0.449052
C -1.111296 -1.728788 -0.053973
C 2.976349 0.654579 0.185539
C -2.442811 1.855787 0.132125
C -3.346997 -0.717211 -0.633812
C 3.914611 0.065924 -0.611034
C -3.758793 1.681259 -0.344409
C -4.211594 0.393721 -0.727978
C 4.648706 0.880224 -1.665415
C 4.317564 -1.396533 -0.548780
H 2.128301 0.666717 2.158673
H 2.604904 -0.967348 1.604250
H 0.899190 -2.380401 0.508846
H 2.750820 1.719156 0.037035
H -2.069880 2.839498 0.434776
H -3.670086 -1.723034 -0.921023
H -4.432429 2.541555 -0.418190
H -5.234279 0.261877 -1.097091
H 5.740878 0.879382 -1.478008
H 4.304924 1.928443 -1.688917
H 4.500418 0.445349 -2.674108
H 3.837194 -1.949398 0.274813
H 4.057096 -1.910192 -1.495747
H 5.414579 -1.492611 -0.429425


