%chk=000084430.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000084430

0 1
 O   -5.053000       1.287500     -0.5664000    
 O   -8.649200     -0.7239000      0.2105000    
 O   -7.498100       1.240300      0.5880000    
 C    2.574400      0.3239000     -0.1218000    
 C    3.863100     -0.4899000      2.8700000E-02
 C    1.308100     -0.5364000     -5.2900001E-02
 C    5.103500      0.4002000     -8.1500001E-02
 C   1.8800000E-02  0.2716000     -0.2245000    
 C    6.418800     -0.3781000      2.8700000E-02
 C   -1.216100     -0.6303000     -0.1637000    
 C    7.661700      0.5159000     -1.1900000E-02
 C   -2.539500      0.1324000     -0.3062000    
 C    8.941500     -0.3042000      0.1703000    
 C   -3.796800     -0.7262000     -0.1780000    
 C    10.21280      0.5479000      0.1639000    
 C   -5.073300      7.1400002E-02 -0.3750000    
 C    11.49060     -0.2632000      0.3163000    
 C   -6.378600     -0.6932000     -0.3514000    
 C   -7.545600      8.0700003E-02  0.2013000    
 C   -9.843300     -0.1263000      0.7256000    
 H    2.533700       1.087900      0.6643000    
 H    2.592400      0.8557000      -1.081200    
 H    3.862700      -1.003200      0.9977000    
 H    3.899400      -1.263900     -0.7473000    
 H    1.282900      -1.060000      0.9109000    
 H    1.357100      -1.307600     -0.8316000    
 H    5.069600       1.162000      0.7073000    
 H    5.085700      0.9346000      -1.039300    
 H   3.9900001E-02  0.7991000      -1.185600    
 H  -4.2700000E-02   1.033400      0.5617000    
 H    6.472100      -1.112000     -0.7849000    
 H    6.415800     -0.9462000      0.9675000    
 H   -1.154800      -1.387600     -0.9550000    
 H   -1.220800      -1.170100      0.7914000    
 H    7.698100       1.052100     -0.9675000    
 H    7.596300       1.270500      0.7810000    
 H   -2.573200      0.9258000      0.4519000    
 H   -2.546900      0.6413000      -1.278900    
 H    9.007000      -1.052500     -0.6293000    
 H    8.887800     -0.8565000       1.116800    
 H   -3.832500      -1.186000      0.8155000    
 H   -3.777800      -1.521500     -0.9311000    
 H    10.26460       1.114100     -0.7737000    
 H    10.16070       1.282900      0.9760000    
 H    11.49150     -0.8152000       1.261500    
 H    12.36370      0.3966000      0.3052000    
 H    11.59580     -0.9826000     -0.5018000    
 H   -6.601300      -1.004100      -1.376700    
 H   -6.242400      -1.578100      0.2799000    
 H   -10.64370     -0.8694000      0.6773000    
 H   -10.12800      0.7367000      0.1163000    
 H   -9.699500      0.1677000       1.769800    


%chk=000084430-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000084430

0 1
O -5.291467 1.019687 -1.943434
O -8.111396 0.148372 0.732608
O -6.225935 -0.963357 1.531261
C 2.398196 0.274900 -0.436232
C 3.695033 -0.499383 -0.109145
C 1.128702 -0.605636 -0.396285
C 4.957011 0.392742 -0.118946
C -0.162240 0.173148 -0.735528
C 6.257042 -0.377613 0.204902
C -1.442457 -0.686871 -0.639398
C 7.514846 0.520604 0.209828
C -2.720517 0.097532 -1.010452
C 8.816590 -0.247338 0.532726
C -3.998152 -0.742372 -0.830715
C 10.072418 0.654309 0.543547
C -5.275388 -0.051492 -1.287795
C 11.368733 -0.120548 0.865596
C -6.608686 -0.748830 -0.907876
C -6.924384 -0.561506 0.570475
C -8.511644 0.419715 2.137450
H 2.282242 1.113465 0.282042
H 2.491874 0.738214 -1.440848
H 3.593798 -0.978718 0.887263
H 3.823828 -1.325640 -0.839366
H 1.029500 -1.057722 0.612977
H 1.245548 -1.451621 -1.105596
H 4.827419 1.216171 0.614424
H 5.056280 0.876395 -1.113445
H -0.078592 0.593939 -1.759305
H -0.255588 1.041542 -0.050405
H 6.393115 -1.194966 -0.534029
H 6.154359 -0.868908 1.195314
H -1.342678 -1.569205 -1.306383
H -1.536553 -1.085699 0.392375
H 7.616805 1.013620 -0.779843
H 7.378174 1.336850 0.949986
H -2.794117 1.007790 -0.383498
H -2.657127 0.453435 -2.056369
H 8.957574 -1.060918 -0.209538
H 8.714973 -0.743484 1.520869
H -4.138280 -1.056695 0.224192
H -3.919591 -1.692589 -1.405146
H 10.172370 1.150502 -0.443566
H 9.930315 1.466309 1.285836
H 11.306062 -0.601170 1.860350
H 12.251147 0.545750 0.867119
H 11.548233 -0.918030 0.119834
H -7.422427 -0.333918 -1.519734
H -6.508060 -1.834901 -1.090923
H -9.456488 0.973851 2.054701
H -7.738129 1.022250 2.641902
H -8.649292 -0.527962 2.684325


