%chk=000083636.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000083636

0 1
 O    1.628500      0.2385000      0.4397000    
 O   -1.575900      0.4679000     -0.4990000    
 O    1.064500     -0.3674000     -0.7625000    
 O   -1.043300     -0.5615000      0.3881000    
 C    2.669900       1.084800     -2.3399999E-02
 C   -2.598900       1.109900      0.2471000    
 C  -3.0000001E-04  -1.237300     -0.3335000    
 C    3.744300      0.2349000     -0.7301000    
 C   -3.704900      8.9900002E-02  0.5823000    
 C   0.5904000      -2.323700      0.5917000    
 C    2.038200       2.118300     -0.9573000    
 C    3.278800       1.790900       1.192200    
 C   -1.950100       1.698000       1.501000    
 C   -3.173200       2.238500     -0.6152000    
 C  -0.5821000      -1.865500      -1.605300    
 C    4.406600     -0.8127000      0.1576000    
 C   -4.385400     -0.5276000     -0.6341000    
 C  -0.4069000      -3.375800       1.060800    
 H    3.316600     -0.2846000      -1.596100    
 H    4.525900      0.8941000      -1.129100    
 H   -3.302000     -0.7293000       1.190200    
 H   -4.472600      0.5744000       1.199200    
 H    1.002100      -1.853200       1.493300    
 H    1.436000      -2.815800      9.5100001E-02
 H    2.761100       2.894900      -1.230300    
 H    1.677900       1.671500      -1.890600    
 H    1.175100       2.601100     -0.4845000    
 H    4.151600       2.392300      0.9182000    
 H    2.540400       2.454800       1.657900    
 H    3.565600       1.079700       1.974000    
 H   -2.654400       2.336900       2.045000    
 H   -1.613600      0.9230000       2.198500    
 H   -1.068300       2.296600       1.244600    
 H   -4.032100       2.719500     -0.1361000    
 H   -2.411000       3.005700     -0.7974000    
 H   -3.470600       1.881400      -1.606900    
 H  -0.8473000      -1.094500      -2.338200    
 H   0.1519000      -2.514800      -2.094900    
 H   -1.491300      -2.438400      -1.399200    
 H    5.012500     -0.3524000      0.9433000    
 H    3.668000      -1.469900      0.6252000    
 H    5.076300      -1.437200     -0.4432000    
 H   -5.078300      -1.312300     -0.3121000    
 H   -3.659600     -0.9821000      -1.314300    
 H   -4.969900      0.2117000      -1.189200    
 H   7.5700000E-02  -4.057300       1.769000    
 H  -0.7769000      -3.978000      0.2260000    
 H   -1.262800      -2.918600       1.566600    


%chk=000083636-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000083636

0 1
O 2.218780 -0.427960 0.639829
O -1.351727 0.472233 -0.594127
O 1.320140 -0.880025 -0.534396
O -0.811713 -0.414869 0.564160
C 2.801573 0.908265 0.277918
C -2.552170 1.195363 -0.058604
C 0.065290 -1.442832 -0.004233
C 3.563416 0.818781 -1.072503
C -3.699402 0.194257 0.247033
C 0.315939 -2.380165 1.204923
C 1.688423 1.970540 0.217758
C 3.740086 1.133944 1.484615
C -2.172491 2.003075 1.200107
C -2.864862 2.132896 -1.246323
C -0.514345 -2.127978 -1.253924
C 4.624355 -0.297816 -1.153535
C -4.243053 -0.578837 -0.971886
C -0.906779 -3.221241 1.623080
H 2.811255 0.663829 -1.868119
H 4.031376 1.806255 -1.260382
H -3.316010 -0.520494 0.999755
H -4.521761 0.757000 0.732901
H 0.663185 -1.756302 2.046144
H 1.162770 -3.032306 0.921697
H 2.109047 2.952221 -0.070632
H 0.919970 1.677045 -0.516833
H 1.196674 2.069403 1.201345
H 4.281147 2.088146 1.350781
H 3.158861 1.190468 2.421220
H 4.477540 0.320032 1.580222
H -3.017391 2.647951 1.504065
H -1.922158 1.330590 2.037225
H -1.296566 2.641826 0.994273
H -3.805316 2.677577 -1.046106
H -2.052949 2.867626 -1.382367
H -2.983081 1.566077 -2.184835
H -0.497512 -1.437198 -2.110785
H 0.082064 -3.022746 -1.496654
H -1.557764 -2.424473 -1.062705
H 5.469171 -0.121960 -0.462804
H 4.172104 -1.272823 -0.902347
H 5.038344 -0.363044 -2.176466
H -4.944400 -1.369712 -0.648739
H -3.418685 -1.057739 -1.529130
H -4.786197 0.081700 -1.671787
H -0.663060 -3.823469 2.517089
H -1.220121 -3.920274 0.826903
H -1.765797 -2.573539 1.871280


