%chk=000099479.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000099479

0 1
 O   -1.577100       1.022100      0.1437000    
 O    3.599400     -0.8890000     -9.8899998E-02
 C   -2.691700      0.1325000     -5.6699999E-02
 C   -2.465000      -1.227200      0.6237000    
 C   -1.192100      -1.894300      0.1218000    
 C  -6.8700001E-02 -0.9013000      8.2900003E-02
 C  -0.3224000      0.4753000      8.7700002E-02
 C   -3.899300      0.8187000      0.5987000    
 C   -2.962000      4.6000001E-03  -1.563500    
 C    1.256300      -1.351700      9.3000000E-03
 C   0.7381000       1.385300      5.5000000E-02
 C    2.053100      0.9270000     -5.9000002E-03
 C    2.312300     -0.4411000     -3.2600001E-02
 C    1.565200      -2.817000     -1.9099999E-02
 C   0.4645000       2.856900      9.4099998E-02
 C    3.189400       1.899200     -4.0300000E-02
 H   -3.321500      -1.895100      0.4731000    
 H   -2.364100      -1.073000       1.707300    
 H   -1.349400      -2.303900     -0.8826000    
 H  -0.9623000      -2.727900      0.7948000    
 H   -3.721500      0.9823000       1.668100    
 H   -4.071500       1.809200      0.1618000    
 H   -4.812800      0.2256000      0.4854000    
 H   -3.162500      0.9882000      -2.004400    
 H   -2.097000     -0.3940000      -2.103300    
 H   -3.821200     -0.6445000      -1.762000    
 H    2.587100      -3.032600     -0.3465000    
 H    1.437400      -3.247200      0.9797000    
 H   0.9122000      -3.342300     -0.7242000    
 H   0.7818000       3.276800       1.054500    
 H   0.9830000       3.370500     -0.7231000    
 H  -0.5935000       3.107500     -2.9700000E-02
 H    4.007400       1.570900      0.6113000    
 H    3.565300       2.001400      -1.063500    
 H    2.932400       2.895800      0.3273000    
 H    4.187700     -0.1960000     -0.4376000    


%chk=000099479-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000099479

0 1
O -1.615833 1.026438 0.266274
O 3.631349 -0.950138 -0.230536
C -2.773231 0.116885 -0.027721
C -2.518133 -1.230820 0.684415
C -1.221544 -1.901774 0.185644
C -0.066659 -0.913243 0.088687
C -0.310717 0.485149 0.134681
C -3.978532 0.855811 0.570434
C -2.902716 -0.029554 -1.559572
C 1.267913 -1.384316 -0.044521
C 0.745673 1.438080 0.083023
C 2.079684 0.965867 -0.032104
C 2.313791 -0.435463 -0.102956
C 1.575399 -2.868762 -0.116050
C 0.423513 2.922204 0.151612
C 3.269400 1.912884 -0.087687
H -3.383771 -1.902192 0.529893
H -2.441832 -1.029716 1.770241
H -1.395403 -2.376826 -0.802447
H -0.949978 -2.729697 0.867813
H -3.861622 0.966902 1.662484
H -4.068281 1.863434 0.128458
H -4.911839 0.299652 0.368381
H -3.117818 0.952611 -2.015164
H -1.971048 -0.415529 -2.007290
H -3.725753 -0.722548 -1.814823
H 2.641980 -3.030696 -0.330284
H 1.339158 -3.378449 0.839011
H 0.979736 -3.368268 -0.903446
H 0.859149 3.392655 1.054122
H 0.817454 3.467121 -0.727192
H -0.665500 3.069895 0.187054
H 3.984279 1.727011 0.740635
H 3.827582 1.823331 -1.043097
H 2.956349 2.963912 -0.003266
H 4.284802 -0.210152 -0.278403


