%chk=000072401.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072401

0 1
 O   -5.414000      0.4799000       1.328000    
 O   -2.309200      -3.120500      0.9932000    
 O  -0.8702000       2.666300      0.9010000    
 O  -3.0400001E-02  -2.677600     -0.1930000    
 O   -4.586100     -0.8701000      -1.546200    
 O   -5.458500       1.391700      -2.704700    
 O    2.416200      -2.140000     -0.4862000    
 O    1.604800       3.028000      0.5996000    
 O    4.930900      -1.766200     -0.8117000    
 C   -4.246700      6.6100001E-02  0.6224000    
 C   -3.920600      -1.363400       1.035000    
 C   -3.090500       1.012800      0.9522000    
 C   -2.655000      -1.890300      0.3559000    
 C   -1.720800      0.4613000      0.6357000    
 C   -1.505700     -0.9055000      0.3843000    
 C  -0.6296000       1.346700      0.6333000    
 C  -0.2054000      -1.349100      8.4100001E-02
 C   -4.641800      0.1261000     -0.8268000    
 C   0.6627000      0.8897000      0.3533000    
 C   0.8741000     -0.4577000      7.3899999E-02
 C    2.230400     -0.9556000     -0.2354000    
 C    1.791300       1.843100      0.3520000    
 C   -5.106300       1.472600      -1.339800    
 C    3.360400     -4.1000000E-03 -0.2370000    
 C    3.148400       1.346600      4.6999998E-02
 C    4.651300     -0.4628000     -0.5253000    
 C    4.227200       2.238800      4.2700000E-02
 C    5.723600      0.4298000     -0.5291000    
 C    5.512000       1.777700     -0.2455000    
 C    5.257600      -2.614200      0.2869000    
 H   -4.757900      -2.045500      0.8316000    
 H   -3.805100      -1.407100       2.128200    
 H   -3.110400       1.217400       2.032600    
 H   -3.258000       1.980100      0.4770000    
 H   -2.854800      -2.141000     -0.6897000    
 H   -6.103900     -0.1943000       1.203400    
 H   -1.917500      -2.912100       1.858800    
 H   -4.303300       2.206500      -1.270900    
 H   -5.975300       1.820700     -0.7760000    
 H   -1.618600       2.968700      0.3617000    
 H  -0.8763000      -3.135000     -0.3122000    
 H    4.088400       3.294300      0.2602000    
 H    6.729000      8.2800001E-02 -0.7533000    
 H   -6.233600      0.8084000      -2.772800    
 H    6.348500       2.470600     -0.2492000    
 H    6.275500      -2.402400      0.6287000    
 H    5.213000      -3.651800     -5.5300001E-02
 H    4.556000      -2.488000       1.117900    


%chk=000072401-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000072401

0 1
O -5.615653 0.597992 1.047914
O -2.440481 -3.230111 1.114068
O -0.939635 2.689697 1.308972
O -0.048417 -2.728590 0.121155
O -4.682982 -0.835218 -1.740795
O -4.788880 1.514107 -3.062538
O 2.555596 -2.187622 0.750710
O 1.681803 3.022752 1.240176
O 4.717875 -1.750480 -1.116002
C -4.335365 0.061483 0.521224
C -4.111190 -1.394047 0.962007
C -3.255587 0.969776 1.134785
C -2.754209 -1.917856 0.465428
C -1.841807 0.437768 0.928249
C -1.607510 -0.927275 0.649524
C -0.738317 1.338281 1.012354
C -0.271871 -1.402835 0.452243
C -4.448945 0.178229 -1.022918
C 0.594751 0.888145 0.780593
C 0.827920 -0.503163 0.520666
C 2.239043 -1.011349 0.402646
C 1.753613 1.840959 0.783903
C -4.372374 1.552558 -1.679682
C 3.261940 -0.031507 -0.071667
C 3.034605 1.355487 0.165898
C 4.479994 -0.429631 -0.705246
C 4.014634 2.319267 -0.169354
C 5.438472 0.548198 -1.064762
C 5.214562 1.914599 -0.786702
C 5.415355 -2.636906 -0.157899
H -4.906597 -2.049794 0.566131
H -4.148260 -1.417317 2.069235
H -3.493839 1.050949 2.214521
H -3.380405 1.987568 0.714009
H -2.834135 -2.204120 -0.598376
H -6.355033 -0.016653 0.799132
H -2.405952 -3.111941 2.098730
H -3.320316 1.911484 -1.605687
H -5.013490 2.264573 -1.125149
H -1.896290 2.881261 1.481694
H -0.851939 -3.277799 0.394303
H 3.807073 3.369190 0.056868
H 6.344959 0.214828 -1.580723
H -4.837331 0.556068 -3.338033
H 5.969245 2.657960 -1.064623
H 6.382676 -2.191485 0.148836
H 5.590579 -3.572354 -0.710163
H 4.767916 -2.822729 0.714846


