%chk=000178778.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000178778

0 1
 O    3.131600      -2.239500      9.6699998E-02
 O    4.244900     -0.3444000       1.085300    
 O   0.6210000       2.615500     -4.9600001E-02
 O   -2.315100       1.469200      0.9337000    
 C  -0.7831000      0.4391000      -1.247000    
 C   0.5598000      0.2796000     -0.6122000    
 C   -1.878100     -0.3687000     -0.5410000    
 C  -0.7402000      0.2009000      -2.776000    
 C    1.209300       1.385200     -3.5399999E-02
 C    1.158600     -0.9825000     -0.6008000    
 C    2.398900      -1.097400     -7.3000002E-03
 C    3.034500     -1.5300000E-02  0.5573000    
 C    2.464900       1.241400      0.5596000    
 C   -2.569400      0.2023000      0.5015000    
 C   -2.123000      -1.646500     -0.9886000    
 C    4.299500      -1.755200      0.7904000    
 C   -3.562700     -0.5466000       1.132800    
 C   -3.116100      -2.395200     -0.3570000    
 C   -3.835900      -1.845400      0.7036000    
 C   0.8994000       3.452300      -1.169600    
 C   -3.098400       1.951200       2.023700    
 H   -1.108000       1.484700      -1.180900    
 H   -1.734800      0.3209000      -3.220300    
 H  -0.3638000     -0.7910000      -3.047000    
 H  -7.2800003E-02  0.9269000      -3.254600    
 H   0.6942000      -1.854100      -1.046100    
 H    2.974700       2.087300       1.007700    
 H   -1.579700      -2.109100      -1.804000    
 H    4.402200      -2.306800       1.732000    
 H    5.182000      -1.950100      0.1703000    
 H   -4.161700     -0.1867000       1.962100    
 H   -3.328000      -3.407200     -0.6897000    
 H   -4.608500      -2.429700       1.194900    
 H    1.943700       3.779100      -1.143400    
 H   0.2564000       4.334400      -1.105400    
 H   0.6951000       2.939900      -2.114000    
 H   -2.926500       1.366900       2.934100    
 H   -4.160000       2.014500       1.761600    
 H   -2.762300       2.972000       2.234100    


%chk=000178778-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000178778

0 1
O 2.773926 -2.030861 0.934367
O 4.209210 -0.097393 0.884551
O 0.682682 2.629220 -1.366634
O -2.076788 1.067317 1.134109
C -1.055651 0.451812 -1.369465
C 0.344407 0.338249 -0.744179
C -2.069627 -0.473937 -0.695576
C -0.957171 0.258554 -2.906913
C 1.218291 1.466826 -0.770630
C 0.809668 -0.880497 -0.182058
C 2.107070 -0.923263 0.332685
C 2.947067 0.200026 0.305391
C 2.538891 1.419734 -0.239542
C -2.574804 -0.133098 0.597731
C -2.542667 -1.666804 -1.285179
C 4.107831 -1.515598 1.331797
C -3.510949 -0.958607 1.263642
C -3.479507 -2.504973 -0.632566
C -3.960274 -2.147742 0.643240
C 1.507737 3.835407 -1.362981
C -2.542387 1.468264 2.461292
H -1.386243 1.492008 -1.192065
H -1.949458 0.358093 -3.384376
H -0.536933 -0.729039 -3.171860
H -0.291352 1.030831 -3.328390
H 0.154530 -1.754520 -0.143092
H 3.212133 2.278802 -0.249971
H -2.177006 -1.945804 -2.278769
H 4.196317 -1.548259 2.432833
H 4.889961 -2.105336 0.822958
H -3.893713 -0.688835 2.252541
H -3.825793 -3.423414 -1.118249
H -4.685056 -2.785915 1.161329
H 1.762204 4.148402 -0.331126
H 0.890039 4.609357 -1.842550
H 2.439446 3.690821 -1.945015
H -2.274510 0.714164 3.226907
H -3.637712 1.634628 2.473227
H -2.021208 2.413279 2.674088


