%chk=000166523.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000166523

0 1
 O  -0.4409000      0.2070000     -0.7153000    
 O  -0.2497000      -1.457600      0.9693000    
 C    1.773300     -0.3554000      0.1530000    
 C   0.8538000      0.7364000     -0.4256000    
 C    1.055000      -1.014400       1.345700    
 C    3.099100      0.2621000      0.6129000    
 C   -1.026600     -0.3752000      0.4514000    
 C   -2.387600     -0.9263000      6.1500002E-02
 C    2.056400      -1.416500     -0.9280000    
 C   -3.354700      0.1651000     -0.4456000    
 C    3.803700      0.9653000     -0.5394000    
 C   -2.230000      -2.002700      -1.020400    
 C   -3.587100       1.287600      0.5687000    
 C    5.130000       1.556200     -8.9100003E-02
 C   -4.494700       2.368500      7.9999998E-04
 H   0.7421000       1.579500      0.2675000    
 H    1.231200       1.135000      -1.371700    
 H    1.612600      -1.886500       1.704800    
 H   0.9599000     -0.3203000       2.190000    
 H    3.752500     -0.5155000       1.029200    
 H    2.917500      0.9822000       1.421400    
 H   -1.123700      0.3796000       1.239600    
 H   -2.835100      -1.410000      0.9398000    
 H    1.159900      -2.004500      -1.156100    
 H    2.378400     -0.9757000      -1.876500    
 H    2.827500      -2.121900     -0.5983000    
 H   -4.319500     -0.2978000     -0.6900000    
 H   -2.972800      0.5951000      -1.380500    
 H    3.202900       1.789000     -0.9360000    
 H    4.017400      0.2799000      -1.364300    
 H   -3.205300      -2.433900      -1.272600    
 H   -1.592800      -2.825800     -0.6810000    
 H   -1.801300      -1.598000      -1.943300    
 H   -2.645300       1.770000      0.8458000    
 H   -4.030100      0.8780000       1.483400    
 H    4.982700       2.289900      0.7100000    
 H    5.802900      0.7757000      0.2805000    
 H    5.624500       2.061200     -0.9251000    
 H   -4.053900       2.822500     -0.8925000    
 H   -5.472500       1.956900     -0.2691000    
 H   -4.652000       3.159100      0.7412000    


%chk=000166523-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000166523

0 1
O -0.432366 0.175699 -0.863418
O -0.246860 -1.423244 0.935391
C 1.847320 -0.359589 0.038585
C 0.911472 0.717307 -0.579897
C 1.100462 -0.931404 1.278494
C 3.165757 0.299146 0.540749
C -1.048693 -0.340912 0.358997
C -2.443740 -0.890552 0.028028
C 2.108420 -1.496986 -0.976913
C -3.401132 0.237553 -0.442648
C 4.074978 0.925157 -0.543822
C -2.360409 -2.030584 -1.013398
C -3.737852 1.307064 0.623530
C 5.352047 1.545402 0.064767
C -4.809911 2.305789 0.134955
H 0.820593 1.581734 0.118760
H 1.283044 1.076943 -1.552791
H 1.631272 -1.802879 1.697952
H 1.015801 -0.145029 2.064111
H 3.750842 -0.470487 1.088421
H 2.915771 1.084979 1.286638
H -1.082164 0.490766 1.105924
H -2.830859 -1.308232 0.980681
H 1.164765 -2.017480 -1.211648
H 2.526215 -1.108681 -1.923032
H 2.822243 -2.235355 -0.564465
H -4.347630 -0.238113 -0.772320
H -2.963426 0.725791 -1.335421
H 3.521374 1.708183 -1.099149
H 4.359495 0.154223 -1.284998
H -3.360860 -2.471253 -1.177812
H -1.678998 -2.827011 -0.669365
H -1.985384 -1.646058 -1.978011
H -2.823748 1.868335 0.902363
H -4.092535 0.805290 1.547597
H 5.099619 2.338218 0.794259
H 5.950019 0.780552 0.595462
H 5.993698 1.995185 -0.714794
H -4.472850 2.830351 -0.778931
H -5.754669 1.783808 -0.108753
H -5.033422 3.070176 0.902024


