%chk=000176827.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000176827

0 1
 O  -0.2898000       1.871100     -0.3992000    
 O   -3.435600     -0.9901000      0.8872000    
 O   -2.358900       2.119600       1.476900    
 O   0.6320000      -2.689200       1.079100    
 O    3.419900      -1.417200      2.8899999E-02
 C   -1.216700     -0.8209000     -0.2065000    
 C   0.2943000     -0.4956000      0.1953000    
 C   -2.216500     -0.2468000      0.8645000    
 C   0.4205000       1.031100      0.5262000    
 C   -1.612400       1.467500     -0.7620000    
 C   -1.553500      0.1006000      -1.367300    
 C   -2.539800       1.196000      0.4189000    
 C    1.284500     -0.8199000     -0.9752000    
 C   0.7150000      -1.330100       1.435500    
 C   -1.460500      -2.313100     -0.4832000    
 C    2.743500     -0.4057000     -0.7147000    
 C    1.833800       1.548100      0.5421000    
 C    2.888700      0.9076000      1.1000000E-02
 C   -1.823100     -0.1950000      -2.643800    
 C    4.274500       1.482300      8.6199999E-02
 H   -1.823800     -0.2785000       1.882800    
 H   1.6400000E-02   1.217800       1.528300    
 H   -2.025900       2.230200      -1.428600    
 H   -3.587500       1.268900      9.9500000E-02
 H   0.9669000     -0.2767000      -1.873700    
 H    1.261000      -1.881900      -1.239600    
 H   3.9400000E-02  -1.166600       2.278900    
 H    1.715200      -1.104600       1.811400    
 H  -0.6969000      -2.763400      -1.122700    
 H   -1.554600      -2.895500      0.4385000    
 H   -2.411500      -2.463300      -1.010600    
 H    3.251300     -0.3409000      -1.684300    
 H    1.984000       2.508500       1.030300    
 H   -1.785200      -1.212500      -3.014500    
 H   -2.080000      0.5853000      -3.352200    
 H   -3.836000     -0.9478000      2.2000000E-03
 H   -2.479800       3.011500       1.108900    
 H    1.471200      -2.940200      0.6576000    
 H    4.290300       2.455300      0.5889000    
 H    4.680400       1.624600     -0.9207000    
 H    4.942900      0.8151000      0.6389000    
 H    3.684100      -1.076300      0.8990000    


%chk=000176827-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000176827

0 1
O -0.333077 1.951025 -0.415134
O -3.527367 -0.988748 0.969700
O -2.340701 2.267102 1.422697
O 1.134787 -2.648702 1.189401
O 3.298904 -1.560406 0.036643
C -1.282749 -0.812558 -0.246870
C 0.227907 -0.490774 0.191164
C -2.292624 -0.211920 0.836648
C 0.346823 1.016789 0.563658
C -1.678128 1.479888 -0.862351
C -1.599629 0.089284 -1.444751
C -2.582505 1.266743 0.385756
C 1.209727 -0.783168 -0.975262
C 0.616360 -1.319048 1.474162
C -1.492827 -2.315077 -0.501134
C 2.671451 -0.403233 -0.692077
C 1.767676 1.525129 0.631537
C 2.841235 0.895123 0.084893
C -1.859974 -0.252271 -2.728566
C 4.249171 1.449494 0.189105
H -1.882955 -0.217383 1.858167
H -0.142087 1.174470 1.550124
H -2.020828 2.267527 -1.550705
H -3.650062 1.340763 0.102945
H 0.885449 -0.206084 -1.858872
H 1.181782 -1.851490 -1.248873
H -0.273038 -1.480391 2.105583
H 1.354068 -0.736531 2.067365
H -0.806516 -2.688701 -1.280527
H -1.308388 -2.907109 0.407862
H -2.523456 -2.519556 -0.841565
H 3.210744 -0.315591 -1.659503
H 1.907721 2.488612 1.139566
H -1.831085 -1.294773 -3.065349
H -2.110410 0.504191 -3.482098
H -3.952817 -1.077786 0.078236
H -1.556334 2.807137 1.129051
H 2.054971 -2.517532 0.807794
H 4.260958 2.431606 0.690911
H 4.703580 1.570439 -0.813769
H 4.921006 0.782830 0.768619
H 4.225038 -1.340021 0.304017


