%chk=000156186.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000156186

0 1
 O    2.808600      0.8877000     -0.3679000    
 O  -0.4346000     -0.8653000     -5.9400000E-02
 O    3.791800      -3.809100      0.2872000    
 O    7.291300     -0.6146000     -0.1456000    
 O  -0.2526000       4.190700       2.187000    
 O   -1.570800       5.318000      1.4900000E-02
 C   0.9215000     -0.5715000      0.2597000    
 C    1.436200      0.5610000     -0.6399000    
 C    1.762600      -1.823500      2.5900001E-02
 C    3.223300      -1.491700     -2.0199999E-02
 C    3.657100     -0.1772000     -0.2236000    
 C   0.6323000       1.835600     -0.4611000    
 C  -0.9417000      -1.916800      0.7492000    
 C    4.175000      -2.511500      0.1136000    
 C   -2.382900      -2.196200      0.3467000    
 C    5.022900      0.1174000     -0.2534000    
 C   0.5555000       2.437500      0.7929000    
 C  -2.7200000E-02   2.398500      -1.551500    
 C    5.538100      -2.217500      7.1500003E-02
 C   -3.263900     -0.9599000      0.5183000    
 C    5.961800     -0.9029000     -0.1081000    
 C  -0.1843000       3.608400      0.9573000    
 C  -0.7669000       3.569500      -1.387200    
 C  -0.8456000       4.174400     -0.1327000    
 C   -4.700600      -1.245400      0.1633000    
 C   -5.130400      -1.058300      -1.142300    
 C   -5.570700      -1.690400       1.147500    
 C   -6.460100      -1.322200      -1.470900    
 C   -6.900400      -1.954400      0.8189000    
 C   -7.345100      -1.770200     -0.4902000    
 H   0.9986000     -0.2831000       1.316900    
 H    1.367200      0.2516000      -1.692700    
 H    1.474900      -2.319800     -0.9098000    
 H    1.605100      -2.533300      0.8462000    
 H  -0.8883000      -1.638000       1.808000    
 H  -0.3978000      -2.852300      0.5946000    
 H   -2.409600      -2.512600     -0.7039000    
 H   -2.771200      -3.028600      0.9459000    
 H    5.349300       1.144800     -0.3966000    
 H    1.078100       2.007400       1.643400    
 H   2.4100000E-02   1.938400      -2.534400    
 H   -3.208500     -0.5989000       1.553600    
 H   -2.898000     -0.1323000     -0.1029000    
 H    6.276500      -3.008300      0.1790000    
 H   -1.277400       3.999600      -2.244700    
 H    4.583500      -4.369300      0.3600000    
 H   -4.448500     -0.7114000      -1.913500    
 H   -5.233700      -1.838700       2.169600    
 H    7.403100      0.3425000     -0.2776000    
 H   0.2638000       3.660900       2.818300    
 H   -6.806300      -1.179300      -2.490300    
 H   -7.589500      -2.303900       1.582300    
 H   -1.956700       5.561400     -0.8442000    
 H   -8.380400      -1.975900     -0.7461000    


%chk=000156186-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000156186

0 1
O 2.754172 0.791269 -0.271421
O -0.309403 -1.324681 -0.207531
O 4.275993 -3.805066 0.169790
O 7.501172 -0.176297 0.054540
O -0.178993 4.381068 1.798520
O -2.327970 4.611148 0.167245
C 1.043196 -0.940471 0.197303
C 1.402666 0.302831 -0.663178
C 2.056020 -2.077476 -0.051558
C 3.481964 -1.558552 -0.052548
C 3.768804 -0.176357 -0.154592
C 0.443794 1.461540 -0.490547
C -0.962595 -2.291951 0.692655
C 4.589525 -2.434640 0.072790
C -2.458044 -2.286191 0.357330
C 5.089733 0.328251 -0.119257
C 0.613410 2.387250 0.567393
C -0.663903 1.601082 -1.353755
C 5.921442 -1.974194 0.108989
C -3.142416 -0.936473 0.710748
C 6.155791 -0.584019 0.015011
C -0.310672 3.432633 0.772312
C -1.599830 2.638396 -1.147000
C -1.437447 3.558310 -0.087701
C -4.588279 -0.878391 0.243324
C -4.898561 -0.516700 -1.094509
C -5.657649 -1.215961 1.112568
C -6.235289 -0.494593 -1.551452
C -6.997489 -1.195201 0.661491
C -7.291607 -0.834920 -0.673774
H 1.049810 -0.635510 1.268399
H 1.439108 -0.014010 -1.725553
H 1.811482 -2.547476 -1.025625
H 1.954745 -2.872151 0.709390
H -0.792167 -1.988144 1.750360
H -0.528998 -3.303188 0.543237
H -2.577646 -2.491827 -0.723470
H -2.952926 -3.115730 0.900138
H 5.249086 1.408005 -0.209110
H 1.494914 2.300588 1.214892
H -0.810861 0.889547 -2.172207
H -3.091040 -0.788702 1.807609
H -2.552311 -0.126278 0.244865
H 6.774075 -2.654629 0.204006
H -2.464690 2.737547 -1.816290
H 5.098897 -4.343575 0.274862
H -4.082259 -0.247871 -1.777500
H -5.437857 -1.490443 2.152271
H 7.570610 0.807092 -0.024124
H 0.643953 4.203435 2.319084
H -6.454984 -0.210356 -2.587298
H -7.809973 -1.454954 1.350034
H -3.080421 4.583870 -0.475308
H -8.329586 -0.815887 -1.024851


