%chk=000178016.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000178016

0 1
 O   -3.050000       2.344000      0.6956000    
 O   -4.189100     -2.6600000E-02  0.7226000    
 C  -0.9490000     -0.1117000     -0.1797000    
 C   -2.634400       1.534400     -0.3895000    
 C   -1.165700       1.235500     -0.2603000    
 C   -3.295800      0.1159000     -0.3683000    
 C   -2.121100     -0.8129000     -0.2311000    
 C   0.3073000     -0.6963000     -5.7700001E-02
 C    1.423400      0.1546000     -1.6200000E-02
 C   0.3896000      -2.094000      1.6899999E-02
 C    1.235400       1.564200     -9.9699996E-02
 C  -7.4699998E-02   2.095100     -0.2234000    
 C   -2.072800      -2.196900     -0.1622000    
 C    2.701500     -0.4225000      0.1073000    
 C  -0.8208000      -2.835600     -3.7700001E-02
 C    1.672300      -2.651100      0.1397000    
 C    2.809600      -1.827100      0.1843000    
 C    2.373600       2.380200     -5.5500001E-02
 C    3.812600      0.4325000      0.1479000    
 C    3.648000       1.818500      6.7100003E-02
 H   -2.831800       2.046300      -1.338000    
 H   -3.820700     -8.4100001E-02  -1.309300    
 H  -0.2309000       3.168900     -0.2898000    
 H   -2.982000      -2.788200     -0.2029000    
 H  -0.7920000      -3.922400      1.6500000E-02
 H    1.799500      -3.729500      0.2018000    
 H    3.787700      -2.295000      0.2801000    
 H    2.280500       3.462300     -0.1160000    
 H   -4.000900       2.512400      0.5844000    
 H   -4.925200      0.5915000      0.5778000    
 H    4.817600      2.7100001E-02  0.2426000    
 H    4.520000       2.466200      0.1000000    


%chk=000178016-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000178016

0 1
O -3.298496 2.546076 0.358534
O -4.138673 0.048561 0.864261
C -0.995506 -0.089611 -0.243093
C -2.688794 1.575128 -0.549262
C -1.193137 1.328916 -0.332251
C -3.362948 0.124537 -0.394900
C -2.190757 -0.835417 -0.297694
C 0.279579 -0.681147 -0.101660
C 1.418182 0.177212 -0.030625
C 0.368727 -2.112248 -0.025510
C 1.239148 1.613074 -0.102552
C -0.099821 2.174080 -0.259634
C -2.113442 -2.242880 -0.219401
C 2.722609 -0.412758 0.116521
C -0.843164 -2.866658 -0.091364
C 1.694221 -2.679250 0.118850
C 2.814555 -1.861034 0.185522
C 2.402026 2.427492 -0.023047
C 3.851920 0.446902 0.190260
C 3.683798 1.848053 0.120420
H -2.885433 1.987819 -1.554046
H -4.031266 -0.089260 -1.252308
H -0.213670 3.262697 -0.315785
H -3.020297 -2.856392 -0.243142
H -0.788267 -3.960237 -0.032450
H 1.804086 -3.768523 0.177797
H 3.810067 -2.307670 0.296929
H 2.299666 3.517721 -0.073578
H -3.311719 2.120487 1.257885
H -5.008992 0.502774 0.719678
H 4.854496 0.018209 0.303365
H 4.562999 2.499045 0.179579


