%chk=000166175.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000166175

0 1
 O    2.821300      0.7166000     -3.9799999E-02
 O    2.895000      -1.581000      0.1895000    
 C    1.454100      0.6381000     -0.4498000    
 C   0.6230000      3.8500000E-02  0.7062000    
 C  -0.8659000     -4.3099999E-02  0.4577000    
 C   0.9755000       2.069300     -0.7247000    
 C    1.374200     -0.1888000      -1.735800    
 C   -1.671700       1.023700      0.8184000    
 C   -1.393400      -1.182700     -0.1256000    
 C   -3.593300     -0.1921000      2.2000000E-03
 C   -3.045600      0.9486000      0.5889000    
 C   -2.767200      -1.257700     -0.3551000    
 C    3.417200     -0.4760000      0.2493000    
 C   -5.062000     -0.2727000     -0.2426000    
 C    4.838800     -0.2408000      0.6611000    
 H   0.8007000      0.6308000       1.616400    
 H   0.9434000     -0.9643000       1.001900    
 H    1.657400       2.564600      -1.426900    
 H   0.9959000       2.674900      0.1887000    
 H  -2.7200000E-02   2.110600      -1.159700    
 H    1.452200      -1.266900      -1.572700    
 H    2.178300      8.9000002E-02  -2.427400    
 H   0.4227000     -2.5400000E-02  -2.254700    
 H   -1.258300       1.914200       1.282700    
 H  -0.7601000      -2.019700     -0.4044000    
 H   -3.679100       1.784100      0.8748000    
 H   -3.182300      -2.152800     -0.8107000    
 H   -5.282900     -0.8873000      -1.122000    
 H   -5.564100     -0.7101000      0.6261000    
 H   -5.486400      0.7193000     -0.4308000    
 H    4.866400      0.3865000       1.555700    
 H    5.388600      0.2304000     -0.1574000    
 H    5.312400      -1.199100      0.8929000    


%chk=000166175-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000166175

0 1
O 2.890153 0.641946 -0.000857
O 3.182407 -1.680248 0.220767
C 1.434540 0.571145 -0.469743
C 0.595845 -0.029632 0.705608
C -0.905327 -0.072319 0.453275
C 1.112017 2.051839 -0.721405
C 1.351933 -0.251498 -1.768705
C -1.748797 1.006333 0.825765
C -1.510600 -1.203550 -0.153640
C -3.743394 -0.165915 -0.024787
C -3.140193 0.962109 0.588350
C -2.901600 -1.247364 -0.391998
C 3.622452 -0.507800 0.290031
C -5.245052 -0.229582 -0.247596
C 5.030982 -0.124129 0.703100
H 0.810976 0.583381 1.601648
H 0.972408 -1.049163 0.897075
H 1.780224 2.461440 -1.498447
H 1.249043 2.643403 0.200672
H 0.067827 2.159371 -1.059518
H 1.596265 -1.310428 -1.591304
H 2.050673 0.156266 -2.520921
H 0.328625 -0.185074 -2.177741
H -1.311688 1.887731 1.311580
H -0.885207 -2.059281 -0.436530
H -3.767755 1.810764 0.888201
H -3.341832 -2.135327 -0.862691
H -5.498001 -0.843369 -1.130230
H -5.758610 -0.681172 0.623740
H -5.676079 0.776362 -0.396267
H 5.002158 0.526437 1.594475
H 5.522046 0.447855 -0.103154
H 5.611161 -1.031831 0.923647


