%chk=000176958.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000176958

0 1
 O    1.612300       1.298500      1.4900000E-02
 O    3.396200     -0.1015000     -1.5300000E-02
 C  -0.5633000      0.4303000     -0.6441000    
 C   2.4700001E-02 -0.9958000     -0.5339000    
 C   -2.065600      0.2763000     -0.3461000    
 C   -1.122600      -1.890200     -4.6399999E-02
 C   -2.123900     -0.9329000      0.5835000    
 C    1.228800      -1.052800      0.4037000    
 C   0.1956000       1.402400      0.2557000    
 C   -2.770100       1.496700      0.2245000    
 C    2.187900      6.9100000E-02  0.1035000    
 H  -0.4375000      0.7745000      -1.679700    
 H   0.3454000      -1.332600      -1.528600    
 H   -2.568600      8.1000002E-03  -1.286100    
 H  -0.8018000      -2.669700      0.6517000    
 H   -1.586700      -2.388600     -0.9067000    
 H   -3.126400      -1.368500      0.6362000    
 H   -1.810700     -0.6677000       1.600300    
 H    1.750700      -2.007400      0.2697000    
 H   0.9407000     -0.9874000       1.459300    
 H  -9.2699997E-02   2.434600      3.1800002E-02
 H   8.6000003E-03   1.232900       1.322500    
 H   -2.379400       1.774500       1.208500    
 H   -2.660300       2.355900     -0.4451000    
 H   -3.840700       1.297500      0.3421000    


%chk=000176958-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000176958

0 1
O 1.643144 1.342658 0.051466
O 3.470006 -0.039539 -0.060523
C -0.562002 0.429203 -0.667790
C 0.030143 -1.028968 -0.564357
C -2.088151 0.284479 -0.342591
C -1.137383 -1.928196 -0.042752
C -2.139956 -0.942957 0.605150
C 1.268803 -1.075847 0.379022
C 0.172703 1.379664 0.297520
C -2.797162 1.546985 0.187646
C 2.241032 0.067406 0.110867
H -0.418408 0.831182 -1.687798
H 0.361181 -1.366498 -1.562923
H -2.587865 -0.014288 -1.288028
H -0.781041 -2.708554 0.654299
H -1.626065 -2.445500 -0.890001
H -3.157531 -1.362804 0.697862
H -1.809781 -0.653511 1.623665
H 1.818229 -2.024645 0.273243
H 0.927899 -1.005926 1.432369
H -0.098555 2.433240 0.133076
H -0.017437 1.123333 1.358461
H -2.382885 1.877843 1.158256
H -2.714982 2.390696 -0.522698
H -3.873336 1.346745 0.342458


