%chk=000088006.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088006

0 1
 O   0.9362000      -1.074100      -1.749200    
 O  -0.6569000      -2.051800       1.036500    
 N    1.707800      0.2838000     -9.8999999E-03
 C    3.125400      0.1200000     -0.2989000    
 C    1.389200       1.140800       1.130100    
 C   0.7101000     -0.3419000     -0.7778000    
 C  -0.6860000     -0.1417000     -0.4147000    
 C    3.710500      -1.062400      0.4454000    
 C    1.223500       2.586200      0.7085000    
 C   -1.323700      -1.001700      0.4795000    
 C   -1.386600      0.9264000     -0.9750000    
 C   -2.662000     -0.7932000      0.8135000    
 C   -2.724800       1.134700     -0.6411000    
 C   -3.362500      0.2748000      0.2531000    
 H    3.242400     -4.8999999E-02  -1.375300    
 H    3.661600       1.042500     -5.2400000E-02
 H   0.4767000      0.8008000       1.626400    
 H    2.190600       1.055800       1.873100    
 H    3.625400     -0.9316000       1.529000    
 H    3.192200      -1.990400      0.1816000    
 H    4.770100      -1.181600      0.1991000    
 H    2.147600       2.974500      0.2677000    
 H   0.4311000       2.721700     -2.9200001E-02
 H   0.9822000       3.206300       1.577800    
 H  -0.9057000       1.596800      -1.682700    
 H   -3.171700      -1.455200       1.508400    
 H   -3.271100       1.964700      -1.079400    
 H   -4.404700      0.4368000      0.5124000    
 H   -1.259600      -2.532400       1.629400    


%chk=000088006-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000088006

0 1
O 1.014638 -0.705771 -1.914072
O -0.482452 -1.454899 1.512935
N 1.704528 0.326415 0.053096
C 3.121856 0.136616 -0.342343
C 1.442292 1.076042 1.301288
C 0.725320 -0.166299 -0.793543
C -0.732995 -0.010183 -0.406665
C 3.704740 -1.185973 0.199619
C 1.444465 2.606545 1.089870
C -1.333942 -0.701981 0.677117
C -1.576885 0.726398 -1.274370
C -2.729719 -0.637819 0.901905
C -2.968855 0.810156 -1.055134
C -3.545678 0.122482 0.037374
H 3.165893 0.136388 -1.444865
H 3.700572 1.002063 0.031038
H 0.481148 0.750787 1.725056
H 2.220609 0.791874 2.035150
H 3.645435 -1.232025 1.302477
H 3.145468 -2.041363 -0.214975
H 4.766055 -1.287088 -0.093870
H 2.399778 2.952680 0.654922
H 0.628154 2.904435 0.408349
H 1.299137 3.128358 2.054021
H -1.123557 1.217870 -2.141725
H -3.175818 -1.182974 1.744406
H -3.597533 1.392281 -1.736310
H -4.625713 0.169138 0.213836
H -1.009641 -1.984554 2.161316


