%chk=000088751.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088751

0 1
 O    3.844600       1.544800      -1.483500    
 O   -3.847900      -1.911900     -0.2262000    
 O   -1.721500      -2.331400     -0.9109000    
 N   2.2100000E-02 -0.6530000      0.4549000    
 C   -1.047600      0.2623000      0.3374000    
 C    1.416000     -0.5086000      0.3309000    
 C   -2.303500     -0.1564000     -0.1018000    
 C  -0.8350000       1.600500      0.6684000    
 C    1.947200      0.4590000     -0.5248000    
 C    2.274000      -1.332400       1.063000    
 C   -3.346800      0.7630000     -0.2100000    
 C   -1.878300       2.520000      0.5603000    
 C   -3.134200       2.101300      0.1210000    
 C    3.329200      0.6020000     -0.6479000    
 C    3.655900      -1.189400      0.9399000    
 C    4.183500     -0.2221000      8.4500000E-02
 C   -2.557800      -1.547600     -0.4553000    
 H  -0.2677000      -1.591600      0.7141000    
 H   0.1245000       1.952700       1.036800    
 H    1.301400       1.097000      -1.122900    
 H    1.875500      -2.089500       1.733800    
 H   -4.333200      0.4721000     -0.5616000    
 H   -1.714400       3.561100      0.8228000    
 H   -3.945700       2.818000      3.5200000E-02
 H    4.321200      -1.831100       1.510300    
 H    5.262000     -0.1211000     -2.4999999E-03
 H    4.815600       1.503700      -1.444300    
 H   -4.010900      -2.849100     -0.4662000    


%chk=000088751-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000088751

0 1
O 3.986859 1.820639 -1.148039
O -3.998972 -1.926377 -0.393357
O -1.817934 -2.581651 -0.003027
N 0.026812 -0.667001 0.260623
C -1.008012 0.262524 0.202261
C 1.429390 -0.462717 0.239510
C -2.367963 -0.197850 0.000661
C -0.800806 1.666186 0.383642
C 2.047293 0.618127 -0.439801
C 2.242418 -1.449052 0.870322
C -3.434691 0.744759 -0.058166
C -1.874706 2.566647 0.330112
C -3.202270 2.118344 0.092516
C 3.454237 0.718307 -0.453394
C 3.644808 -1.335764 0.830738
C 4.271175 -0.247839 0.181230
C -2.657369 -1.630380 -0.123130
H -0.303191 -1.650024 0.280252
H 0.201825 2.037265 0.605739
H 1.469622 1.353422 -1.003776
H 1.766788 -2.286312 1.392142
H -4.446286 0.362262 -0.218628
H -1.679276 3.633861 0.485864
H -4.030413 2.831628 0.044504
H 4.261280 -2.096603 1.321487
H 5.364477 -0.158948 0.166683
H 4.975637 1.793656 -1.141447
H -4.092531 -2.914808 -0.450120


