%chk=000147859.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000147859

0 1
 O    5.030200     -0.7142000      6.5200001E-02
 O    1.783200      0.4569000     -0.3085000    
 O   -4.450600      0.8608000      0.2392000    
 O   -4.221700      -1.317100      3.3700000E-02
 N   -3.738700     -0.1611000      9.2799999E-02
 C    3.896500     -7.3600002E-02  0.6553000    
 C    4.799000      0.6553000     -0.2897000    
 C    2.593400     -0.6136000      0.1748000    
 C   0.4341000      0.3058000     -0.2100000    
 C  -0.3831000       1.424700     -4.8999999E-02
 C  -0.1313000     -0.9677000     -0.2715000    
 C   -2.331200     -3.5999999E-03 -1.1000000E-02
 C   -1.765800       1.270000      5.0700001E-02
 C   -1.514000      -1.122500     -0.1721000    
 H    3.920800      0.1834000       1.704400    
 H    4.456000      0.8589000      -1.295800    
 H    5.473800       1.396600      0.1182000    
 H    2.125700      -1.128800       1.023400    
 H    2.744000      -1.333900     -0.6385000    
 H   5.2400000E-02   2.419100     -3.9999999E-04
 H   0.4659000      -1.861800     -0.4237000    
 H   -2.370700       2.164400      0.1759000    
 H   -1.920000      -2.129200     -0.2298000    


%chk=000147859-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000147859

0 1
O 5.170795 -0.842590 0.130972
O 1.715168 0.605330 0.385356
O -4.613097 0.863789 -0.135034
O -4.305118 -1.369224 -0.498817
N -3.857919 -0.180573 -0.249985
C 4.043465 0.065527 0.556497
C 4.929245 0.474019 -0.577439
C 2.672420 -0.519100 0.300737
C 0.359751 0.327448 0.218071
C -0.505482 1.448800 0.338248
C -0.166423 -0.963953 -0.056137
C -2.403006 -0.004767 -0.087901
C -1.888463 1.286684 0.185190
C -1.555490 -1.126812 -0.209439
H 4.185644 0.537186 1.536469
H 4.560998 0.379967 -1.606511
H 5.699993 1.234374 -0.408664
H 2.423031 -1.279825 1.066744
H 2.633418 -0.985762 -0.702816
H -0.066803 2.427814 0.550339
H 0.487532 -1.834476 -0.153269
H -2.577551 2.130408 0.272263
H -1.994208 -2.105464 -0.421273


