%chk=000027752.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000027752

0 1
 O   0.8184000      -2.798000       1.486800    
 O    1.538500      -3.508200     -0.4697000    
 O   -3.631500       3.250400      0.5189000    
 O   -1.502300       3.707000      0.2098000    
 O    5.100000       1.852700      0.3765000    
 O    5.629500     -0.2424000     -4.8700001E-02
 O   -3.806600      -2.922000     -0.2736000    
 O   -5.200700      -1.285900      0.1923000    
 N   0.2507000       1.847500     -0.3053000    
 N    1.332800      -2.621500      0.3724000    
 N   -2.454900       2.892900      0.2708000    
 N    4.815200      0.6774000      0.1082000    
 N   -4.048600      -1.710500     -6.0899999E-02
 C   0.7905000     -0.4568000     -0.7678000    
 C  -0.6566000     -0.3053000     -0.4220000    
 C    1.226000       1.013500     -0.5230000    
 C  -0.9121000       1.059900     -0.2245000    
 C    1.717700      -1.297900      3.3599999E-02
 C   -1.682100      -1.233500     -0.3875000    
 C    2.664000       1.356600     -0.4775000    
 C   -2.191100       1.515800      5.1500000E-02
 C    2.968300     -0.9493000      0.3670000    
 C    3.436200      0.3575000     -3.2099999E-02
 C   -2.974400     -0.7815000     -0.1077000    
 C   -3.226900      0.5817000      0.1124000    
 H   0.8903000     -0.6723000      -1.839000    
 H   -1.462200      -2.277100     -0.5877000    
 H    2.970300       2.363800     -0.7262000    
 H    3.627600      -1.611600      0.9194000    
 H   -4.240300      0.9147000      0.3272000    


%chk=000027752-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000027752

0 1
O 2.251123 -3.577850 0.818009
O 0.434314 -3.214845 -0.523958
O -3.626784 3.355786 0.674988
O -1.879974 3.815156 -0.729386
O 5.307127 1.939554 0.151666
O 5.733639 -0.255812 0.631186
O -3.881594 -2.953650 -0.006941
O -5.344381 -1.217349 0.240728
N 0.237720 1.889359 -0.277564
N 1.486392 -2.815431 0.119696
N -2.605413 3.013048 -0.037258
N 4.947531 0.712432 0.299683
N -4.161037 -1.698668 0.072044
C 0.814291 -0.437383 -0.609898
C -0.684085 -0.310657 -0.319501
C 1.250760 1.024930 -0.416432
C -0.941133 1.104891 -0.236577
C 1.817683 -1.383790 0.008067
C -1.727788 -1.239856 -0.259740
C 2.630801 1.388886 -0.258680
C -2.272036 1.564708 -0.070620
C 3.110404 -1.001365 0.265341
C 3.515042 0.376207 0.067729
C -3.031341 -0.731451 -0.043371
C -3.323926 0.643795 0.059528
H 0.854212 -0.644716 -1.710842
H -1.569006 -2.314976 -0.357933
H 2.943364 2.436265 -0.287823
H 3.849750 -1.732551 0.606518
H -4.349956 0.982935 0.224939