%chk=000100664.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000100664

0 1
 O  -0.2595000      -1.662500     -2.6000000E-03
 O   -1.613700       1.647800     -3.9999999E-04
 N   -1.521000      0.2509000     -1.3000000E-03
 C   0.9129000      0.4423000      1.0200000E-02
 C    2.202600     -0.3752000      9.3000000E-03
 C  -0.3336000     -0.4329000     -1.7000000E-03
 C    3.430400      0.5206000     -1.1500000E-02
 C   -2.818100     -0.3909000     -2.0000001E-03
 H   0.8778000       1.079300      0.9019000    
 H   0.8835000       1.090500     -0.8736000    
 H    2.237900      -1.018500      0.8965000    
 H    2.225400      -1.037700     -0.8643000    
 H    3.441800       1.150100     -0.9070000    
 H    4.341800     -8.5400000E-02 -1.0600000E-02
 H    3.455000       1.172600      0.8676000    
 H   -2.724400      -1.479600     -9.3999999E-03
 H   -3.368200     -6.7000002E-02 -0.8901000    
 H   -3.364200     -7.9400003E-02  0.8929000    
 H   -1.706500       1.818800      0.9523000    


%chk=000100664-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000100664

0 1
O -0.309792 -1.715351 0.077741
O -1.572458 1.655087 -0.035118
N -1.565679 0.217932 0.234540
C 0.909824 0.439477 0.080900
C 2.210398 -0.381925 -0.019565
C -0.334842 -0.448430 0.112506
C 3.459984 0.522997 -0.046404
C -2.860158 -0.427001 -0.020333
H 0.929175 1.074555 0.990148
H 0.820463 1.144601 -0.768187
H 2.264531 -1.086606 0.830660
H 2.173156 -1.010187 -0.928594
H 3.434830 1.217600 -0.907656
H 4.383958 -0.078066 -0.126304
H 3.534691 1.133042 0.874243
H -2.691311 -1.514738 0.016788
H -3.242168 -0.145491 -1.018871
H -3.598240 -0.138951 0.748582
H -1.646461 2.085255 0.861125


