%chk=000032322.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000032322

0 1
 O  -0.6667000     -0.1105000      6.5499999E-02
 O    2.592600       1.166200      0.2608000    
 O   -2.050200      0.4891000       1.800000    
 O    3.448900       2.244400      -1.584200    
 N   -2.692600      0.7632000     -0.4098000    
 N    3.471800       3.232300      0.4920000    
 C   -3.988000       1.322900     -0.1565000    
 C   -5.175700      0.4447000      0.1074000    
 C   -5.087900       1.223000      -1.172500    
 C    1.580700      -1.081000      0.2847000    
 C    1.238600      -2.264100     -0.6691000    
 C   0.3192000     -0.5353000      0.9962000    
 C    2.253300      4.5699999E-02 -0.5446000    
 C    2.589800      -1.524700       1.362600    
 C   0.5691000      -3.475000     -8.3999997E-03
 C   -1.826100      0.3909000      0.5977000    
 C   0.2306000      -4.545400      -1.036800    
 C    3.192600       2.213600     -0.3852000    
 H   -3.932700       2.255200      0.3971000    
 H   -5.047000     -0.6294000      5.2700002E-02
 H   -5.890900      0.7739000      0.8510000    
 H   -5.745300       2.075500      -1.290800    
 H   -4.901400      0.6701000      -2.085100    
 H    2.160900      -2.602200      -1.160700    
 H   0.5860000      -1.897500      -1.472600    
 H   -2.400600      0.6412000      -1.375100    
 H   0.5894000      0.3155000       1.635100    
 H  -0.1110000      -1.302300       1.651200    
 H    3.165600     -0.3403000      -1.018000    
 H    1.573700      0.3745000      -1.341100    
 H    2.165000      -2.288000       2.022700    
 H    3.495000      -1.942300      0.9078000    
 H    2.893800     -0.6891000       2.003000    
 H  -0.3576000      -3.178800      0.4926000    
 H    1.228800      -3.913000      0.7474000    
 H  -0.2434000      -5.403000     -0.5489000    
 H  -0.4615000      -4.159300      -1.792000    
 H    1.132800      -4.899900      -1.545300    
 H    3.918300       4.088800      0.1823000    
 H    3.239900       3.159500       1.476900    


%chk=000032322-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000032322

0 1
O -0.689156 -0.226301 0.032573
O 2.478379 1.152552 0.317358
O -2.037363 0.617311 1.778732
O 3.296639 2.328305 -1.556261
N -2.661153 0.773931 -0.489004
N 3.248918 3.273181 0.594360
C -3.893526 1.498765 -0.277347
C -5.111848 0.759874 0.289493
C -5.081876 1.174959 -1.189478
C 1.576232 -1.133751 0.296085
C 1.242816 -2.305577 -0.682732
C 0.320325 -0.635831 1.042086
C 2.159547 0.004635 -0.570847
C 2.615710 -1.566876 1.363429
C 0.646429 -3.579527 -0.041231
C -1.832617 0.417765 0.555861
C 0.360252 -4.670074 -1.097270
C 3.036336 2.270485 -0.328709
H -3.767804 2.542090 0.034650
H -4.980795 -0.299231 0.524118
H -5.758280 1.308117 0.979181
H -5.712381 2.005167 -1.518576
H -4.950109 0.380917 -1.931232
H 2.175217 -2.583790 -1.218174
H 0.533252 -1.933769 -1.448215
H -2.318958 0.613416 -1.437292
H 0.558696 0.232344 1.680180
H -0.114106 -1.429709 1.675835
H 3.086593 -0.319118 -1.079270
H 1.433209 0.339387 -1.331863
H 2.197348 -2.317193 2.057942
H 3.502232 -2.013674 0.876120
H 2.953191 -0.699112 1.956152
H -0.295805 -3.330956 0.485011
H 1.340355 -3.984318 0.720844
H -0.071355 -5.576463 -0.634570
H -0.354725 -4.305100 -1.858600
H 1.287216 -4.967130 -1.623521
H 3.652184 4.149076 0.275321
H 2.988584 3.144320 1.568860


