%chk=000054460.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000054460

0 1
 O   -1.401300     -0.8320000      8.9900002E-02
 O    1.397000     -0.8399000     -8.7499999E-02
 O   -3.176500      -1.498200      -1.192800    
 O    3.177300      -1.497900       1.192300    
 O   -3.216700       2.360800       1.306100    
 O    3.217100       2.361600      -1.306000    
 N   -3.301500      0.4698000      3.0999999E-02
 N    3.302000      0.4701000     -3.1300001E-02
 N   -2.567800       1.365500      0.9665000    
 N    2.568100       1.366000     -0.9667000    
 C  -0.6836000      -1.999300     -0.3274000    
 C   0.6845000      -1.999200      0.3267000    
 C   -2.666700     -0.6877000     -0.4211000    
 C    2.667400     -0.6874000      0.4206000    
 C   -4.650900      0.8236000     -0.3819000    
 C    4.651400      0.8242000      0.3817000    
 H   -1.238900      -2.896600     -3.3199999E-02
 H  -0.5737000      -1.969700      -1.417600    
 H    1.237000      -2.898600      3.3799998E-02
 H   0.5722000      -1.972700       1.416900    
 H   -5.292800      0.8808000      0.5023000    
 H   -5.060500      7.5700000E-02  -1.066100    
 H   -4.627800       1.791500     -0.8912000    
 H    4.628000       1.792000      0.8913000    
 H    5.293300      0.8818000     -0.5024000    
 H    5.061100      7.6200001E-02   1.065700    


%chk=000054460-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000054460

0 1
O -1.457032 -0.976750 0.257078
O 1.452543 -0.972548 -0.250722
O -3.019397 -1.196558 -1.472630
O 3.027340 -1.203107 1.466109
O -3.450717 1.961580 1.829400
O 3.438629 1.970710 -1.823715
N -3.286908 0.449757 0.182705
N 3.285022 0.451042 -0.183036
N -2.746085 0.999578 1.387449
N 2.735903 1.007711 -1.380925
C -0.675423 -2.096267 -0.339467
C 0.674463 -2.094106 0.346500
C -2.604516 -0.635571 -0.431997
C 2.605559 -0.636214 0.431452
C -4.524673 0.989468 -0.413583
C 4.528221 0.985756 0.406415
H -1.210972 -3.043215 -0.144253
H -0.587227 -1.948301 -1.428854
H 1.212705 -3.039764 0.152410
H 0.585674 -1.945469 1.435765
H -5.351750 0.918659 0.313023
H -4.749804 0.402177 -1.314070
H -4.382794 2.052884 -0.670690
H 4.390256 2.048252 0.669382
H 5.349718 0.916737 -0.326666
H 4.758968 0.393957 1.302520


