%chk=000145221.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000145221

0 1
 O    4.317400     -0.6536000     -0.4697000    
 O    3.762800       1.445400      0.2034000    
 N  -0.1113000     -0.4374000      0.1083000    
 N   0.3284000      -1.680800      0.3973000    
 C   0.9081000      0.4569000     -9.4999999E-02
 C   -1.467700     -0.1764000      4.3800000E-02
 C    2.076200     -0.2464000      7.1599998E-02
 C   0.6724000       1.878100     -0.4236000    
 C    1.658200      -1.556300      0.3732000    
 C   -1.950300       1.091200      0.3692000    
 C   -2.353500      -1.181000     -0.3457000    
 C   -3.318700       1.354100      0.3053000    
 C   -3.721900     -0.9182000     -0.4099000    
 C    3.404500      0.2750000     -4.3800000E-02
 C   -4.204600      0.3494000     -8.4500000E-02
 H   0.5661000       2.492500      0.4752000    
 H    1.548000       2.280200     -0.9489000    
 H  -0.1510000       2.040000      -1.124700    
 H    2.262800      -2.428500      0.5784000    
 H   -1.349400       1.879700      0.8002000    
 H   -2.008500      -2.176100     -0.6156000    
 H   -3.698900       2.332100      0.5862000    
 H   -4.411800      -1.699900     -0.7141000    
 H   -5.270600      0.5523000     -0.1283000    
 H    5.217800     -0.2706000     -0.5395000    


%chk=000145221-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000145221

0 1
O 4.413564 -0.809669 0.022951
O 3.863924 1.402828 -0.437313
N -0.118643 -0.334130 0.090985
N 0.323003 -1.659434 0.338525
C 0.936051 0.543781 -0.130235
C -1.536688 -0.104739 0.054643
C 2.111741 -0.239266 -0.003928
C 0.805143 1.993617 -0.493142
C 1.671087 -1.573140 0.283981
C -2.094352 1.120396 0.493697
C -2.376894 -1.150569 -0.400545
C -3.493265 1.306552 0.442747
C -3.772347 -0.955129 -0.438517
C 3.483411 0.232937 -0.163729
C -4.337526 0.274784 -0.025601
H 0.686930 2.632846 0.402238
H 1.731737 2.316206 -0.992657
H -0.059777 2.172255 -1.154951
H 2.284681 -2.455760 0.448984
H -1.456719 1.909547 0.900083
H -1.925255 -2.098202 -0.704132
H -3.921572 2.254595 0.785504
H -4.419272 -1.765002 -0.792313
H -5.422053 0.422904 -0.059701
H 5.327590 -0.436510 -0.098775


