%chk=000157952.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000157952

0 1
 O   -1.216900      0.1340000      6.7299999E-02
 N    3.042600     -0.1549000      0.5169000    
 N    1.665700       1.465500     -0.1235000    
 N   -4.888500     -6.0100000E-02  0.2049000    
 C    1.123100      0.2420000     -0.3523000    
 C  -0.2426000      0.1487000     -0.9671000    
 C    1.932100     -0.7805000      2.4400000E-02
 C   -2.534700      4.6300001E-02 -0.4587000    
 C   -3.521000      1.2200000E-02  0.6978000    
 C    1.803300      -2.245400     -1.7500000E-02
 C    2.836700       1.192200      0.4076000    
 H  -0.4081000       1.013400      -1.620800    
 H  -0.3216000     -0.7632000      -1.570700    
 H   -2.728000      0.9157000      -1.099000    
 H   -2.628500     -0.8643000      -1.063000    
 H    3.867700     -0.6029000      0.8932000    
 H   -3.311800     -0.8509000       1.339700    
 H   -3.394300      0.9027000       1.324200    
 H   0.7716000      -2.552300      0.1819000    
 H    2.087000      -2.625200      -1.004100    
 H    2.442300      -2.727400      0.7297000    
 H    3.573600       1.913800      0.7303000    
 H   -5.093400      0.7607000     -0.3635000    
 H   -5.534400     -3.0400001E-02  0.9927000    


%chk=000157952-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000157952

0 1
O -1.128448 0.037646 -0.035784
N 3.139797 -0.247487 0.407976
N 2.126112 1.492842 -0.606005
N -4.837401 -0.249029 0.209844
C 1.226124 0.411216 -0.506868
C -0.167367 0.525486 -1.047173
C 1.834645 -0.684425 0.121414
C -2.514492 0.142749 -0.509091
C -3.423105 -0.379244 0.612567
C 1.326124 -2.051665 0.474855
C 3.272009 1.061155 -0.049474
H -0.361531 1.590533 -1.290337
H -0.299340 -0.071701 -1.978270
H -2.756978 1.204962 -0.743979
H -2.670700 -0.457066 -1.431426
H 3.854231 -0.797285 0.884331
H -3.200813 -1.449776 0.773399
H -3.156752 0.153156 1.554226
H 0.239214 -2.078242 0.300256
H 1.801795 -2.846519 -0.131961
H 1.496544 -2.293180 1.541484
H 4.188310 1.638495 0.047558
H -5.183659 0.714064 0.178307
H -5.482419 -0.876986 0.694553


