%chk=000127664.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000127664

0 1
 I   0.7060000       1.326600       2.823300    
 I  -0.3089000      -3.051500      -1.319000    
 I    4.934500     -0.2267000      -1.321100    
 O   -1.430100       1.230300     -0.9272000    
 O   -3.036600       1.360900      0.7236000    
 N    3.493200       1.309500       1.179900    
 C   -2.001100     -0.7740000      0.1855000    
 C  -0.8768000      -1.019800       1.208400    
 C   -3.296000      -1.477000      0.6270000    
 C   0.5030000     -0.8101000      0.6310000    
 C   -2.242200      0.7223000      4.5299999E-02
 C   -4.419500      -1.330900     -0.3916000    
 C    1.347400      0.1494000       1.176400    
 C   0.9117000      -1.586600     -0.4466000    
 C    2.619800      0.3354000      0.6358000    
 C    2.183900      -1.400600     -0.9871000    
 C    3.038100     -0.4396000     -0.4459000    
 C   -1.542200       2.639300      -1.148700    
 C  -0.5842000       3.043200      -2.249000    
 H   -1.824700      -1.064700     -0.8426000    
 H   -1.114800     -0.4621000       2.111800    
 H  -0.9107000      -2.062800       1.556600    
 H   -3.638100      -1.082300       1.591600    
 H   -3.103500      -2.546700      0.7722000    
 H   -4.727500     -0.2892000     -0.5183000    
 H   -5.297100      -1.896400     -6.1600000E-02
 H   -4.117400      -1.722000      -1.368400    
 H    2.510100      -2.005100      -1.831000    
 H   -2.568900       2.882100      -1.444100    
 H   -1.292500       3.174700     -0.2260000    
 H    4.413900       1.439300      0.7823000    
 H    3.192700       1.873800       1.963500    
 H  -0.6425000       4.117600      -2.444000    
 H   0.4450000       2.788200      -1.975300    
 H  -0.8099000       2.502400      -3.174000    


%chk=000127664-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000127664

0 1
I 0.521835 1.542014 2.526097
I 0.065167 -3.596492 -1.045126
I 5.058964 -0.172187 -1.309307
O -1.449419 1.264961 -0.908911
O -2.956795 1.407903 0.861254
N 3.347980 1.516120 0.955130
C -2.073781 -0.803492 0.158931
C -0.914180 -1.204046 1.141645
C -3.398037 -1.477292 0.596264
C 0.484260 -0.938691 0.610660
C -2.233775 0.715011 0.106577
C -4.556763 -1.256071 -0.398342
C 1.282789 0.159497 1.029756
C 1.075882 -1.813514 -0.346958
C 2.599033 0.437232 0.526626
C 2.360147 -1.586808 -0.879971
C 3.101196 -0.475473 -0.452947
C -1.475661 2.755826 -1.033001
C -0.513318 3.118930 -2.159216
H -1.801394 -1.146267 -0.855885
H -1.074795 -0.698052 2.109022
H -1.022552 -2.289891 1.322449
H -3.685539 -1.091320 1.593057
H -3.205701 -2.563035 0.704926
H -4.811948 -0.184433 -0.479243
H -5.464948 -1.791005 -0.066421
H -4.294600 -1.628196 -1.406864
H 2.781332 -2.272250 -1.617730
H -2.515376 3.066537 -1.243053
H -1.175350 3.187525 -0.060966
H 4.286248 1.661986 0.587704
H 2.981617 2.153721 1.659111
H -0.493461 4.215633 -2.296542
H 0.510043 2.777874 -1.925568
H -0.824999 2.654642 -3.110459


