%chk=000071879.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000071879

0 1
 O   -3.000400      0.1997000     -0.8703000    
 N   0.4089000      0.3478000      0.5255000    
 C    1.686800     -0.2241000      0.1303000    
 C  -0.6328000      5.5999998E-03 -0.4414000    
 C    2.777700      0.2189000       1.122300    
 C    1.534600      -1.744100      6.7400001E-02
 C   -1.971500      0.5655000      4.1099999E-02
 C    4.176300      0.1366000      0.5596000    
 C  -0.2601000      0.5380000      -1.825300    
 C    4.900700      -1.035400      0.7090000    
 C    4.710300       1.234600     -9.5899999E-02
 C    6.192900      -1.111100      0.1892000    
 C    6.002500       1.158700     -0.6159000    
 C   -4.265000      7.8199998E-02 -0.3570000    
 C    6.743800     -1.4200000E-02 -0.4734000    
 C   -4.643600      0.8549000      0.7320000    
 C   -5.156300     -0.8219000     -0.9300000    
 C   -5.930700      0.7299000       1.254900    
 C   -6.443400     -0.9467000     -0.4071000    
 C   -6.830700     -0.1707000      0.6853000    
 H    2.000400      0.1480000     -0.8502000    
 H  -0.7946000      -1.074700     -0.5220000    
 H    2.713500     -0.3611000       2.053100    
 H    2.604500       1.261800       1.425000    
 H   0.1459000      1.1600000E-02   1.451700    
 H   0.9598000      -2.080700     -0.8007000    
 H    1.072400      -2.149100      0.9752000    
 H    2.508300      -2.231500     -3.6899999E-02
 H   -2.167200      0.1558000       1.042000    
 H   -1.924700       1.660100      0.1041000    
 H   0.5335000     -4.4799998E-02  -2.303000    
 H   5.1300000E-02   1.588300      -1.784200    
 H   -1.114800      0.4857000      -2.509100    
 H    4.488000      -1.892400       1.232900    
 H    4.140300       2.151600     -0.2146000    
 H    6.771300      -2.023400      0.3026000    
 H    6.431200       2.012700      -1.132300    
 H    7.750000     -7.3299997E-02 -0.8777000    
 H   -3.984300       1.587400       1.187200    
 H   -4.858400      -1.428300      -1.780700    
 H   -6.234900       1.338400       2.101600    
 H   -7.144100      -1.647900     -0.8508000    
 H   -7.833400     -0.2667000       1.091400    


%chk=000071879-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000071879

0 1
O -3.138105 -0.424975 -0.564705
N 0.409815 -0.085373 0.422543
C 1.797782 -0.340533 -0.053013
C -0.716231 -0.389421 -0.502188
C 2.769785 0.196437 1.038823
C 2.085193 -1.823174 -0.405092
C -1.996455 0.070203 0.219787
C 4.230861 0.201169 0.614846
C -0.564337 0.341651 -1.849468
C 5.152835 -0.745515 1.129812
C 4.702355 1.155964 -0.325182
C 6.505643 -0.744399 0.717828
C 6.051847 1.161239 -0.741647
C -4.429827 -0.094994 -0.124778
C 6.960227 0.209000 -0.221556
C -4.709305 0.674940 1.032402
C -5.489316 -0.592065 -0.925229
C -6.055533 0.941929 1.376685
C -6.823725 -0.317239 -0.568187
C -7.117244 0.452150 0.585484
H 1.949918 0.273493 -0.960743
H -0.829798 -1.481184 -0.707480
H 2.645663 -0.417429 1.954857
H 2.434203 1.221520 1.285953
H 0.262374 -0.550177 1.332957
H 1.396020 -2.190576 -1.187431
H 1.962181 -2.466213 0.488702
H 3.118088 -1.948439 -0.776328
H -2.041919 -0.352541 1.246917
H -2.017699 1.176378 0.285981
H 0.258842 -0.075049 -2.456247
H -0.366050 1.416136 -1.679686
H -1.498204 0.236982 -2.427486
H 4.808161 -1.487530 1.860985
H 4.007758 1.905773 -0.725294
H 7.202559 -1.483157 1.130163
H 6.397285 1.908891 -1.465014
H 8.008410 0.213853 -0.541136
H -3.903733 1.066488 1.660613
H -5.244009 -1.184751 -1.812153
H -6.268736 1.538363 2.271212
H -7.637702 -0.704434 -1.191389
H -8.155880 0.664308 0.859781


