%chk=000071698.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000071698

0 1
 O   8.8500001E-02  -1.756600     -0.6361000    
 O    2.601900      -2.701600      -1.463700    
 N    2.651200      0.2569000      0.7615000    
 N   -2.955900       1.712300     -5.6499999E-02
 C    2.439600      -2.006900     -0.2238000    
 C    2.731900     -0.5241000     -0.4654000    
 C    2.988500       1.652200      0.5142000    
 C    1.029500      -2.266600      0.3016000    
 C   -1.542800      2.7000001E-03 -0.2963000    
 C   -1.112100      -1.329200     -0.1350000    
 C   -2.777800      0.3789000      0.2364000    
 C  -0.9873000       1.155900     -0.9180000    
 C   -1.879300       2.190600     -0.7540000    
 C    4.412700       1.765200     -2.2200000E-02
 C    2.823500       2.450700       1.803300    
 C   -1.930900      -2.233200      0.5515000    
 C   -3.606900     -0.5138000      0.9248000    
 C   -3.158800      -1.829600       1.072500    
 C   -1.815500       3.596100      -1.194700    
 H    3.165600      -2.427600      0.4823000    
 H    2.051500     -0.1281000      -1.228900    
 H    3.734100     -0.4865000     -0.9056000    
 H    2.295000       2.076800     -0.2225000    
 H   0.8985000      -1.809900       1.290400    
 H   0.8652000      -3.346900      0.3889000    
 H    3.279400     -0.1373000       1.461500    
 H  -3.8500000E-02   1.221200      -1.432600    
 H    4.743400       2.810400       0.000000    
 H    5.125100       1.189600      0.5800000    
 H    4.494700       1.445800      -1.065700    
 H    1.799000       2.373100       2.184200    
 H    3.032600       3.512200       1.631400    
 H    3.503900       2.097100       2.586400    
 H   -3.766200       2.256300      0.2069000    
 H   -1.621300      -3.267600      0.6793000    
 H   -4.563100     -0.2007000       1.330400    
 H   -3.779800      -2.548700       1.600500    
 H    3.523700      -2.581800      -1.749300    
 H   -1.873900       4.274200     -0.3373000    
 H  -0.8789000       3.802400      -1.722800    
 H   -2.642500       3.826900      -1.874100    


%chk=000071698-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000071698

0 1
O 0.289567 -0.901462 -0.388905
O 2.250788 -2.489594 -1.910565
N 3.473149 -0.265274 0.896263
N -3.535521 1.742819 -0.637435
C 2.446264 -2.020797 -0.529070
C 3.134126 -0.633995 -0.488787
C 3.426673 1.176727 1.251672
C 1.078749 -2.017798 0.148856
C -1.731614 0.375100 -0.420771
C -0.998550 -0.714258 0.128723
C -3.055979 0.631838 0.069009
C -1.441278 1.363253 -1.435618
C -2.560933 2.189122 -1.553708
C 4.479391 2.041897 0.504378
C 3.573785 1.318312 2.780377
C -1.594951 -1.511104 1.131165
C -3.668661 -0.153695 1.074093
C -2.914561 -1.224589 1.590064
C -2.818730 3.366145 -2.451025
H 3.080011 -2.750233 0.027722
H 2.423049 0.107426 -0.892494
H 4.016817 -0.658358 -1.177968
H 2.416485 1.531228 0.964599
H 1.227148 -1.878863 1.237636
H 0.563191 -2.977600 -0.051426
H 4.333618 -0.715749 1.236109
H -0.525204 1.443768 -2.016146
H 4.346695 3.115824 0.734641
H 5.505553 1.752444 0.804998
H 4.392422 1.917015 -0.590819
H 2.787308 0.741385 3.296508
H 3.498221 2.376886 3.087634
H 4.559496 0.940115 3.118014
H -4.454296 2.162772 -0.513596
H -1.057087 -2.356721 1.568282
H -4.680812 0.052963 1.437276
H -3.348522 -1.862225 2.368580
H 3.074078 -2.304705 -2.430965
H -3.022599 4.290903 -1.876071
H -1.937322 3.555553 -3.084680
H -3.682464 3.194323 -3.123050


