%chk=000064458.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000064458

0 1
 O   -1.569300      0.1047000      1.2700000E-02
 O   -2.320400      -2.071300      5.5000000E-03
 N   -5.239400       1.697600     -2.4999999E-03
 C    2.163200      0.4633000      1.0100000E-02
 C    3.967400     -0.8424000       1.220400    
 C    3.973700     -0.7355000      -1.297500    
 C    4.551000       1.313000      5.2099999E-02
 C    2.484600     -0.4314000       1.230700    
 C    2.490900     -0.3248000      -1.280300    
 C    3.066500       1.718100      6.5399997E-02
 C    4.268800      -1.617600     -7.2999999E-02
 C    4.843100      0.4207000       1.269800    
 C    4.849400      0.5270000      -1.235400    
 C   0.6874000      0.8702000      2.3700001E-02
 C  -0.2210000     -0.3438000      1.7600000E-02
 C   -2.523600     -0.8671000      6.8000001E-03
 C   -3.883300     -0.2706000      6.9999998E-04
 C   -4.988900      -1.086500     -6.8999999E-03
 C   -4.031400       1.090700      2.7000001E-03
 C   -6.249100     -0.4990000     -1.2600000E-02
 C   -6.319600      0.8848000     -9.9999998E-03
 H    4.182400      -1.474700       2.089100    
 H    4.193100      -1.291900      -2.215700    
 H    5.179000       2.210000      9.1700003E-02
 H    1.896100      -1.354600       1.228500    
 H    2.251700      9.6900001E-02   2.164000    
 H    2.264200      0.2824000      -2.165900    
 H    1.897900      -1.241400      -1.361900    
 H    2.852300       2.300500      0.9708000    
 H    2.856300       2.374800     -0.7885000    
 H    5.319400      -1.933100     -8.3800003E-02
 H    3.662400      -2.530800     -0.1133000    
 H    4.648800      0.9753000       2.196100    
 H    5.903600      0.1407000       1.283000    
 H    5.910000      0.2489000      -1.266800    
 H    4.659700       1.158100      -2.112300    
 H   0.4532000       1.506300     -0.8400000    
 H   0.4638000       1.483500      0.9065000    
 H  -7.5300001E-02 -0.9598000     -0.8732000    
 H  -8.6400002E-02 -0.9554000      0.9135000    
 H   -4.907400      -2.169000     -8.7000001E-03
 H   -3.202100       1.789000      8.7000001E-03
 H   -7.147900      -1.105000     -1.8700000E-02
 H   -7.278900       1.391900     -1.4100000E-02


%chk=000064458-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000064458

0 1
O -1.645930 0.053045 -0.092917
O -2.507078 -2.095502 0.199888
N -5.400488 1.816682 -0.224476
C 2.203617 0.325569 -0.011754
C 4.109963 -0.863547 1.210659
C 4.163561 -0.674291 -1.320142
C 4.539289 1.380525 0.114380
C 2.582706 -0.582393 1.198336
C 2.635484 -0.393185 -1.326988
C 3.013105 1.655157 0.102623
C 4.511538 -1.580597 -0.107332
C 4.887268 0.475312 1.327105
C 4.942019 0.663924 -1.202466
C 0.689926 0.683327 -0.016351
C -0.261123 -0.514248 -0.058091
C -2.686517 -0.860233 0.051267
C -4.022998 -0.195989 0.012403
C -5.183744 -0.993014 0.179779
C -4.183019 1.201171 -0.186472
C -6.447221 -0.370046 0.144294
C -6.507098 1.029516 -0.059440
H 4.354650 -1.511927 2.075328
H 4.444266 -1.188182 -2.260899
H 5.084279 2.341791 0.196951
H 2.036376 -1.545667 1.143546
H 2.277499 -0.088485 2.144340
H 2.368270 0.238493 -2.199263
H 2.091273 -1.352887 -1.438859
H 2.718357 2.189046 1.029694
H 2.754605 2.317799 -0.749269
H 5.597149 -1.804414 -0.100828
H 3.978156 -2.549247 -0.190493
H 4.621589 0.989413 2.272960
H 5.978029 0.279784 1.355649
H 6.033424 0.470062 -1.212691
H 4.716360 1.312804 -2.072813
H 0.476228 1.331936 -0.889579
H 0.457862 1.278643 0.889437
H -0.130072 -1.138615 -0.959749
H -0.181087 -1.163621 0.830861
H -5.070027 -2.071155 0.332811
H -3.306864 1.842401 -0.319155
H -7.367529 -0.948156 0.270589
H -7.470153 1.551699 -0.093872


