%chk=000168833.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000168833

0 1
 O   0.5540000       3.212500     -2.7000001E-03
 O   -1.508300       2.460300      2.6000000E-03
 O    3.935400      -1.979600     -2.9000000E-03
 O    4.272900      0.1895000     -8.2999999E-03
 N   -2.057000      3.4299999E-02  1.0700000E-02
 N  -0.2698000       2.268100      3.0000001E-04
 N   -5.368800      -1.605300     -1.5400000E-02
 N    3.503400     -0.8016000     -3.8999999E-03
 C  -0.6565000     -0.1556000      5.9000002E-03
 C   -2.985100      -1.051800      1.7300000E-02
 C   0.2178000      0.9312000      6.9999998E-04
 C  -0.1524000      -1.456400      7.4999998E-03
 C   -4.408100     -0.5092000     -1.3600000E-02
 C    1.596300      0.7175000     -2.2000000E-03
 C    2.100300     -0.5833000     -3.0000001E-04
 C    1.226000      -1.670300      4.3000001E-03
 H   -2.852100      -1.662300      0.9193000    
 H   -2.832600      -1.692600     -0.8605000    
 H   -2.421400      0.9770000      1.8200001E-02
 H  -0.7920000      -2.333600      1.2900000E-02
 H   -4.561400      0.1035000     -0.9093000    
 H   -4.590500      0.1339000      0.8552000    
 H    2.281800       1.561800     -5.9000002E-03
 H    1.583400      -2.697000      6.0000001E-03
 H   -6.314400      -1.226200      1.4300000E-02
 H   -5.257500      -2.161600      0.8314000    


%chk=000168833-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000168833

0 1
O 0.646345 3.278810 0.023803
O -1.514682 2.563571 0.075931
O 4.013149 -2.010560 -0.073443
O 4.358966 0.249477 -0.070599
N -2.048843 -0.004533 0.058072
N -0.220916 2.327182 0.040389
N -5.450110 -1.597147 0.093679
N 3.586591 -0.787298 -0.058796
C -0.695950 -0.177280 0.032788
C -3.038128 -1.093020 0.066471
C 0.235345 0.938575 0.020700
C -0.117687 -1.497140 0.016119
C -4.469456 -0.510493 0.012401
C 1.630503 0.734102 -0.009778
C 2.131690 -0.572733 -0.027295
C 1.258503 -1.696521 -0.013636
H -2.926344 -1.707371 0.984215
H -2.898757 -1.765750 -0.801120
H -2.355203 0.984191 0.080542
H -0.783798 -2.362900 0.027067
H -4.604015 0.013118 -0.952071
H -4.574314 0.259615 0.813709
H 2.306631 1.592961 -0.019123
H 1.689619 -2.701084 -0.026559
H -6.311819 -1.463633 -0.435887
H -5.603921 -1.990940 1.024021


