%chk=000017083.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000017083

0 1
 O    7.010800     -0.7103000      1.7100001E-02
 O    6.041000       1.342100     -3.0000000E-03
 N   -8.057000     -0.2560000      6.5600000E-02
 C  -0.4644000     -0.4856000     -6.0000001E-03
 C   -1.722400      0.3911000     -1.9400001E-02
 C   0.8378000      0.3198000     -6.6000000E-03
 C   -3.022600     -0.4135000     -9.8300003E-02
 C    2.096100     -0.5557000      3.3000000E-03
 C   -4.281100      0.4601000     -4.0800001E-02
 C    3.400600      0.2481000     -3.1099999E-02
 C   -5.583700     -0.3476000     -3.5799999E-02
 C    4.637500     -0.6487000      4.8400000E-02
 C   -6.830700      0.5324000      8.1100002E-02
 C    5.938000      0.1238000      2.5599999E-02
 H   -1.733400       1.011300      0.8854000    
 H   -1.675900       1.077700     -0.8735000    
 H  -0.4771000      -1.143800     -0.8836000    
 H  -0.4883000      -1.135200      0.8775000    
 H   0.8591000      0.9669000     -0.8922000    
 H   0.8531000      0.9807000      0.8688000    
 H   -3.031700      -1.000200      -1.025100    
 H   -3.048100      -1.131000      0.7311000    
 H    2.083400      -1.185200      0.9017000    
 H    2.070300      -1.233700     -0.8588000    
 H   -4.283200       1.146900     -0.8961000    
 H   -4.243800       1.080300      0.8634000    
 H    3.438000      0.8467000     -0.9497000    
 H    3.412600      0.9587000      0.8048000    
 H   -5.561500      -1.058400      0.8000000    
 H   -5.638900     -0.9421000     -0.9567000    
 H    4.610900      -1.231700      0.9758000    
 H    4.640300      -1.339100     -0.8027000    
 H   -6.789100       1.113100       1.009400    
 H   -6.858800       1.244600     -0.7507000    
 H   -8.055800     -0.9067000      0.8500000    
 H   -8.856900      0.3597000      0.2054000    
 H    7.857700     -0.2160000     -8.1000002E-03


%chk=000017083-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000017083

0 1
O 7.083633 -0.748287 -0.061804
O 6.127737 1.363064 0.063081
N -8.103046 -0.284197 0.029723
C -0.460211 -0.483869 0.001894
C -1.724979 0.403953 0.014431
C 0.855781 0.326059 0.002739
C -3.040650 -0.406684 0.012871
C 2.119370 -0.563223 -0.010651
C -4.306419 0.479973 0.026595
C 3.430026 0.253775 -0.006948
C -5.618056 -0.336130 0.019330
C 4.677076 -0.650323 -0.023695
C -6.881422 0.547955 0.039643
C 5.980385 0.123377 -0.001583
H -1.701515 1.062908 0.907716
H -1.708630 1.077365 -0.868065
H -0.484740 -1.142878 -0.891335
H -0.476976 -1.157156 0.884649
H 0.872286 0.999574 -0.879385
H 0.880506 0.984512 0.896008
H -3.065000 -1.064900 -0.880601
H -3.056502 -1.080777 0.895036
H 2.099758 -1.237703 0.871296
H 2.093180 -1.220324 -0.905410
H -4.289274 1.154561 -0.855078
H -4.282444 1.137422 0.921262
H 3.453805 0.929933 -0.883144
H 3.462917 0.909082 0.884445
H -5.631993 -1.012787 0.901035
H -5.662570 -0.985104 -0.876659
H 4.679759 -1.338439 0.845072
H 4.685355 -1.304092 -0.917878
H -6.814272 1.244953 0.912967
H -6.891402 1.179797 -0.869996
H -8.167663 -0.925620 0.827393
H -8.973285 0.239203 -0.107765
H 7.922276 -0.211475 -0.040989


