%chk=000035887.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000035887

0 1
 O    4.605100     -0.7816000     -0.5498000    
 N    7.629300      0.6939000      0.9503000    
 C   -1.424400       1.158500      2.8600000E-02
 C  -0.9392000     -0.1282000     -5.0000001E-02
 C  -0.5978000       2.435900      5.3599998E-02
 C   0.5432000     -0.3023000     -0.1838000    
 C   -2.882800       1.402800      0.1580000    
 C   -1.819500      -1.285300     -2.4000001E-03
 C    1.294100     -0.4093000      0.9611000    
 C    1.084700     -0.3478000      -1.445000    
 C  -0.3353000       2.993800      -1.340000    
 C   -2.136400      -1.870400       1.223500    
 C   -2.347100      -1.809300      -1.182500    
 C   -3.437900       1.477200       1.419400    
 C   -3.639400       1.548800     -0.9870000    
 C    3.259100     -0.6226000     -0.4282000    
 C    2.673900     -0.5719000      0.8368000    
 C    2.464500     -0.5105000      -1.569200    
 C   -2.981000      -2.979700       1.269300    
 C   -3.191700      -2.918400      -1.136700    
 C   -4.808300       1.707300       1.541100    
 C   -5.009800       1.779000     -0.8654000    
 C    5.418600     -0.2546000      0.4974000    
 C   -3.508500      -3.503600      8.9199997E-02
 C   -5.594200       1.858100      0.3988000    
 C    6.769600      0.1336000     -8.1699997E-02
 C    8.911300       1.106800      0.3945000    
 H   0.3613000       2.267800      0.5555000    
 H   -1.099000       3.203100      0.6579000    
 H   0.8463000     -0.3755000       1.949900    
 H   0.4741000     -0.2644000      -2.339200    
 H   0.1833000       2.277300      -1.981500    
 H   -1.268300       3.279500      -1.836200    
 H   0.2890000       3.890700      -1.269800    
 H   -1.734500      -1.474800       2.153200    
 H   -2.111100      -1.365300      -2.146700    
 H   -2.834900       1.362500       2.315900    
 H   -3.196100       1.487100      -1.977000    
 H    3.252000     -0.6826000       1.749500    
 H    2.914700     -0.5495000      -2.557300    
 H   -3.228200      -3.435100       2.223800    
 H   -3.602900      -3.326200      -2.055600    
 H   -5.263300       1.768900       2.525400    
 H   -5.621900       1.895700      -1.754900    
 H    5.541400      -1.021700       1.271500    
 H    4.968000      0.6433000      0.9417000    
 H   -4.166400      -4.367100      0.1247000    
 H   -6.661300       2.037000      0.4935000    
 H    6.612000      0.8595000     -0.8895000    
 H    7.233100     -0.7487000     -0.5410000    
 H    7.784300      6.9999998E-04   1.681800    
 H    9.533600       1.529400       1.189400    
 H    9.451200      0.2600000     -4.1700002E-02
 H    8.781800       1.881400     -0.3684000    


%chk=000035887-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000035887

0 1
O 4.726953 0.400734 -0.698611
N 8.007310 -0.831592 0.542753
C -1.757604 1.432016 0.079851
C -0.979006 0.285151 0.069397
C -1.156924 2.836585 0.139873
C 0.509907 0.321357 -0.106600
C -3.256306 1.390688 0.025663
C -1.555516 -1.085987 0.289627
C 1.359345 -0.408878 0.766119
C 1.126499 1.038922 -1.172733
C -1.466457 3.715699 -1.099875
C -2.472131 -1.342971 1.346263
C -1.148339 -2.178985 -0.525159
C -4.051624 2.201161 0.883620
C -3.928161 0.588589 -0.940063
C 3.348936 0.329189 -0.445138
C 2.762471 -0.405178 0.616586
C 2.521373 1.045682 -1.345078
C -2.982890 -2.639773 1.565012
C -1.666290 -3.475313 -0.315037
C -5.461168 2.190438 0.799992
C -5.335402 0.583025 -1.032270
C 5.629257 -0.325855 0.210604
C -2.588685 -3.712609 0.731200
C -6.112276 1.381251 -0.159554
C 7.055355 -0.065852 -0.285933
C 9.423100 -0.454851 0.370366
H -0.066959 2.777576 0.295379
H -1.569325 3.352384 1.031972
H 0.912641 -0.985872 1.583466
H 0.497125 1.579691 -1.887569
H -1.045760 3.271426 -2.020464
H -2.555234 3.825771 -1.248723
H -1.032243 4.725142 -0.978743
H -2.777258 -0.518571 1.999169
H -0.424578 -2.004406 -1.329526
H -3.567330 2.832044 1.638078
H -3.334431 -0.028458 -1.622535
H 3.378475 -0.969924 1.322657
H 2.990482 1.590473 -2.170224
H -3.685716 -2.814409 2.387698
H -1.348684 -4.299708 -0.963953
H -6.050450 2.813568 1.482683
H -5.826567 -0.041962 -1.786855
H 5.391256 -1.411224 0.184805
H 5.513619 0.039644 1.249226
H -2.987493 -4.719487 0.899402
H -7.205859 1.376120 -0.229563
H 7.282625 1.010397 -0.173404
H 7.110363 -0.296572 -1.377181
H 7.865340 -1.845874 0.448663
H 10.055632 -1.091490 1.013874
H 9.799399 -0.538152 -0.678264
H 9.567507 0.592428 0.693856


