%chk=000069171.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000069171

0 1
 O    4.902700      0.4981000      0.2885000    
 N   -1.486300      4.4199999E-02 -1.1600000E-02
 C   -2.333300      -1.026500     -0.4793000    
 C   -2.116000       1.260000      0.5074000    
 C  -8.8600002E-02 -6.5399997E-02 -3.4000002E-02
 C   -2.522000      -2.079700      0.6074000    
 C   -2.156800       2.346000     -0.5625000    
 C   0.5202000      -1.229200     -0.5161000    
 C   0.7094000      0.9879000      0.4253000    
 C   -3.446000      -3.211300      0.1788000    
 C   -2.844000       3.618400     -8.6300001E-02
 C    1.910600      -1.338400     -0.5384000    
 C    2.099800      0.8786000      0.4028000    
 C    2.700400     -0.2845000     -7.9000004E-02
 C    4.150000     -0.3981000     -0.1030000    
 H   -1.972900      -1.467600      -1.416100    
 H   -3.321000     -0.6233000     -0.7415000    
 H   -1.649600       1.608200       1.436400    
 H   -3.149300       1.030000      0.8015000    
 H   -2.939700      -1.608000       1.505900    
 H   -1.561300      -2.510800      0.9095000    
 H   -2.690800       1.969000      -1.444000    
 H   -1.149300       2.602600     -0.9065000    
 H  -3.8199998E-02  -2.083000     -0.8849000    
 H   0.3089000       1.918900      0.8110000    
 H   -4.439000      -2.829200     -7.8100003E-02
 H   -3.041900      -3.734900     -0.6933000    
 H   -3.559600      -3.936900      0.9901000    
 H   -3.877400       3.416400      0.2124000    
 H   -2.315500       4.049100      0.7700000    
 H   -2.860600       4.363900     -0.8874000    
 H    2.364600      -2.250900     -0.9164000    
 H    2.696200       1.712000      0.7651000    
 H    4.566300      -1.341600     -0.4952000    


%chk=000069171-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000069171

0 1
O 5.122486 0.480572 0.190839
N -1.428060 0.057616 0.019725
C -2.309105 -1.030991 -0.452503
C -2.096498 1.282979 0.506662
C -0.039490 -0.059138 -0.010982
C -2.618403 -2.100618 0.625446
C -2.266889 2.375055 -0.579775
C 0.599969 -1.280940 -0.415195
C 0.811525 1.041500 0.360653
C -3.553656 -3.204542 0.087734
C -2.984672 3.626045 -0.030382
C 1.997071 -1.383053 -0.447753
C 2.203715 0.919906 0.330232
C 2.830682 -0.292785 -0.076092
C 4.293556 -0.426769 -0.117335
H -1.866000 -1.511934 -1.345371
H -3.259850 -0.575620 -0.790606
H -1.544358 1.693903 1.372882
H -3.095005 0.995418 0.888440
H -3.081602 -1.604903 1.501105
H -1.670704 -2.545243 0.983518
H -2.840039 1.951250 -1.427746
H -1.273317 2.650892 -0.980527
H 0.001830 -2.152730 -0.692722
H 0.374559 1.997544 0.661483
H -4.521323 -2.784784 -0.246826
H -3.100019 -3.730128 -0.773838
H -3.766344 -3.958741 0.866021
H -3.990996 3.375577 0.355991
H -2.412285 4.086207 0.797139
H -3.108307 4.390935 -0.817426
H 2.459618 -2.328834 -0.759967
H 2.845008 1.762985 0.611877
H 4.656905 -1.432631 -0.456202


