%chk=000030206.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000030206

0 1
 O  -0.1988000     -3.4299999E-02   1.308600    
 N    2.263700     -8.2599998E-02  0.1795000    
 N   -2.430700     -0.2601000     -0.3416000    
 N   -1.165300     -0.6015000     -0.7295000    
 C    3.577400     -0.4890000     -0.3185000    
 C    2.039800       1.340500     -7.1300000E-02
 C    1.210800     -0.8835000     -0.4439000    
 C    3.847700      -1.950400      3.0700000E-02
 C    3.121100       2.175300      0.6102000    
 C  -0.1106000     -0.4582000      0.1572000    
 C    5.218400      -2.392200     -0.4580000    
 C    2.898500       3.662500      0.3821000    
 C   -3.314700      -1.110900      0.2464000    
 C   -2.977500      0.9767000     -0.4909000    
 C   -4.470100     -0.3994000      0.4834000    
 C   -4.256700      0.9214000      1.7100001E-02
 C   -3.001200      -2.525900      0.5379000    
 C   -2.251600       2.111600      -1.099500    
 H    3.662800     -0.3335000      -1.401800    
 H    4.388100      6.3199997E-02  0.1622000    
 H    2.041600       1.550200      -1.149900    
 H    1.079100       1.695300      0.3137000    
 H    1.198000     -0.7670000      -1.534400    
 H    1.279200      -1.948100     -0.2036000    
 H    3.783800      -2.103100       1.114900    
 H    3.132800      -2.629300     -0.4423000    
 H    3.139500       1.973200       1.687700    
 H    4.120100       1.976500      0.2137000    
 H   -1.065300     -0.9596000      -1.673900    
 H    5.300700      -2.289000      -1.544800    
 H    6.011700      -1.796600      4.9999999E-03
 H    5.392300      -3.442300     -0.2028000    
 H    2.915700       3.904000     -0.6856000    
 H    1.934700       3.982300      0.7912000    
 H    3.684000       4.244400      0.8746000    
 H   -5.369700     -0.7861000      0.9420000    
 H   -4.961200       1.740900      4.9899999E-02
 H   -2.701000      -3.055900     -0.3718000    
 H   -2.190200      -2.602000       1.269400    
 H   -3.872700      -3.043800      0.9517000    
 H   -1.398200       2.404300     -0.4794000    
 H   -1.884300       1.853000      -2.097900    
 H   -2.904000       2.985000      -1.202000    


%chk=000030206-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000030206

0 1
O -0.214401 -0.607479 1.393916
N 2.320070 -0.134277 -0.210638
N -2.476258 -0.156242 -0.265952
N -1.187306 -0.422219 -0.724500
C 3.644018 -0.733005 -0.510948
C 2.168315 1.280852 -0.629626
C 1.196257 -0.989581 -0.612100
C 4.056238 -1.835586 0.488635
C 2.913450 2.268945 0.293227
C -0.106488 -0.650929 0.145013
C 5.440272 -2.432299 0.153186
C 2.709900 3.734727 -0.147365
C -3.458175 -1.143428 -0.020004
C -2.962972 1.132358 0.052925
C -4.587270 -0.459383 0.435009
C -4.279798 0.952290 0.480843
C -3.186674 -2.604067 -0.227796
C -2.105523 2.357787 -0.063455
H 3.685450 -1.142474 -1.554345
H 4.398034 0.074156 -0.465988
H 2.496737 1.437412 -1.690609
H 1.090421 1.532899 -0.593942
H 1.007240 -0.967412 -1.721503
H 1.438499 -2.037051 -0.355408
H 4.054395 -1.399764 1.504610
H 3.300645 -2.645895 0.497869
H 2.544704 2.117467 1.324381
H 3.996090 2.035330 0.306775
H -1.042290 -0.436535 -1.738104
H 5.449169 -2.884804 -0.856922
H 6.227746 -1.655254 0.179346
H 5.720666 -3.218482 0.876955
H 3.083289 3.901931 -1.175845
H 1.638233 4.011247 -0.129264
H 3.246266 4.429973 0.523085
H -5.529916 -0.927471 0.715418
H -4.946298 1.751131 0.803230
H -2.907225 -2.841930 -1.273037
H -2.370451 -2.966965 0.426054
H -4.093344 -3.181976 0.015380
H -1.227463 2.307058 0.609353
H -1.730920 2.520647 -1.093441
H -2.695629 3.244298 0.221282


