%chk=000121030.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000121030

0 1
 O   -4.464500      0.1935000      0.2970000    
 O    3.718500       1.076100     -0.1906000    
 N    1.076000      0.5726000      7.4000000E-03
 N    4.282200      -1.165400      5.4200001E-02
 C  -0.3062000      0.4784000      7.9899997E-02
 C    1.963100     -0.5583000      0.1054000    
 C  -0.9344000     -0.7671000      0.2588000    
 C   -1.113400       1.625500     -2.4300000E-02
 C   -3.108500      0.2863000      0.2260000    
 C    3.398400     -9.8300003E-02 -2.5800001E-02
 C   -2.324200     -0.8624000      0.3313000    
 C   -2.503100       1.530300      4.8400000E-02
 C    5.716000      -1.016500     -4.9600001E-02
 C    6.103600      0.4382000     -0.2533000    
 C   -5.057900      -1.017100     -0.1702000    
 C   -6.445600     -0.7158000     -0.6945000    
 H    1.853700      -1.054300       1.076900    
 H    1.764300      -1.278300     -0.6971000    
 H    1.474200       1.496900     -0.1202000    
 H  -0.3610000      -1.685600      0.3517000    
 H  -0.6575000       2.603300     -0.1633000    
 H   -2.754300      -1.845500      0.4980000    
 H   -3.108900       2.428400     -3.4499999E-02
 H    6.158400      -1.414000      0.8689000    
 H    6.053800      -1.632200     -0.8888000    
 H    3.916300      -2.103100      0.1911000    
 H    5.736700      0.8503000      -1.199000    
 H    5.843700       1.073600      0.5997000    
 H    7.197800      0.4880000     -0.3245000    
 H   -4.484800      -1.461500     -0.9937000    
 H   -5.121800      -1.730100      0.6592000    
 H   -6.935400      -1.625800      -1.052300    
 H   -7.064700     -0.2667000      8.9199997E-02
 H   -6.399200      7.0000002E-03  -1.515900    


%chk=000121030-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000121030

0 1
O -4.609258 0.222718 -0.059446
O 3.583500 1.339259 0.790495
N 1.020540 0.640823 0.404436
N 4.418163 -0.755151 0.191738
C -0.360392 0.487561 0.271186
C 1.978961 -0.401982 0.121049
C -0.951408 -0.729332 -0.168919
C -1.229616 1.579012 0.583692
C -3.198352 0.233233 0.023113
C 3.395193 0.146333 0.398733
C -2.356132 -0.856850 -0.292169
C -2.620967 1.452567 0.461390
C 5.840691 -0.411249 0.377480
C 6.630976 -0.421037 -0.947240
C -5.247063 -1.023738 -0.508162
C -6.754512 -0.779040 -0.502291
H 1.811824 -1.306492 0.751779
H 1.926709 -0.742701 -0.939993
H 1.428790 1.525681 0.719343
H -0.322279 -1.589750 -0.420756
H -0.800092 2.528835 0.925010
H -2.769422 -1.810803 -0.634327
H -3.284381 2.289457 0.701975
H 5.856458 0.593960 0.830966
H 6.293871 -1.116493 1.101003
H 4.186368 -1.694013 -0.140227
H 6.610828 -1.417651 -1.426827
H 6.211818 0.313903 -1.655979
H 7.688113 -0.158484 -0.760386
H -4.887387 -1.282149 -1.527052
H -4.973232 -1.852549 0.179030
H -7.290902 -1.686781 -0.834429
H -7.100984 -0.517765 0.512293
H -7.015126 0.051068 -1.181009


