%chk=000054569.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000054569

0 1
 O    2.529900       1.036100     -0.9067000    
 O   -2.311300       3.112000     -0.2618000    
 N    4.927900      0.3766000      0.4713000    
 C   -1.358100     -0.2704000     -0.1238000    
 C   -1.014900       1.088600     -0.3037000    
 C  -0.3377000      -1.243200     -0.2116000    
 C   -2.801700     -0.3316000      0.1286000    
 C   0.9888000     -0.7849000     -0.4793000    
 C   -3.333100      0.9729000      0.1027000    
 C   -2.231900       1.906500     -0.1691000    
 C    1.262100      0.5899000     -0.6486000    
 C   0.2587000       1.545500     -0.5623000    
 C  -0.5200000      -2.636700     -5.6499999E-02
 C   -3.679000      -1.376400      0.3721000    
 C    2.044000      -1.705900     -0.5779000    
 C   -4.667000       1.279600      0.3035000    
 C    3.096200       1.940700      3.5100002E-02
 C    4.602300       1.735500      6.4900003E-02
 C   0.5453000      -3.535600     -0.1589000    
 C   -5.040100      -1.098400      0.5797000    
 C    1.825500      -3.071200     -0.4190000    
 C   -5.529300      0.2163000      0.5460000    
 C    4.365000      8.1500001E-02   1.791300    
 C    6.378400      0.1726000      0.4837000    
 H   0.4573000       2.602300     -0.7006000    
 H   -1.492600      -3.064100      0.1476000    
 H   -3.366500      -2.410600      0.4112000    
 H    3.059700      -1.384700     -0.7946000    
 H   -5.031700       2.299500      0.2747000    
 H    2.896300       2.959000     -0.3209000    
 H    2.636300       1.861100       1.027300    
 H    4.994500       1.907000     -0.9455000    
 H    5.060100       2.478600      0.7299000    
 H   0.3682000      -4.600100     -3.4800000E-02
 H   -5.728600      -1.918100      0.7707000    
 H    2.653500      -3.768800     -0.5017000    
 H   -6.587000      0.4015000      0.7103000    
 H    4.648300      0.8289000       2.541400    
 H    4.721200     -0.8941000       2.144600    
 H    3.275600     -9.9999998E-03   1.770900    
 H    6.881700      0.8264000       1.205300    
 H    6.801800      0.3628000     -0.5089000    
 H    6.619200     -0.8671000      0.7317000    


%chk=000054569-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000054569

0 1
O 2.639918 0.310626 -0.237621
O -2.092631 2.976168 0.713483
N 5.355797 0.888171 1.048438
C -1.534967 -0.489793 -0.088404
C -1.033287 0.807062 0.160295
C -0.610478 -1.547703 -0.383734
C -3.029195 -0.442137 0.027953
C 0.810930 -1.229084 -0.415334
C -3.407959 0.901425 0.351166
C -2.170054 1.743264 0.447973
C 1.259496 0.125187 -0.161259
C 0.339339 1.142365 0.130856
C -0.996712 -2.905833 -0.647410
C -4.043980 -1.409167 -0.114771
C 1.761630 -2.260412 -0.694219
C -4.740782 1.289099 0.530579
C 3.170460 1.654463 0.057709
C 4.694158 1.591234 -0.069152
C -0.047212 -3.892376 -0.921774
C -5.401979 -1.022528 0.066081
C 1.343975 -3.570060 -0.943846
C -5.756176 0.306851 0.385156
C 5.416881 1.686242 2.287466
C 6.670698 0.330561 0.677182
H 0.633515 2.175789 0.331066
H -2.053601 -3.176979 -0.632673
H -3.827645 -2.451120 -0.361043
H 2.822477 -1.996940 -0.699386
H -4.979978 2.329158 0.776644
H 2.757912 2.377499 -0.676136
H 2.852682 1.960174 1.073906
H 4.930301 1.059660 -1.009125
H 5.069609 2.642823 -0.186802
H -0.370084 -4.920583 -1.118684
H -6.188368 -1.777711 -0.046043
H 2.081355 -4.352319 -1.153873
H -6.809098 0.576167 0.518759
H 6.043995 2.609874 2.186064
H 5.840153 1.072114 3.101617
H 4.404431 1.995949 2.600411
H 7.432464 1.108963 0.414043
H 6.558173 -0.346599 -0.187837
H 7.071137 -0.260045 1.520581


