%chk=000030204.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000030204

0 1
 O  -0.8309000     -0.2351000       1.374000    
 N   0.7636000     -0.5046000     -0.8687000    
 N    1.982500     -0.6382000       1.174000    
 C  -3.0500000E-02  0.6995000     -0.7085000    
 C   0.2618000      -1.552600      -1.753100    
 C   0.8907000       1.861400     -0.4084000    
 C   -1.096400      0.4844000      0.3895000    
 C    1.972700     -0.6699000     -0.1866000    
 C  -0.4342000      -2.623500     -0.9597000    
 C   -2.404900       1.110500      0.2841000    
 C    1.442900       2.575100      -1.458200    
 C    1.162300       2.186200      0.9096000    
 C    3.127900     -0.8621000     -0.9433000    
 C   0.2934000      -3.707300     -0.4855000    
 C   -1.796400      -2.516300     -0.7108000    
 C    2.292400       3.646300      -1.181600    
 C    2.011700       3.257400       1.186200    
 C   -2.544500       2.329900     -0.3784000    
 C   -3.521100      0.4898000      0.8449000    
 C    2.576800       3.987500      0.1406000    
 C    4.338200      -1.028300     -0.2793000    
 C  -0.3521000      -4.700800      0.2505000    
 C   -2.441900      -3.509900      2.5200000E-02
 C    3.177400     -0.8031000       1.784400    
 C   -1.719800      -4.602200      0.5059000    
 C   -3.800200       2.928600     -0.4803000    
 C   -4.776900       1.088600      0.7429000    
 C    4.371900     -0.9994000       1.110500    
 C   -4.916400       2.308000      8.0300003E-02
 H  -0.5636000      0.9033000      -1.646500    
 H    1.065800      -1.995700      -2.354400    
 H  -0.4345000      -1.137200      -2.493600    
 H    1.228800       2.315400      -2.490800    
 H   0.7388000       1.656800       1.755200    
 H    3.107600     -0.8710000      -2.028600    
 H    1.358600      -3.796300     -0.6792000    
 H   -2.374400      -1.683600      -1.099400    
 H    2.732900       4.214300      -1.995800    
 H    2.231900       3.524800       2.215600    
 H   -1.699300       2.849100     -0.8180000    
 H   -3.434400     -0.4616000       1.363200    
 H    3.238100       4.821700      0.3560000    
 H    5.253900      -1.176200     -0.8437000    
 H   0.2102000      -5.551500      0.6244000    
 H   -3.507800      -3.435200      0.2198000    
 H    3.149700     -0.7710000       2.868500    
 H   -2.222700      -5.376400       1.078000    
 H   -3.908900       3.879400     -0.9941000    
 H   -5.646100      0.6050000       1.178900    
 H    5.304100      -1.125200       1.649100    
 H   -5.894000       2.774400      1.3000000E-03


%chk=000030204-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000030204

0 1
O -1.624536 -0.970391 1.101092
N 0.566887 -0.623232 -0.685818
N 1.169929 -0.112102 1.515146
C -0.530990 0.382233 -0.579843
C 0.805398 -1.247235 -1.994028
C -0.074111 1.767865 -1.036801
C -1.253085 0.205937 0.806902
C 1.391469 -0.881723 0.401399
C 0.241829 -2.664625 -2.164917
C -1.666094 1.347234 1.692397
C -0.657924 2.330759 -2.200931
C 0.947574 2.492459 -0.367259
C 2.406430 -1.890307 0.387641
C -0.693997 -3.207454 -1.251149
C 0.650257 -3.436547 -3.282667
C -0.243924 3.593018 -2.685913
C 1.362255 3.751088 -0.850591
C -2.014657 2.642192 1.228224
C -1.801645 1.054030 3.078344
C 0.769298 4.308736 -2.009462
C 3.187429 -2.068150 1.542312
C -1.214572 -4.506105 -1.461213
C 0.127892 -4.732029 -3.490904
C 1.926261 -0.311815 2.626352
C -0.809414 -5.271635 -2.578189
C -2.480083 3.622022 2.134407
C -2.246716 2.036971 3.982237
C 2.957880 -1.270680 2.693462
C -2.589185 3.328750 3.511869
H -1.302715 0.039041 -1.300572
H 1.893341 -1.254092 -2.206072
H 0.362525 -0.582128 -2.760683
H -1.447147 1.780166 -2.730356
H 1.394838 2.065409 0.534784
H 2.547488 -2.536465 -0.481631
H -1.008687 -2.618505 -0.380484
H 1.379791 -3.024720 -3.993171
H -0.707454 4.011777 -3.586304
H 2.146788 4.302764 -0.320217
H -1.944284 2.890749 0.166672
H -1.554174 0.043676 3.419807
H 1.094841 5.287157 -2.380427
H 3.965450 -2.839466 1.552035
H -1.936707 -4.918029 -0.747006
H 0.452596 -5.319456 -4.357525
H 1.687882 0.329720 3.483227
H -1.214421 -6.277821 -2.735312
H -2.756088 4.614336 1.760978
H -2.333945 1.799817 5.048438
H 3.546888 -1.394800 3.606025
H -2.941961 4.094807 4.211792


