%chk=000036535.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000036535

0 1
 O   -1.670800       1.609500      0.2072000    
 O  -0.5317000      0.1803000       1.582000    
 O    6.631200     -0.3669000     -0.9336000    
 N   -4.312000     -0.9931000     -8.8999998E-03
 N   0.4898000       1.217500     -0.2514000    
 C   -2.923400      0.9950000      0.4893000    
 C   -4.036600       1.915400     -1.4000000E-03
 C   -2.994700     -0.3724000     -0.1966000    
 C   -5.390900       1.230200      0.1253000    
 C   -5.382000     -0.1429000     -0.5491000    
 C   -4.347500      -2.317300     -0.6292000    
 C   -5.653300      -3.029400     -0.3428000    
 C  -0.5507000      0.9234000      0.6083000    
 C    1.816900      0.7325000     -0.2097000    
 C    2.186500     -0.1509000      0.7919000    
 C    2.722500       1.150200      -1.171800    
 C    4.419200     -0.2175000     -0.1288000    
 C    3.496400     -0.6290000      0.8328000    
 C    4.032300      0.6721000      -1.131200    
 C    5.784500     -0.7165000     -8.7300003E-02
 C    6.214300      -1.690000       1.004800    
 H   -3.024000      0.8782000       1.577000    
 H   -3.854500       2.195100      -1.047200    
 H   -4.027100       2.854000      0.5652000    
 H   -2.755100     -0.2652000      -1.264100    
 H   -2.229900      -1.038800      0.2176000    
 H   -5.646700       1.118100       1.186700    
 H   -6.166500       1.859600     -0.3256000    
 H   -6.369800     -0.5762000     -0.3625000    
 H   -5.275100     -2.0000000E-02  -1.634900    
 H   -4.183600      -2.263000      -1.713000    
 H   -3.538900      -2.930500     -0.2120000    
 H   -5.915000      -2.986300      0.7200000    
 H   -6.486500      -2.630300     -0.9291000    
 H   -5.560800      -4.087500     -0.6126000    
 H   0.2772000       1.862200      -1.008900    
 H    1.529100     -0.5137000       1.568700    
 H    2.431400       1.842800      -1.956700    
 H    3.756400      -1.319800       1.629000    
 H    4.732800       1.007200      -1.891500    
 H    5.633400      -2.613500      0.9383000    
 H    6.108700      -1.225400       1.988600    
 H    7.269700      -1.943800      0.8628000    


%chk=000036535-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000036535

0 1
O -1.558465 1.017997 -0.418620
O -0.470895 -0.511279 1.014837
O 7.130320 0.383470 -0.477970
N -4.729765 -1.024346 -0.151616
N 0.690227 0.908749 -0.492852
C -2.891600 0.603272 0.122467
C -3.841238 1.780449 -0.116829
C -3.367818 -0.664061 -0.613862
C -5.279420 1.365101 0.273762
C -5.695737 0.064062 -0.443801
C -5.149092 -2.353899 -0.668382
C -6.403306 -2.913397 0.027886
C -0.435891 0.375088 0.126556
C 2.046283 0.574186 -0.269823
C 2.457461 -0.410732 0.669085
C 3.026869 1.270937 -1.033887
C 4.817225 0.005301 0.072616
C 3.829216 -0.681759 0.827578
C 4.388084 0.988693 -0.862387
C 6.284834 -0.257861 0.217256
C 6.749078 -1.313745 1.217317
H -2.777152 0.376863 1.197929
H -3.806211 2.051476 -1.190660
H -3.510667 2.662446 0.460683
H -3.330715 -0.467324 -1.717858
H -2.681705 -1.499051 -0.387573
H -5.339621 1.201573 1.366507
H -5.987134 2.175249 0.016386
H -6.696370 -0.244227 -0.095833
H -5.766767 0.254251 -1.548993
H -5.316623 -2.325543 -1.777040
H -4.306127 -3.048754 -0.491960
H -6.263548 -2.909552 1.123123
H -7.311968 -2.331515 -0.208550
H -6.584031 -3.953607 -0.299410
H 0.490605 1.632017 -1.187934
H 1.705233 -0.942012 1.255124
H 2.711948 2.032261 -1.758760
H 4.126857 -1.443904 1.555671
H 5.153099 1.516249 -1.441525
H 6.330580 -2.307179 0.969801
H 6.421374 -1.062507 2.243323
H 7.847773 -1.370039 1.193816


