%chk=000073547.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000073547

0 1
 O   -2.692400      -2.425400     -3.3399999E-02
 O   0.3311000      0.8015000       1.133000    
 O  -0.1132000       1.046500      -1.111300    
 N    3.889800       1.515900      0.4794000    
 C  -0.3246000      -2.356600     -0.2480000    
 C   -1.594600      -1.609700     -0.4359000    
 C   0.1642000      -2.727700       1.116100    
 C    1.300200      -3.705400      0.8149000    
 C   -1.624600     -0.2532000      0.3123000    
 C    1.718500      -3.443100     -0.6308000    
 C   0.5271000      -2.751000      -1.201700    
 C   -2.920400      0.5312000      0.1297000    
 C  -0.3921000      0.5931000     -8.8000000E-03
 C    2.681200      0.7242000      0.6541000    
 C    1.497500       1.618100      0.9874000    
 C   -3.458000       1.248300       1.198800    
 C   -3.567300      0.5320000      -1.106100    
 C    3.902900       2.157800     -0.8373000    
 C    5.083500      0.6836000      0.6477000    
 C   -4.642500       1.965700       1.032000    
 C   -4.751800       1.249400      -1.272800    
 C   -5.289400       1.966400     -0.2037000    
 C    5.126800       3.042400      -1.004600    
 C    5.148100     -0.4042000     -0.4110000    
 H   -1.714300      -1.436200      -1.511600    
 H  -0.6099000      -3.210100       1.720500    
 H   0.5400000      -1.852800       1.654500    
 H    2.136900      -3.591800       1.512000    
 H   0.9362000      -4.736400      0.9132000    
 H   -1.587600     -0.5015000       1.384500    
 H    2.597200      -2.794000     -0.6853000    
 H    1.935500      -4.378800      -1.154100    
 H   0.3955000      -2.567500      -2.258500    
 H   -2.650200      -3.254200     -0.5406000    
 H    2.444500      0.1117000     -0.2253000    
 H    2.790000      1.5600000E-02   1.487000    
 H    1.660200       2.115200       1.950900    
 H    1.317600       2.411200      0.2546000    
 H   -2.963100       1.259100       2.166100    
 H   -3.168700      7.1000000E-03  -1.967500    
 H    3.813700       1.458900      -1.676600    
 H    3.039100       2.826800     -0.9219000    
 H    6.003400       1.277800      0.6499000    
 H    5.060700      0.2163000       1.640900    
 H   -5.060600       2.524900       1.863900    
 H   -5.252900       1.254900      -2.236400    
 H   -6.210900       2.526400     -0.3341000    
 H    4.996500       3.685400      -1.882500    
 H    6.042400       2.467300      -1.171600    
 H    5.273200       3.699500     -0.1404000    
 H    6.007400      -1.050100     -0.1929000    
 H    5.314400     -1.8700000E-02  -1.420500    
 H    4.274500      -1.060200     -0.4183000    


%chk=000073547-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000073547

0 1
O -2.807808 -2.275977 0.114177
O 0.329055 0.905810 1.196682
O -0.162913 1.054226 -1.078553
N 3.941100 1.427388 0.196221
C -0.367856 -2.287572 -0.216915
C -1.648132 -1.502862 -0.388578
C 0.127916 -2.785322 1.140742
C 1.270504 -3.778775 0.761368
C -1.682797 -0.179811 0.443374
C 1.718750 -3.364447 -0.678576
C 0.508292 -2.609537 -1.208274
C -2.988284 0.592654 0.226488
C -0.457307 0.650647 0.072154
C 2.731375 0.670744 0.585918
C 1.601853 1.654728 0.955078
C -3.972067 0.594023 1.245068
C -3.250646 1.282416 -0.984974
C 3.944722 1.812382 -1.239614
C 5.212631 0.868228 0.716099
C -5.198499 1.270255 1.061283
C -4.476341 1.960152 -1.168435
C -5.455161 1.956929 -0.147669
C 4.912085 2.967743 -1.555860
C 5.656750 -0.498139 0.122433
H -1.789505 -1.245724 -1.458823
H -0.672409 -3.259058 1.737717
H 0.512127 -1.933152 1.739158
H 2.103474 -3.766184 1.485686
H 0.868764 -4.808617 0.733882
H -1.598671 -0.455963 1.507713
H 2.607123 -2.696638 -0.654678
H 1.996150 -4.233060 -1.304787
H 0.396498 -2.317887 -2.258899
H -2.827039 -3.141390 -0.368198
H 2.367878 -0.009674 -0.219234
H 2.959273 0.041054 1.465701
H 1.809969 2.168229 1.905174
H 1.436293 2.389172 0.148568
H -3.782231 0.048568 2.176524
H -2.488433 1.302371 -1.771828
H 4.173251 0.940387 -1.902026
H 2.916531 2.126465 -1.498271
H 6.011643 1.614031 0.549864
H 5.106621 0.770088 1.813599
H -5.951750 1.259286 1.857261
H -4.666344 2.493388 -2.107074
H -6.405530 2.483393 -0.292192
H 4.796508 3.281987 -2.609448
H 5.968987 2.679524 -1.410074
H 4.697969 3.833510 -0.904589
H 6.591180 -0.837911 0.606795
H 5.846907 -0.429521 -0.964013
H 4.888246 -1.276959 0.286757


