%chk=000065089.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000065089

0 1
 O    1.979200      -1.397900       1.341600    
 O    3.544900      -1.637100     -0.2808000    
 O   -4.007700      -1.380900     -0.3070000    
 O   -4.304700      0.4900000      0.8105000    
 N    4.189200       1.029700      3.6899999E-02
 N   -3.580000     -0.2964000      0.1553000    
 C    1.870000       1.110300     -0.7509000    
 C    2.820600      0.6064000      0.3449000    
 C   0.4327000      0.7395000     -0.5127000    
 C  -5.9300002E-02 -0.4571000      -1.017500    
 C  -0.3857000       1.598100      0.2100000    
 C   -1.392800     -0.8011000     -0.7960000    
 C   -1.719200       1.254100      0.4317000    
 C    2.835500     -0.9119000      0.4052000    
 C   -2.222800      5.4299999E-02 -7.1199998E-02
 H    1.946800       2.202800     -0.8390000    
 H    2.177500      0.7185000      -1.731000    
 H    2.542400       1.004300       1.327600    
 H   0.5757000      -1.130100      -1.586900    
 H  -2.3000001E-03   2.533500      0.6079000    
 H   -1.750200      -1.743300      -1.203500    
 H   -2.335600       1.944900       1.001300    
 H    4.808400      0.7657000      0.8027000    
 H    4.226800       2.046800     -1.9099999E-02
 H    1.999600      -2.377800       1.382000    


%chk=000065089-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000065089

0 1
O 2.106190 -1.223068 1.674153
O 3.266557 -1.700449 -0.280859
O -4.094398 -1.413790 -0.435141
O -4.351413 0.416225 0.902308
N 4.225034 1.083562 0.060131
N -3.643591 -0.345492 0.135017
C 1.912198 1.106214 -0.788680
C 2.861951 0.669124 0.384269
C 0.457440 0.741650 -0.564150
C -0.096815 -0.418239 -1.169075
C -0.369083 1.534314 0.276976
C -1.438541 -0.783378 -0.947183
C -1.712245 1.187979 0.514142
C 2.803516 -0.858531 0.515453
C -2.228918 0.027941 -0.104170
H 2.019594 2.203990 -0.888687
H 2.310523 0.643142 -1.707604
H 2.458153 1.085998 1.334089
H 0.530782 -1.036044 -1.821279
H 0.043565 2.435871 0.744532
H -1.880734 -1.669690 -1.409631
H -2.361664 1.788786 1.156202
H 4.988751 0.623982 0.555521
H 4.360784 2.080476 -0.108405
H 2.021365 -2.215273 1.714070


