%chk=000056459.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000056459

0 1
 O   -1.113300      -1.130400      -1.945000    
 O   -1.927800       2.015600       1.317500    
 N   4.3600000E-02   1.295400      0.2644000    
 N   -1.894400      0.3536000     -0.3209000    
 C   0.4212000      0.3366000     -0.7612000    
 C  -0.9396000     -0.2552000      -1.106400    
 C   -1.334200       1.302200      0.5182000    
 C    1.355600     -0.7107000     -0.2683000    
 C    1.003900       2.199100      0.8684000    
 C   -3.312700      5.7100002E-02 -0.3626000    
 C    2.730000     -0.5810000     -0.4819000    
 C   0.8627000      -1.827600      0.4104000    
 C    1.136000       3.414000      1.1700000E-02
 C   -3.611000      -1.036300      0.6084000    
 C    3.606400      -1.562700     -1.9500000E-02
 C    1.739200      -2.809300      0.8728000    
 C    3.111000      -2.676800      0.6578000    
 C    2.288700       3.821700     -0.5313000    
 C   -4.165200      -2.205400      0.2676000    
 H   0.7977000      0.8720000      -1.640000    
 H   0.6177000       2.508800       1.846000    
 H    1.954700       1.686600       1.035500    
 H   -3.877800      0.9532000     -8.5199997E-02
 H   -3.583400     -0.2269000      -1.385400    
 H    3.129100      0.2821000      -1.008200    
 H  -0.1955000      -1.957300      0.6179000    
 H   0.2426000       4.008000     -0.1650000    
 H   -3.378100     -0.8604000       1.655700    
 H    4.674600      -1.459400     -0.1865000    
 H    1.354400      -3.674300       1.404900    
 H    3.793500      -3.440400       1.019100    
 H    2.322800       4.719000      -1.139400    
 H    3.211200       3.271500     -0.3819000    
 H   -4.365500      -2.958600       1.021800    
 H   -4.425700      -2.431900     -0.7603000    


%chk=000056459-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000056459

0 1
O -1.078254 -1.000427 -2.193113
O -2.195475 1.908265 1.339058
N -0.105387 1.329851 0.351647
N -1.972305 0.327809 -0.442802
C 0.374169 0.448505 -0.729203
C -0.950380 -0.192914 -1.243740
C -1.482825 1.271286 0.521134
C 1.393820 -0.597922 -0.281631
C 0.759781 2.257763 1.098245
C -3.398352 -0.043091 -0.540181
C 2.437996 -0.981636 -1.155441
C 1.282114 -1.220476 0.986395
C 1.280384 3.388149 0.227019
C -3.781944 -1.117479 0.462852
C 3.360663 -1.979739 -0.769452
C 2.206484 -2.213904 1.374519
C 3.248353 -2.597196 0.497325
C 2.594695 3.625180 -0.007344
C -4.227170 -2.349262 0.116778
H 0.806045 1.041989 -1.559791
H 0.138716 2.659296 1.921163
H 1.602837 1.695337 1.540878
H -3.984712 0.876301 -0.357007
H -3.574564 -0.389673 -1.572823
H 2.523590 -0.506913 -2.140193
H 0.473315 -0.926832 1.666376
H 0.512669 4.036363 -0.220389
H -3.692582 -0.833044 1.520657
H 4.164456 -2.273119 -1.453552
H 2.113943 -2.691233 2.356426
H 3.964849 -3.369418 0.798478
H 2.925643 4.463466 -0.630386
H 3.378341 2.990769 0.426328
H -4.508578 -3.089887 0.873815
H -4.317935 -2.654262 -0.932943


