%chk=000095261.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000095261

0 1
 O    1.872900       1.537200      5.4499999E-02
 O   -1.898600      -1.550200      5.1100001E-02
 N    2.996900     -0.5091000      3.7300002E-02
 N   -2.986600      0.5157000      3.8199998E-02
 C    4.227800     -0.1216000      0.6608000    
 C    4.128000     -0.2576000     -0.8063000    
 C   -4.224100      0.1484000      0.6607000    
 C   -4.121800      0.2858000     -0.8060000    
 C   0.6005000     -0.4867000      1.7100001E-02
 C  -0.5909000      0.4511000      1.8300001E-02
 C    1.877800      0.3087000      3.7500001E-02
 C   -1.882000     -0.3217000      3.6800001E-02
 H    4.684900     -0.9158000       1.232600    
 H    4.239200      0.8656000       1.099400    
 H    4.061700      0.6322000      -1.415600    
 H    4.513600      -1.148500      -1.279700    
 H   -4.667400      0.9492000       1.234200    
 H   -4.252800     -0.8394000       1.097200    
 H   -4.071100     -0.6037000      -1.417200    
 H   -4.491700       1.184300      -1.277500    
 H   0.5837000      -1.141100      0.8969000    
 H   0.5955000      -1.122000     -0.8767000    
 H  -0.5819000       1.090200     -0.8732000    
 H  -0.5704000       1.104800      0.8991000    


%chk=000095261-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000095261

0 1
O 1.694382 1.700590 -0.637935
O -1.690182 -1.693431 -0.648856
N 3.088722 0.126194 0.361829
N -3.085989 -0.123801 0.356430
C 4.398639 0.243052 -0.297104
C 3.825267 -1.132319 0.104853
C -4.394829 -0.236268 -0.305483
C -3.821286 1.136537 0.104835
C 0.678482 -0.361959 0.266190
C -0.675536 0.364394 0.267391
C 1.837379 0.579855 -0.066731
C -1.834001 -0.575484 -0.072501
H 5.203651 0.682843 0.300207
H 4.402733 0.512006 -1.360107
H 3.462900 -1.784898 -0.699631
H 4.230560 -1.650227 0.980494
H -5.201190 -0.678660 0.288076
H -4.397216 -0.499608 -1.369895
H -3.457052 1.793250 -0.695431
H -4.227857 1.649956 0.982531
H 0.871870 -0.870226 1.227350
H 0.636626 -1.162434 -0.502055
H -0.632699 1.169301 -0.496163
H -0.870173 0.867137 1.231205


