%chk=000121865.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000121865

0 1
 O   0.9273000      -3.277000      0.5752000    
 O   0.2116000      -2.429500      -1.319200    
 O    4.887500       2.017000      0.1759000    
 O    5.139700      6.3600004E-02 -0.7933000    
 N   -3.925700      0.6901000     -1.1400000E-02
 N  -0.8027000     -0.4396000       1.226400    
 N  -0.4489000      0.8032000      -2.611200    
 N   0.7831000      -2.310800     -0.2101000    
 N    4.442900      0.8926000     -0.1595000    
 C   -3.743700     -0.4936000      0.8308000    
 C   -3.053800     -0.1545000       2.153800    
 C   -4.048400      0.3089000      -1.413300    
 C   -1.671400      0.4721000       1.962600    
 C   -2.689800     -1.0200000E-02  -2.041100    
 C   -5.102400       1.445300      0.4225000    
 C   -1.714500       1.167100      -1.983800    
 C   0.4926000     -0.1290000      0.8759000    
 C    1.285100      -1.035000      0.1710000    
 C    1.009000       1.115200       1.237600    
 C    2.594000     -0.6967000     -0.1724000    
 C    2.318000       1.453400      0.8942000    
 C    3.110500      0.5475000      0.1894000    
 H   -3.150800      -1.264000      0.3271000    
 H   -4.707900     -0.9774000       1.039300    
 H   -2.952000      -1.080200       2.735100    
 H   -3.674300      0.5180000       2.756500    
 H   -4.733100     -0.5395000      -1.542200    
 H   -4.477000       1.138300      -1.992100    
 H   -1.246400      0.6683000       2.954400    
 H   -1.771500       1.430100       1.440600    
 H   -2.241200     -0.8921000      -1.571000    
 H   -2.858200     -0.2836000      -3.091300    
 H   -5.211800       2.357400     -0.1756000    
 H   -6.026800      0.8637000      0.3282000    
 H   -5.006400       1.776900       1.461200    
 H   -1.131500      -1.383400       1.060500    
 H   -1.523000       1.475400     -0.9534000    
 H   -2.137300       2.028400      -2.511900    
 H   0.4352000       1.854500       1.787900    
 H   0.2185000       1.564300      -2.493500    
 H  -4.8400000E-02 -5.2999998E-03  -2.138800    
 H    3.195200      -1.417800     -0.7228000    
 H    2.687500       2.431300       1.192600    


%chk=000121865-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000121865

0 1
O -0.189784 -1.618741 -1.017292
O 1.939150 -2.030218 -1.718729
O 5.505558 1.698877 1.829883
O 5.754410 0.145432 0.170858
N -3.983246 0.660046 -0.009650
N -0.610558 0.042682 0.979630
N -1.390675 -0.348076 -3.486297
N 1.115989 -1.424204 -0.930418
N 5.028569 0.836424 0.988198
C -3.647090 -0.503454 0.845426
C -2.829837 -0.135313 2.106599
C -4.541052 0.250262 -1.334125
C -1.581782 0.734422 1.843233
C -3.535590 -0.451410 -2.269425
C -4.890782 1.612187 0.670000
C -2.350047 0.441280 -2.691197
C 0.737797 0.249638 0.956998
C 1.618669 -0.475129 0.051486
C 1.372026 1.199067 1.837965
C 3.016922 -0.281719 0.070483
C 2.749585 1.388864 1.852377
C 3.572675 0.636269 0.968342
H -3.074474 -1.224356 0.234021
H -4.568589 -1.048813 1.179602
H -2.527867 -1.074239 2.609461
H -3.466663 0.414355 2.824940
H -5.436512 -0.409855 -1.198575
H -4.899953 1.172633 -1.831263
H -1.110024 0.974045 2.813109
H -1.890830 1.683217 1.360490
H -3.142461 -1.377737 -1.804663
H -4.071015 -0.779796 -3.180525
H -5.089428 2.468818 0.002707
H -5.873559 1.155293 0.950924
H -4.426770 2.007511 1.590455
H -0.953860 -0.611690 0.256227
H -1.912414 0.905675 -1.775838
H -2.726355 1.272532 -3.319766
H 0.749689 1.796643 2.507126
H -0.673280 0.199701 -3.970665
H -0.998470 -1.152483 -2.979808
H 3.651603 -0.845638 -0.617663
H 3.219122 2.110397 2.526159


