%chk=000129810.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000129810

0 1
 O    4.442100      -1.154500     -3.0000001E-04
 O  -0.6811000       2.594600      -1.006800    
 O   -1.285100      -2.010100      -1.314800    
 O   -1.486300      -2.600200      0.7900000    
 N    2.262900      0.6696000      0.1584000    
 N   -2.072300      0.5429000      0.4689000    
 N   -3.845100     -0.6623000     -3.7200000E-02
 N   -1.742300      -1.799100     -0.1546000    
 C    1.478300       1.797400     -0.3397000    
 C   1.1200000E-02   1.421200     -0.5740000    
 C    2.276900     -0.4281000     -0.8185000    
 C    3.637900       1.086400      0.4671000    
 C  -0.6722000      0.9033000      0.6978000    
 C    3.110800      -1.587900     -0.2819000    
 C    4.440500     -0.1091000      0.9727000    
 C   -2.536400     -0.6718000      8.5500002E-02
 C   -3.122900       1.388300      0.6037000    
 C   -4.217000      0.6192000      0.2838000    
 H    1.901200       2.205500      -1.268000    
 H    1.513300       2.620600      0.3869000    
 H  -9.5700003E-02  0.7047000      -1.393200    
 H    2.697400     -8.5699998E-02  -1.773000    
 H    1.275900     -0.8232000      -1.006700    
 H    3.636000       1.864200       1.239200    
 H    4.121100       1.497100     -0.4290000    
 H  -0.6799000       1.675300       1.477700    
 H  -0.1719000      2.1800000E-02   1.111000    
 H    2.667100      -2.020800      0.6231000    
 H    3.172100      -2.382200      -1.032800    
 H    5.480300      0.1863000       1.145300    
 H    4.042700     -0.4919000       1.920500    
 H  -0.6206000       3.258300     -0.2986000    
 H   -3.021400       2.422600      0.9017000    
 H   -5.253500      0.9231000      0.2687000    


%chk=000129810-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000129810

0 1
O 4.464463 -1.210332 0.121087
O -0.780772 2.681064 -1.144448
O -0.448074 -1.706346 -0.193617
O -2.272970 -3.065922 0.059910
N 2.253691 0.664569 -0.046082
N -2.014778 0.532943 0.584034
N -3.882969 -0.765447 0.304074
N -1.718357 -1.908761 0.050230
C 1.461552 1.806292 -0.547457
C -0.052445 1.496413 -0.655792
C 2.427808 -0.415867 -1.059458
C 3.574733 1.074014 0.503584
C -0.615042 1.002323 0.694613
C 3.154145 -1.610718 -0.423985
C 4.279698 -0.147330 1.118652
C -2.532061 -0.745185 0.312607
C -3.124396 1.353234 0.741832
C -4.260828 0.541436 0.567921
H 1.802189 2.170160 -1.548316
H 1.595284 2.649534 0.164769
H -0.244972 0.733078 -1.425802
H 3.013365 -0.044689 -1.936775
H 1.439334 -0.755341 -1.411462
H 3.418537 1.842755 1.284966
H 4.232163 1.511398 -0.288696
H -0.599286 1.825664 1.433408
H 0.030266 0.187107 1.054065
H 2.521807 -2.040365 0.380778
H 3.371717 -2.386320 -1.175718
H 5.292803 0.113983 1.466992
H 3.678304 -0.530641 1.971592
H -0.472368 3.479467 -0.641453
H -3.020252 2.414677 0.947321
H -5.308291 0.828654 0.609525


