%chk=000103892.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000103892

0 1
 O    4.283800      -2.116200     -0.3092000    
 O    1.712200       3.604500      0.5942000    
 O   -1.859500      -1.229600       2.078700    
 N    1.287400      2.6699999E-02 -0.1833000    
 C   0.3039000     -0.9736000      0.2299000    
 C    2.640800     -0.4229000      0.1408000    
 C    1.008900       1.312000      0.4563000    
 C   -1.102900     -0.5423000     -8.9400001E-02
 C    2.953800      -1.709000     -0.6049000    
 C    2.015100       2.351800     -6.6999998E-03
 C   -2.112300     -0.6926000      0.8523000    
 C   -1.368000      5.4000001E-03  -1.337700    
 C   -3.410200     -0.2878000      0.5400000    
 C   -2.666000      0.4101000      -1.649800    
 C   -3.687000      0.2634000     -0.7110000    
 H   0.4212000      -1.197700       1.297400    
 H   0.4237000      -1.916300     -0.3138000    
 H    2.785200     -0.5647000       1.220100    
 H    3.411500      0.2806000     -0.1855000    
 H    1.041500       1.231200       1.551700    
 H   1.6400000E-02   1.708800      0.2171000    
 H    2.869000      -1.571100      -1.688300    
 H    2.321300      -2.545500     -0.3008000    
 H    1.982400       2.483700      -1.093200    
 H    3.044300       2.140400      0.2886000    
 H  -0.5927000      0.1146000      -2.091000    
 H   -4.215500     -0.3964000       1.261600    
 H   -2.882500      0.8361000      -2.625200    
 H   -4.697600      0.5777000     -0.9545000    
 H    4.454000      -2.928900     -0.8154000    
 H    1.760400       3.488000       1.558400    
 H   -2.685300      -1.251100       2.592200    


%chk=000103892-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000103892

0 1
O 4.166668 -2.219907 -0.661475
O 1.983104 3.758817 0.250111
O -2.220674 -1.430373 2.109437
N 1.317763 0.013135 0.274191
C 0.198817 -0.796501 0.813887
C 2.629231 -0.674540 0.356809
C 1.323055 1.409650 0.765817
C -1.148126 -0.472887 0.175035
C 2.874906 -1.546198 -0.882369
C 1.952181 2.377793 -0.257433
C -2.352916 -0.810028 0.846421
C -1.250263 0.132055 -1.098339
C -3.617196 -0.542995 0.272111
C -2.505513 0.401527 -1.690728
C -3.691815 0.064975 -1.001017
H 0.107682 -0.700833 1.920771
H 0.429847 -1.864058 0.627739
H 2.718269 -1.311403 1.266271
H 3.438317 0.075141 0.415006
H 1.858391 1.505848 1.746476
H 0.279830 1.727917 0.938353
H 2.899995 -0.902621 -1.785881
H 2.054825 -2.286560 -1.000586
H 1.328894 2.423594 -1.164205
H 2.970481 2.041396 -0.547869
H -0.315020 0.388087 -1.607706
H -4.536016 -0.809021 0.812049
H -2.557195 0.872791 -2.677906
H -4.671187 0.272481 -1.445833
H 4.377473 -2.793239 -1.439835
H 2.523279 3.782440 1.080598
H -3.109789 -1.597186 2.509695


