%chk=000121376.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000121376

0 1
 O    5.373800      0.9737000      0.7397000    
 O   -3.559800       1.970700      -1.121100    
 O  -0.5075000     -0.4783000       1.474200    
 O   -4.847600      -1.890200      0.9984000    
 N    3.291700     -0.7311000     -0.1878000    
 N   -4.174400     -1.0900000E-02 -0.1423000    
 N   -2.649800      -1.233900       1.154700    
 C   -1.786200      0.5194000     -0.3283000    
 C  -0.9219000       1.777300     -0.1580000    
 C   -1.330600     -0.2444000      -1.584600    
 C   -3.238900      0.9259000     -0.5552000    
 C   -1.572800     -0.4107000      0.8617000    
 C    3.293100      0.7091000     -0.4802000    
 C    4.670700      -1.215200     -3.4600001E-02
 C    4.036400       1.460600      0.6205000    
 C    5.380600     -0.4188000       1.056300    
 C    2.594800      -1.472800      -1.236400    
 C   -1.363500       2.582500       1.044800    
 C   5.9400000E-02 -0.6722000      -1.448600    
 C   -3.949400      -1.109700      0.6785000    
 C    1.201800      -1.031100      -1.351800    
 H  -0.9781000       2.413500      -1.050500    
 H   0.1348000       1.532800     -1.5400000E-02
 H   -1.440600      0.3850000      -2.476900    
 H   -1.963100      -1.125400      -1.754300    
 H    2.283200       1.122500     -0.5318000    
 H    3.785800      0.8997000      -1.443000    
 H    5.219200      -1.107800     -0.9795000    
 H    4.673400      -2.275800      0.2413000    
 H    4.092100       2.525500      0.3729000    
 H    3.526200       1.371100       1.587400    
 H    4.916000     -0.5734000       2.037800    
 H    6.425100     -0.7379000       1.130800    
 H    2.597900      -2.542500     -0.9931000    
 H    3.099400      -1.362300      -2.204700    
 H   -2.388100       2.953600      0.9539000    
 H   -1.288400       2.017000       1.978200    
 H  -0.7175000       3.461300       1.152000    
 H   -5.140600      0.1674000     -0.4018000    
 H   -2.492100      -1.957100       1.851100    


%chk=000121376-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000121376

0 1
O 5.343411 -0.133241 1.736888
O -4.075793 0.811745 -1.600192
O -0.191276 0.685078 1.284923
O -4.158362 -1.404347 2.485338
N 3.515959 -0.752962 -0.431387
N -4.066806 -0.297731 0.427325
N -2.142342 -0.442053 1.790537
C -1.896644 0.579546 -0.489192
C -1.473592 1.991718 -0.983547
C -1.304397 -0.538556 -1.469855
C -3.421839 0.409250 -0.604303
C -1.333541 0.313886 0.915877
C 3.221148 0.345310 0.530250
C 4.983134 -0.927662 -0.588823
C 3.884659 0.037680 1.879833
C 5.618246 -1.217192 0.781820
C 2.858599 -0.547742 -1.748847
C -2.029018 3.149063 -0.128650
C 0.157359 -0.529090 -1.579611
C -3.500035 -0.767855 1.627333
C 1.387434 -0.548158 -1.662488
H -1.824348 2.095008 -2.026382
H -0.370263 2.018266 -0.988766
H -1.767084 -0.346975 -2.457489
H -1.651524 -1.536969 -1.136268
H 2.128616 0.430317 0.666214
H 3.604985 1.325534 0.146958
H 5.463605 -0.014917 -1.026382
H 5.177218 -1.778611 -1.270329
H 3.753668 0.874149 2.585280
H 3.441693 -0.886603 2.308553
H 5.219621 -2.176642 1.177008
H 6.716897 -1.274673 0.705736
H 3.180613 -1.368192 -2.420839
H 3.188058 0.410333 -2.232192
H -3.134300 3.163202 -0.128968
H -1.673397 3.089709 0.915957
H -1.688040 4.116392 -0.537900
H -5.069443 -0.479459 0.310881
H -1.728376 -0.709456 2.689999


