%chk=000226432.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000226432

0 1
 O    1.997600       1.738800      0.2423000    
 O    2.994400     -0.8127000     -0.2311000    
 O  -0.6728000       2.067700      0.3820000    
 O    1.171900      -2.863400     -0.5337000    
 O   -3.407700       1.626900       1.499700    
 O   -3.472700       2.002600     -0.6622000    
 N   -3.189900       1.275100      0.3174000    
 C   -1.217700     -0.2145000     -5.0000002E-04
 C  -0.7257000      -1.498500     -0.2387000    
 C    1.162500      0.6503000      7.8299999E-02
 C    1.634900     -0.5816000     -0.1501000    
 C  -0.2933000      0.9217000      0.1695000    
 C   0.7268000      -1.740900     -0.3242000    
 C   -2.598600      1.3000000E-03  7.8299999E-02
 C   -1.614500      -2.568300     -0.3986000    
 C   -3.481200      -1.067200     -8.1699997E-02
 C   -2.990100      -2.349400     -0.3198000    
 C    2.260300       2.359000      -1.000500    
 C    3.525800      -1.122400       1.041700    
 C    3.176100       3.543400     -0.7767000    
 C    5.013700      -1.367800      0.9085000    
 H   -1.256200      -3.577200     -0.5849000    
 H   -4.557200     -0.9190000     -2.3900000E-02
 H   -3.679100      -3.179900     -0.4440000    
 H    2.749000       1.657000      -1.687500    
 H    1.329200       2.709800      -1.462500    
 H    3.363900     -0.2936000       1.741900    
 H    3.050100      -2.023100       1.448900    
 H    2.715100       4.263700     -9.2799999E-02
 H    4.115800       3.222200     -0.3151000    
 H    3.401500       4.047800      -1.720600    
 H    5.208200      -2.191600      0.2137000    
 H    5.515400     -0.4833000      0.5021000    
 H    5.458600      -1.611300       1.877500    


%chk=000226432-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000226432

0 1
O 2.134301 1.718744 -0.070113
O 3.047100 -0.699916 0.294045
O -0.707006 2.195604 0.217900
O 1.159187 -2.916142 0.559897
O -4.170746 1.766032 -0.037226
O -2.710599 1.838065 -1.794206
N -3.175224 1.312718 -0.716869
C -1.204095 -0.149744 -0.055320
C -0.724868 -1.459893 0.206112
C 1.189814 0.724587 0.021914
C 1.676401 -0.579133 0.238215
C -0.263397 1.014068 0.043234
C 0.746653 -1.721911 0.369484
C -2.591491 0.012771 -0.278589
C -1.616184 -2.553760 0.286570
C -3.496923 -1.064076 -0.176002
C -3.002259 -2.352939 0.113791
C 1.814147 3.075605 -0.634652
C 3.753760 -1.934832 0.769868
C 3.161344 3.704470 -0.971021
C 5.225457 -1.545584 0.854945
H -1.199385 -3.544581 0.490274
H -4.564785 -0.885405 -0.331544
H -3.696533 -3.195008 0.190568
H 1.173509 2.949290 -1.526183
H 1.253692 3.644268 0.123494
H 3.337777 -2.231828 1.748435
H 3.570341 -2.750544 0.051743
H 3.792263 3.782794 -0.069318
H 3.702432 3.109023 -1.725631
H 3.000893 4.721737 -1.373075
H 5.605775 -1.228986 -0.131135
H 5.375818 -0.718144 1.568719
H 5.816932 -2.415750 1.194374


