%chk=000043807.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000043807

0 1
 O  -0.8348000      -1.338300       2.115100    
 O   0.2828000       3.599300     -0.5599000    
 O  -0.7267000       2.949700       1.359300    
 N    1.901000       1.308300     -0.4629000    
 C   0.2923000      0.1629000      0.5505000    
 C    1.284500     -0.7575000      0.1109000    
 C  -0.9520000     -0.1799000       1.272400    
 C    2.282500     -1.3100000E-02 -0.5216000    
 C   0.6996000       1.424700      0.1833000    
 C   -2.034900     -0.3997000      0.2245000    
 C    1.429700      -2.156800      0.1907000    
 C    3.423100     -0.6005000      -1.080500    
 C    2.661600       2.414900      -1.006200    
 C   2.4800001E-02   2.667200      0.4120000    
 C    2.565300      -2.758100     -0.3640000    
 C    3.545500      -1.989900     -0.9893000    
 C   -2.736800      0.6905000     -0.2466000    
 C   -2.279900      -1.681900     -0.2215000    
 C   0.1684000      -1.151000       3.095800    
 C   -3.728600      0.4894000      -1.206400    
 C   -3.271700      -1.882800      -1.181600    
 C   -3.995900     -0.7972000      -1.674000    
 H   -1.279100      0.6331000       1.931000    
 H   0.6820000      -2.787100      0.6614000    
 H    4.192900     -1.8500000E-02  -1.574700    
 H    2.201300       2.726200      -1.947000    
 H    2.692900       3.227400     -0.2757000    
 H    3.691900       2.106900      -1.194700    
 H    2.681600      -3.837200     -0.3078000    
 H    4.418700      -2.478100      -1.414700    
 H   -2.563100       1.695200      0.1179000    
 H   -1.729200      -2.542800      0.1425000    
 H   0.1331000      -2.011400       3.771400    
 H  -3.7700001E-02 -0.2568000       3.694100    
 H    1.183100      -1.099500       2.699400    
 H   -4.296300       1.333800      -1.586200    
 H   -3.479700      -2.884500      -1.546400    
 H   -4.768800     -0.9538000      -2.420800    
 H  -0.1872000       4.442700     -0.3861000    


%chk=000043807-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000043807

0 1
O -0.793330 -1.206042 2.132823
O 1.053214 3.935053 0.581658
O -0.962642 2.939302 1.138206
N 2.062937 1.447527 -0.433245
C 0.293487 0.261243 0.475380
C 1.236610 -0.673295 -0.081267
C -1.007200 -0.103914 1.174762
C 2.323571 0.090588 -0.639932
C 0.824903 1.555675 0.255410
C -2.085451 -0.556830 0.181413
C 1.262733 -2.095217 -0.158524
C 3.422851 -0.537605 -1.277180
C 2.928346 2.535411 -0.913880
C 0.208408 2.808281 0.685285
C 2.349575 -2.715287 -0.792274
C 3.418359 -1.941757 -1.345482
C -2.617329 0.385036 -0.734954
C -2.566131 -1.887034 0.167374
C 0.024245 -0.809345 3.279779
C -3.609897 -0.002998 -1.660963
C -3.559719 -2.274110 -0.761502
C -4.082607 -1.336701 -1.680876
H -1.380527 0.788564 1.716568
H 0.448324 -2.677953 0.279202
H 4.257067 0.032799 -1.697517
H 2.336571 3.297647 -1.442697
H 3.452913 3.030150 -0.079653
H 3.667740 2.111694 -1.610803
H 2.388334 -3.807363 -0.865620
H 4.256075 -2.456341 -1.829666
H -2.262884 1.422136 -0.711160
H -2.172432 -2.598800 0.898168
H 0.041933 -1.681279 3.952528
H -0.422183 0.059036 3.808006
H 1.060245 -0.555804 2.976563
H -4.017788 0.734170 -2.362207
H -3.927476 -3.306841 -0.763730
H -4.852984 -1.638126 -2.399902
H 0.538339 4.724128 0.903510


