%chk=000150404.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000150404

0 1
 O    5.936000      8.8100001E-02 -0.5517000    
 O    4.605900      -2.320800     -0.4308000    
 N    2.489200      0.4682000      0.7347000    
 C    3.739200     -0.2340000      0.4946000    
 C  -0.6692000      0.8926000     -0.2002000    
 C   -1.033900     -0.5173000     -0.2108000    
 C   -1.871500       1.633600     -1.1500000E-02
 C   0.5496000       1.529700     -0.3338000    
 C   -2.408000     -0.6011000     -3.3799998E-02
 C   -2.956700      0.6677000      9.0800002E-02
 C    1.831200      0.7990000     -0.5317000    
 C   -3.133300      -1.789700      1.2000000E-02
 C    4.663500      0.6848000     -0.3297000    
 C    3.423100      -1.556800     -0.2295000    
 C    4.371300     -0.5496000       1.858800    
 C   0.5624000       2.926300     -0.2775000    
 C   -1.859100       3.014200      4.4100001E-02
 C  -0.3017000      -1.680900     -0.3553000    
 C   -4.320600      0.7961000      0.2753000    
 C  -0.6260000       3.658800     -9.1100000E-02
 C   -2.383100      -2.972600     -0.1357000    
 C   -4.522700      -1.653900      0.2001000    
 C  -0.9844000      -2.909800     -0.3167000    
 C   -5.101100     -0.3726000      0.3293000    
 H    1.649200     -2.7799999E-02  -1.215300    
 H    2.446600       1.491800      -1.114700    
 H    1.866900     -0.1143000       1.295300    
 H    4.833200       1.638800      0.1825000    
 H    4.287000      0.9015000      -1.332000    
 H    2.739300      -2.175700      0.3612000    
 H    3.011700      -1.417700      -1.230600    
 H    4.564100      0.3685000       2.427000    
 H    5.327900      -1.073300       1.754900    
 H    3.716000      -1.183100       2.468900    
 H    1.497000       3.475100     -0.3733000    
 H   -2.767600       3.588400      0.1875000    
 H   0.7629000      -1.702700     -0.4984000    
 H   -4.790100       1.768900      0.3774000    
 H  -0.5816000       4.744400     -5.0799999E-02
 H   -2.874300      -3.942000     -0.1115000    
 H   -5.159700      -2.533500      0.2472000    
 H  -0.4230000      -3.834300     -0.4293000    
 H   -6.175600     -0.2885000      0.4739000    
 H    5.798500     -0.7140000      -1.083100    
 H    4.342800      -3.147800     -0.8695000    


%chk=000150404-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000150404

0 1
O 6.188362 0.077777 -0.118203
O 4.944446 -2.293224 -0.452498
N 2.456764 0.416703 0.434022
C 3.754151 -0.303777 0.427696
C -0.697000 0.938836 -0.279756
C -1.045196 -0.511073 -0.298826
C -1.905182 1.674877 0.022538
C 0.521899 1.625698 -0.495400
C -2.449954 -0.590996 -0.017466
C -3.015395 0.707566 0.184040
C 1.822992 0.900835 -0.814050
C -3.189153 -1.798851 0.058360
C 4.826124 0.571804 -0.297009
C 3.605909 -1.673656 -0.305624
C 4.162942 -0.534361 1.898100
C 0.511601 3.043427 -0.394098
C -1.892438 3.077375 0.112883
C -0.354446 -1.713678 -0.504892
C -4.381289 0.804750 0.469840
C -0.668869 3.760760 -0.095715
C -2.453783 -3.013422 -0.166162
C -4.591669 -1.674107 0.352562
C -1.077515 -2.954401 -0.437362
C -5.156810 -0.403451 0.549266
H 1.613849 0.095046 -1.559816
H 2.511249 1.609911 -1.308288
H 1.787269 0.055076 1.122216
H 4.801724 1.585159 0.138270
H 4.583025 0.643657 -1.381736
H 2.945273 -2.338606 0.289953
H 3.161614 -1.513073 -1.311132
H 4.302815 0.436099 2.403447
H 5.105799 -1.100426 1.958357
H 3.376337 -1.100911 2.434771
H 1.450918 3.587134 -0.548126
H -2.806747 3.636310 0.339289
H 0.719353 -1.738442 -0.712094
H -4.871503 1.770642 0.634527
H -0.635655 4.853515 -0.027734
H -2.965950 -3.981792 -0.122397
H -5.217865 -2.571187 0.423386
H -0.526953 -3.887533 -0.603915
H -6.226723 -0.324299 0.773166
H 6.158337 -0.897573 -0.334677
H 4.888641 -3.131416 -0.972512


