%chk=000124522.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000124522

0 1
 O    4.534200       1.288600      0.1108000    
 O    1.836800      -3.484900     -0.3226000    
 O   -5.629800       1.238300      0.2144000    
 N  -0.5415000     -0.9652000     -0.2114000    
 C   0.7520000     -0.4054000     -0.1241000    
 C    1.827200      -1.162000      0.3421000    
 C    3.098300     -0.5930000      0.4211000    
 C   0.9478000      0.9202000     -0.5113000    
 C   -1.829200     -0.4080000     -0.1036000    
 C    1.646000      -2.584200      0.7630000    
 C    3.294100      0.7328000      3.3799998E-02
 C    2.218800       1.489200     -0.4323000    
 C   -2.897000     -0.9695000     -0.8069000    
 C   -2.043400      0.7092000      0.7066000    
 C   -4.173100     -0.4163000     -0.7006000    
 C   -3.319600       1.262300      0.8130000    
 C   -4.384500      0.6995000      0.1093000    
 C    4.663000       2.648400     -0.3014000    
 H  -0.5453000      -1.947600     -0.4698000    
 H    3.942500      -1.176200      0.7810000    
 H   0.1348000       1.526400     -0.9014000    
 H    2.373400      -2.839900       1.543100    
 H   0.6590000      -2.760200       1.204100    
 H    2.301400       2.521800     -0.7542000    
 H   -2.745700      -1.838500      -1.442300    
 H   -1.238300       1.154900       1.284500    
 H   -4.994300     -0.8641000      -1.253900    
 H   -3.479200       2.128400       1.449600    
 H    1.718400      -4.384000      2.8600000E-02
 H    4.074600       3.319100      0.3339000    
 H    4.427800       2.770700      -1.364200    
 H    5.714000       2.927000     -0.1728000    
 H   -6.243300      0.7239000     -0.3380000    


%chk=000124522-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000124522

0 1
O 4.678275 1.274040 0.079390
O 0.989078 -3.326282 -0.334353
O -5.755211 1.151584 0.103790
N -0.509709 -0.997164 -0.129117
C 0.742188 -0.348014 -0.049843
C 1.884175 -1.139905 0.310580
C 3.165512 -0.559516 0.319867
C 0.941113 1.019722 -0.368725
C -1.799969 -0.425937 -0.092956
C 1.701629 -2.574833 0.744872
C 3.348546 0.810173 0.013762
C 2.227048 1.601819 -0.328766
C -2.873627 -1.121382 -0.716461
C -2.096148 0.786360 0.596563
C -4.193547 -0.628398 -0.657686
C -3.410227 1.288342 0.642813
C -4.463573 0.586519 0.014809
C 4.907608 2.678933 -0.254289
H -0.431892 -1.998715 -0.357676
H 4.046790 -1.156936 0.577547
H 0.091796 1.631065 -0.685836
H 2.684940 -3.041024 0.943566
H 1.083436 -2.615024 1.668192
H 2.337330 2.659756 -0.585726
H -2.668526 -2.052282 -1.258415
H -1.302561 1.321988 1.125394
H -5.003237 -1.186388 -1.146585
H -3.637433 2.217118 1.175016
H 0.867423 -4.266785 -0.048192
H 4.363739 3.353476 0.436849
H 4.607000 2.901942 -1.297332
H 5.991436 2.830506 -0.141543
H -6.413503 0.586941 -0.371411


