%chk=000124164.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000124164

0 1
 O  -2.0600000E-02  0.8873000      0.2751000    
 O   -2.121000     -0.8814000       1.180100    
 O   0.5024000      -1.876600      -1.116600    
 O   -3.143300       1.042100      -1.609000    
 O   0.3681000      -4.273200      0.2387000    
 O   -4.087000       1.469000      0.8426000    
 N    3.410000      0.5371000     -0.1349000    
 C   -1.070700      0.4255000     -0.5833000    
 C   -1.476400     -0.9760000     -9.4700001E-02
 C  -0.3265000      -1.983700      4.9899999E-02
 C   -2.179300       1.484000     -0.6592000    
 C   0.7827000       1.855600     -0.3768000    
 C    1.878600       2.309800      0.5777000    
 C  -0.7812000      -3.436300      0.1420000    
 C    2.755900       1.142500       1.018700    
 C   -2.899200       1.713100      0.6539000    
 C    3.884800     -0.8094000      0.1892000    
 C    4.522900       1.370800     -0.5932000    
 H  -0.6737000      0.2920000      -1.599800    
 H   -2.211600      -1.377100     -0.8030000    
 H   0.2979000      -1.739600      0.9177000    
 H   -1.816200       2.456500     -0.9975000    
 H   0.1945000       2.738200     -0.6427000    
 H    1.210800       1.443300      -1.297600    
 H    2.463200       3.116700      0.1249000    
 H    1.410100       2.730200       1.476900    
 H   -1.330100      -3.732600     -0.7580000    
 H   -1.407400      -3.606700       1.022300    
 H    3.485900       1.482000       1.765100    
 H    2.121600      0.4071000       1.530600    
 H   -2.539500      -1.738300       1.366800    
 H   -2.280000       2.139300       1.462200    
 H    1.237100      -2.504900      -1.009800    
 H   -3.559800      0.2309000      -1.273100    
 H    3.049700      -1.453900      0.4850000    
 H    4.620500     -0.8027000       1.001600    
 H    4.343000      -1.277800     -0.6890000    
 H    4.181200       2.346800     -0.9501000    
 H    5.021500      0.8997000      -1.448400    
 H    5.274300       1.528700      0.1892000    
 H   4.8500001E-02  -5.190100      0.2916000    


%chk=000124164-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000124164

0 1
O -0.231198 1.388828 -0.076155
O -1.694482 -1.174721 0.911104
O 0.427809 -1.310700 -2.107085
O -3.767138 0.493197 -0.600202
O 1.469138 -3.454826 -0.783783
O -3.658829 1.090839 2.011553
N 2.977744 0.116559 0.531349
C -1.308666 0.647090 -0.739541
C -1.278296 -0.881281 -0.476164
C 0.109151 -1.500728 -0.675988
C -2.605288 1.259752 -0.161128
C 0.908070 1.738374 -0.956455
C 1.988411 2.370263 -0.073749
C 0.127818 -2.996214 -0.347581
C 2.501087 1.425679 1.036741
C -2.597142 1.334493 1.370607
C 3.146583 -0.876680 1.612543
C 4.179628 0.206614 -0.319984
H -1.268761 0.805512 -1.835510
H -1.988030 -1.345352 -1.190262
H 0.870562 -0.978279 -0.063697
H -2.667368 2.311194 -0.523372
H 0.559269 2.460076 -1.726998
H 1.277697 0.826319 -1.458669
H 2.818576 2.701844 -0.727878
H 1.583990 3.280288 0.410429
H -0.664489 -3.526214 -0.917629
H -0.019975 -3.149901 0.736492
H 3.296104 1.958258 1.622226
H 1.661843 1.223946 1.726754
H -2.686033 -1.199868 0.928222
H -1.662411 1.676218 1.854391
H 1.208843 -1.900372 -2.283154
H -4.445661 0.580761 0.131309
H 2.213130 -0.947585 2.199404
H 3.979476 -0.626028 2.317259
H 3.347952 -1.869689 1.171614
H 3.988718 0.851676 -1.194889
H 4.438718 -0.799677 -0.694820
H 5.071055 0.615086 0.222429
H 1.534097 -4.436854 -0.694630


