%chk=000133177.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133177

0 1
 O   -4.449500     -0.4976000     -0.9103000    
 O   -3.631300       2.271800      -1.254400    
 O   -1.875400       3.127300      0.8617000    
 O   -3.620000      -2.836300     -0.6322000    
 O    6.272200      0.2335000      -1.770200    
 O    6.124900      0.4806000      0.4825000    
 N   -1.015800     -0.4599000      0.5316000    
 C   -2.361500     -0.9880000      0.2088000    
 C   -3.106900     -3.1800002E-02 -0.7527000    
 C   -3.157100       1.402400     -0.2246000    
 C   -1.768300       1.876000      0.1846000    
 C   -1.104600      0.8802000       1.129600    
 C  -0.2658000      -1.337600       1.435300    
 C   -2.297100      -2.387600     -0.4311000    
 C    1.150400     -0.7996000       1.636500    
 C    1.948900     -0.6946000      0.3333000    
 C    3.391700     -0.2297000      0.5401000    
 C    4.162500     -0.2123000     -0.7803000    
 C    5.602700      0.2033000     -0.5882000    
 H   -2.955000      -1.073000       1.131600    
 H   -2.647200     -4.6500001E-02  -1.748900    
 H   -3.860900       1.496700      0.6114000    
 H   -1.148200       2.042500     -0.7054000    
 H  -0.1239000       1.313400       1.342600    
 H   -1.640600      0.8541000       2.088800    
 H  -0.7686000      -1.440200       2.405200    
 H  -0.1515000      -2.341900       1.018400    
 H   -1.813700      -3.133400      0.2029000    
 H   -1.780500      -2.366600      -1.396300    
 H    1.186800      0.1367000       2.200900    
 H    1.672300      -1.518800       2.283800    
 H    1.456900      4.0000002E-03 -0.3538000    
 H    1.954300      -1.674200     -0.1614000    
 H   -4.873400     -0.4948000     -3.5100002E-02
 H   -4.503600       1.943100      -1.531700    
 H  -0.9747000       3.423300       1.078300    
 H    3.397200      0.7713000      0.9889000    
 H    3.893700     -0.8974000       1.251200    
 H   -4.049600      -2.900100      0.2378000    
 H    4.156500      -1.212300      -1.228100    
 H    3.692400      0.4932000      -1.474300    
 H    7.208500      0.5017000      -1.653000    


%chk=000133177-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000133177

0 1
O -4.225415 -0.414788 -1.189892
O -4.014501 2.388036 -0.885212
O -2.494452 3.309239 1.388492
O -2.798010 -2.721040 -1.303274
O 6.131496 -0.541128 -2.204719
O 6.284735 0.041556 0.036854
N -1.049081 -0.122449 0.881397
C -2.195227 -0.828640 0.235277
C -2.970286 0.158657 -0.690492
C -3.374604 1.441474 0.034700
C -2.135622 2.123715 0.607170
C -1.435400 1.148581 1.558743
C -0.234833 -0.952689 1.821285
C -1.676903 -1.996869 -0.649307
C 1.262551 -0.568258 1.813738
C 1.955328 -0.853696 0.464603
C 3.442436 -0.439784 0.458531
C 4.114319 -0.715806 -0.899728
C 5.587669 -0.359156 -0.920422
H -2.925837 -1.234068 0.986681
H -2.303064 0.425202 -1.540378
H -4.074562 1.183759 0.859642
H -1.462018 2.399215 -0.231716
H -0.524344 1.629126 1.952933
H -2.114641 0.964671 2.428587
H -0.635957 -0.865845 2.859857
H -0.319078 -2.019068 1.546564
H -1.059110 -2.718725 -0.086293
H -1.074885 -1.591959 -1.478781
H 1.374661 0.505063 2.064566
H 1.770729 -1.131544 2.623552
H 1.404422 -0.316595 -0.332465
H 1.873851 -1.938109 0.233466
H -3.997909 -1.312880 -1.570432
H -4.716388 1.886910 -1.376258
H -3.113114 3.846526 0.828533
H 3.533020 0.636951 0.699912
H 3.991977 -0.977556 1.254936
H -3.214931 -3.338588 -0.651705
H 4.025698 -1.785718 -1.176001
H 3.615483 -0.157177 -1.715296
H 7.098998 -0.305646 -2.183849


