%chk=000076352.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000076352

0 1
 O    3.356300      -1.507000     -0.2932000    
 O  -0.3604000       3.635400     -0.2821000    
 O   -2.980500      -2.128800     -0.3047000    
 O    5.039700     -0.3677000      0.8047000    
 O   -2.210400       4.518300      0.7833000    
 O   -2.883800      -4.136300      0.8345000    
 N   9.9999998E-03 -1.2200000E-02  9.7599998E-02
 C    1.030800     -0.9518000     -0.3647000    
 C   0.3226000       1.344000     -0.3517000    
 C   -1.311400     -0.4171000     -0.3804000    
 C    2.400700     -0.5597000      0.1655000    
 C  -0.7123000       2.331900      0.1629000    
 C   -1.685800      -1.784000      0.1702000    
 C    4.647200      -1.290100      0.1030000    
 C   -1.201400       4.643000      0.1024000    
 C   -3.462400      -3.340700      0.1068000    
 C    5.537400      -2.360800     -0.4512000    
 C  -0.7082000       5.952000     -0.4353000    
 C   -4.827900      -3.568300     -0.4674000    
 H   0.8601000      -1.967200      4.6000001E-03
 H    1.059800      -1.020600      -1.460500    
 H    1.276200       1.705200      4.4199999E-02
 H   0.3924000       1.409700      -1.445700    
 H   -2.107800      0.2461000     -3.2000002E-02
 H   -1.369300     -0.4220000      -1.477100    
 H    2.399300     -0.5429000       1.262300    
 H    2.730200      0.4109000     -0.2138000    
 H  -0.7488000       2.316600       1.259100    
 H   -1.709900       2.137300     -0.2381000    
 H   -1.691300      -1.768000       1.267000    
 H   -1.010700      -2.570000     -0.1773000    
 H    6.567100      -2.178600     -0.1305000    
 H    5.222400      -3.336600     -7.3299997E-02
 H    5.504300      -2.341400      -1.543400    
 H   -1.387000       6.751100     -0.1238000    
 H   0.2867000       6.164900     -3.6400001E-02
 H  -0.6868000       5.919300      -1.527400    
 H   -5.204600      -4.539500     -0.1339000    
 H   -5.511300      -2.790700     -0.1170000    
 H   -4.774900      -3.571500      -1.559000    


%chk=000076352-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000076352

0 1
O 3.408399 -1.549166 -0.340779
O -0.358198 3.715408 -0.336773
O -3.031452 -2.158083 -0.349435
O 4.682383 -0.663571 1.398097
O -1.813725 4.360553 1.365473
O -2.898779 -3.728616 1.367444
N 0.013530 0.001389 -0.652299
C 1.191589 -0.828277 -0.991160
C 0.144329 1.437993 -0.985198
C -1.294123 -0.602482 -0.993845
C 2.254077 -0.719498 0.109921
C -0.487957 2.299941 0.115126
C -1.732064 -1.582182 0.102333
C 4.581910 -1.434680 0.418041
C -1.077337 4.666255 0.401366
C -3.519065 -3.240265 0.396876
C 5.648570 -2.374539 -0.099708
C -0.806852 6.062289 -0.115494
C -4.870290 -3.682613 -0.120556
H 0.877874 -1.883931 -1.076972
H 1.643814 -0.546689 -1.969527
H 1.215755 1.694553 -1.065654
H -0.321573 1.692262 -1.964700
H -2.051475 0.197329 -1.077125
H -1.276480 -1.130861 -1.974495
H 1.877536 -1.109760 1.071696
H 2.596162 0.319436 0.266932
H 0.039345 2.176036 1.077202
H -1.556863 2.068224 0.272588
H -1.877846 -1.066442 1.067616
H -1.006966 -2.402463 0.252523
H 6.644170 -1.947016 0.094551
H 5.579177 -3.336633 0.440560
H 5.515249 -2.574566 -1.173664
H -1.691978 6.695604 0.049624
H 0.036500 6.501778 0.448391
H -0.534840 6.046093 -1.181713
H -4.995200 -4.763219 0.048526
H -5.664487 -3.156265 0.440287
H -4.986519 -3.441124 -1.187877


