%chk=000101371.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000101371

0 1
 O  -0.1429000       1.812200      -1.775200    
 O    4.544700      -2.533200     -0.3308000    
 O   -4.716700      -2.242200     -0.4742000    
 C  -1.1000000E-03  0.7221000      0.4252000    
 C  -0.1087000       1.283300       1.885700    
 C    1.254800     -0.1776000      0.2168000    
 C   -1.302700     -9.5799997E-02  0.1764000    
 C   0.2012000       1.903000     -0.5937000    
 C   0.9539000       3.142900     -0.1104000    
 C   -1.292100       2.210700       2.167200    
 C    1.428900     -0.7409000      -1.011300    
 C   -1.270600      -1.431100      0.4478000    
 C    2.095800     -0.3407000       1.275900    
 C   -2.390600      0.5761000     -0.2959000    
 C    1.097400       4.196500      -1.196700    
 C    2.552900      -1.545300      -1.198500    
 C   -2.436500      -2.163900      0.2259000    
 C    3.219900      -1.145200       1.088900    
 C   -3.556500     -0.1567000     -0.5179000    
 C    3.448400      -1.747600     -0.1482000    
 C   -3.579500      -1.526700     -0.2570000    
 H  -0.1791000      0.4572000       2.607500    
 H   0.7940000       1.847900       2.150800    
 H   0.4402000       3.610600      0.7285000    
 H    1.951200       2.830500      0.2163000    
 H   -1.123700       2.743400       3.109700    
 H   -1.463400       2.957200       1.389300    
 H   -2.216000       1.637500       2.295500    
 H   0.7402000     -0.6045000      -1.837500    
 H  -0.4180000      -1.955800      0.8619000    
 H    1.972600      9.3599997E-02   2.257900    
 H   -2.404500       1.641600     -0.4927000    
 H   0.1170000       4.535500      -1.547100    
 H    1.643800       5.064800     -0.8155000    
 H    1.645200       3.801700      -2.058700    
 H    2.718400      -2.010700      -2.166400    
 H   -2.444400      -3.229100      0.4414000    
 H    3.914000      -1.300500       1.910600    
 H   -4.444900      0.3457000     -0.8911000    
 H    4.544200      -2.867300      -1.244300    
 H   -4.553100      -3.172300     -0.2415000    


%chk=000101371-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000101371

0 1
O -0.389880 2.003377 -1.670890
O 4.704365 -2.344706 -0.468397
O -4.888285 -2.363066 -0.397560
C -0.096556 0.791027 0.469896
C -0.212087 1.304287 1.946847
C 1.195567 -0.051771 0.252078
C -1.349940 -0.055730 0.147059
C 0.122734 1.990170 -0.520919
C 1.073757 3.109461 -0.079662
C -1.454691 2.171610 2.237077
C 1.423839 -0.619908 -1.030133
C -1.382746 -1.416498 0.544785
C 2.170478 -0.272725 1.258714
C -2.531639 0.493610 -0.419021
C 1.507160 4.025824 -1.237564
C 2.574869 -1.383578 -1.300964
C -2.538362 -2.209407 0.381609
C 3.328107 -1.038142 1.004659
C -3.692746 -0.284942 -0.594267
C 3.531597 -1.593560 -0.277048
C -3.697779 -1.639117 -0.194200
H -0.235354 0.416242 2.608320
H 0.697397 1.873527 2.216842
H 0.563293 3.703219 0.707122
H 1.953849 2.652587 0.413048
H -1.439205 2.519972 3.285792
H -1.497583 3.067341 1.588866
H -2.387237 1.603695 2.080737
H 0.683423 -0.460304 -1.821819
H -0.488025 -1.871988 0.983692
H 2.037322 0.139894 2.263005
H -2.546851 1.534497 -0.749721
H 0.631527 4.479295 -1.731652
H 2.164154 4.832912 -0.866921
H 2.054648 3.454004 -2.006832
H 2.726198 -1.811145 -2.300883
H -2.531723 -3.261162 0.697602
H 4.076023 -1.214608 1.783444
H -4.596870 0.138937 -1.041197
H 4.756077 -2.687845 -1.394904
H -4.785126 -3.298386 -0.092039


