%chk=000037269.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000037269

0 1
 O    2.938800      0.2287000      0.7810000    
 O   0.1807000     -0.6099000      -1.035000    
 O   -1.128200      -2.452000      -1.178600    
 O   -3.402900      -2.503900      8.7399997E-02
 O   -5.338400       1.700300       1.132400    
 C    2.874000      0.3614000     -0.6428000    
 C    4.176200      0.9603000      -1.177700    
 C    1.685000       1.253200     -0.9727000    
 C    5.372700      0.1202000     -0.7428000    
 C   0.3870000      0.6822000     -0.4200000    
 C    3.983700     -0.6545000       1.202000    
 C    5.344700     -0.1096000      0.7647000    
 C  -0.7933000       1.593200     -0.7239000    
 C   -2.035200      0.9074000     -0.2406000    
 C    3.904800     -0.7787000       2.717300    
 C   -2.117200     -0.4890000     -0.3062000    
 C  -0.9930000      -1.276600     -0.8655000    
 C   -3.127700       1.640500      0.2355000    
 C   -3.276200      -1.147200      0.1173000    
 C   -4.281400      0.9827000      0.6624000    
 C   -4.354100     -0.4085000      0.6058000    
 H    2.724400     -0.6333000      -1.082200    
 H    1.613700       1.362200      -2.062100    
 H    1.840700       2.251700     -0.5448000    
 H    4.306300       1.975700     -0.7817000    
 H    4.147600       1.034100      -2.270400    
 H    6.305800      0.6166000      -1.030800    
 H    5.348200     -0.8466000      -1.260500    
 H   0.4721000      0.5241000      0.6633000    
 H    3.809300      -1.643600      0.7599000    
 H    6.147200     -0.7971000       1.054300    
 H    5.535900      0.8493000       1.263500    
 H  -0.8942000       1.764500      -1.802500    
 H  -0.6610000       2.560800     -0.2271000    
 H    2.923000      -1.161200       3.017000    
 H    4.674800      -1.454100       3.102100    
 H    4.020700      0.1986000       3.198600    
 H   -3.073000       2.725800      0.2740000    
 H   -5.259500     -0.9083000      0.9423000    
 H   -4.279400      -2.756000      0.4251000    
 H   -5.116300       2.646700       1.101000    


%chk=000037269-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000037269

0 1
O 2.990054 0.367282 0.842162
O 0.140673 -0.551971 -1.304770
O -1.233868 -2.293988 -1.822265
O -3.460176 -2.539869 -0.196134
O -5.376688 1.578082 1.418045
C 2.898617 0.345721 -0.638113
C 4.231150 0.804806 -1.262100
C 1.711722 1.252333 -0.989618
C 5.397361 -0.078440 -0.756644
C 0.378006 0.687834 -0.494161
C 4.043833 -0.543501 1.350803
C 5.419647 -0.121075 0.790357
C -0.821067 1.624340 -0.681760
C -2.089738 0.916641 -0.239248
C 3.956365 -0.484475 2.876908
C -2.189435 -0.489065 -0.471368
C -1.115830 -1.206254 -1.223630
C -3.133086 1.628562 0.382522
C -3.371035 -1.161574 -0.023706
C -4.298444 0.939200 0.794097
C -4.419089 -0.449671 0.601032
H 2.676800 -0.694773 -0.965659
H 1.662026 1.389984 -2.086319
H 1.878903 2.242491 -0.521970
H 4.413151 1.862965 -0.985043
H 4.158112 0.753829 -2.366038
H 6.362260 0.296391 -1.146387
H 5.270437 -1.108456 -1.149569
H 0.476300 0.381956 0.565733
H 3.811694 -1.574272 0.993012
H 6.195331 -0.826367 1.147761
H 5.668506 0.881765 1.191374
H -0.888257 1.910505 -1.751542
H -0.670865 2.551205 -0.099383
H 2.951644 -0.787341 3.219022
H 4.702059 -1.159321 3.335070
H 4.147510 0.544267 3.231657
H -3.032929 2.708011 0.551102
H -5.328072 -0.954684 0.946279
H -4.316862 -2.881810 0.166273
H -5.210423 2.548836 1.511216


