%chk=000069541.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000069541

0 1
 O    2.581800     -0.5745000      -1.025300    
 O    2.547800      0.4537000       1.085600    
 C    1.731000     -5.7999999E-03 -9.9999998E-03
 C   0.9975000       1.210700     -0.6112000    
 C   0.7891000      -1.112600      0.5112000    
 C   0.1979000       2.039800      0.4061000    
 C  -3.0099999E-02  -1.817700     -0.5795000    
 C   -1.004500       2.769000     -0.2097000    
 C   -1.154300      -2.704500     -2.2399999E-02
 C   -2.156100       1.845000     -0.6325000    
 C   -2.319900      -1.930000      0.6079000    
 C   -2.894900       1.213300      0.5542000    
 C   -3.172100      -1.168600     -0.4178000    
 C   -3.853900      8.2699999E-02  0.1529000    
 C    3.904700     -0.1908000     -0.6543000    
 C    3.835900     -0.1098000      0.8447000    
 H   0.3815000      0.8890000      -1.455200    
 H    1.742400       1.881000      -1.062800    
 H   0.1450000     -0.7040000       1.294000    
 H    1.393100      -1.878300       1.017300    
 H   0.8725000       2.792700      0.8342000    
 H  -0.1331000       1.432400       1.250800    
 H   0.6470000      -2.453900      -1.163300    
 H  -0.4483000      -1.096100      -1.283700    
 H  -0.6660000       3.337900      -1.084300    
 H   -1.383300       3.501800      0.5133000    
 H  -0.7329000      -3.384600      0.7279000    
 H   -1.543200      -3.333900     -0.8322000    
 H   -1.776200       1.080700      -1.313000    
 H   -2.878400       2.433900      -1.211900    
 H   -1.940600      -1.270500       1.391000    
 H   -2.972400      -2.647300       1.122500    
 H   -3.478000       1.998500       1.052400    
 H   -2.192100      0.8453000       1.304300    
 H   -3.953400      -1.849900     -0.7797000    
 H   -2.594400     -0.9001000      -1.304900    
 H   -4.445900     -0.2050000       1.030400    
 H   -4.563400      0.4667000     -0.5903000    
 H    4.114900      0.7865000      -1.101900    
 H    4.634900     -0.9185000      -1.016700    
 H    3.865700      -1.103500       1.304500    
 H    4.619300      0.5138000       1.282100    


%chk=000069541-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000069541

0 1
O 2.603607 -0.613644 -1.074752
O 2.640031 0.457132 1.055353
C 1.718731 -0.054615 -0.006507
C 0.932238 1.150228 -0.556187
C 0.873611 -1.215957 0.549516
C 0.129344 1.937734 0.510445
C 0.018909 -1.955738 -0.511368
C -1.013218 2.798210 -0.092416
C -1.170734 -2.745616 0.097305
C -2.212712 1.969545 -0.627926
C -2.316590 -1.844897 0.634027
C -3.061168 1.300566 0.485770
C -3.126767 -1.129488 -0.478636
C -3.931431 0.107851 0.004826
C 3.976679 -0.152719 -0.782625
C 3.984823 -0.074585 0.752511
H 0.258242 0.776790 -1.349148
H 1.655004 1.825382 -1.052449
H 0.229105 -0.807451 1.349299
H 1.563674 -1.930098 1.037579
H 0.828339 2.579232 1.078071
H -0.304017 1.239586 1.251292
H 0.675921 -2.638764 -1.080715
H -0.374195 -1.234207 -1.252498
H -0.602571 3.422054 -0.912989
H -1.380883 3.503367 0.681290
H -0.796024 -3.391368 0.918175
H -1.582057 -3.429182 -0.673798
H -1.830705 1.195747 -1.321809
H -2.868964 2.622866 -1.237523
H -1.885052 -1.093312 1.323289
H -3.008776 -2.454941 1.248831
H -3.720265 2.066550 0.942755
H -2.397442 0.954163 1.302001
H -3.825939 -1.858054 -0.937077
H -2.444323 -0.818063 -1.293517
H -4.604116 -0.201271 0.831651
H -4.589683 0.451356 -0.820106
H 4.163213 0.840708 -1.237639
H 4.668959 -0.899250 -1.203865
H 4.123422 -1.076341 1.206501
H 4.718376 0.634994 1.167760


