%chk=000028544.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000028544

0 1
 O    3.029700      0.2813000      4.5100000E-02
 C   -1.098900     -0.4600000     -2.1199999E-02
 C  -0.5197000      0.9275000      0.4030000    
 C   0.8377000       1.202800     -0.2569000    
 C  -2.2200000E-02  -1.526000      9.2799999E-02
 C   -1.624900     -0.4740000      -1.468500    
 C   -2.256500     -0.8511000      0.9215000    
 C   -1.457000       2.113400      0.1488000    
 C    1.817000      8.2199998E-02  2.6000000E-03
 C    1.294800      -1.296000      0.1328000    
 H  -0.3439000      0.8930000       1.489300    
 H    1.264500       2.122600      0.1609000    
 H   0.7452000       1.335500      -1.340200    
 H  -0.3516000      -2.562500      0.1387000    
 H  -0.8520000     -0.1802000      -2.186800    
 H   -1.969800      -1.475300      -1.755400    
 H   -2.476100      0.2034000      -1.595300    
 H   -3.102100     -0.1615000      0.8336000    
 H   -2.637900      -1.853800      0.6923000    
 H   -1.934400     -0.8552000       1.969500    
 H   -1.022200       3.034500      0.5531000    
 H   -1.626500       2.275800     -0.9202000    
 H   -2.426500       1.974600      0.6350000    
 H    2.007900      -2.106900      0.2236000    


%chk=000028544-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000028544

0 1
O 3.118661 0.296897 0.045208
C -1.113856 -0.462037 -0.011015
C -0.521933 0.932367 0.410506
C 0.855994 1.193716 -0.251268
C -0.029492 -1.530376 0.104392
C -1.630899 -0.470628 -1.484129
C -2.283939 -0.860858 0.932605
C -1.468474 2.126240 0.154997
C 1.870373 0.076796 -0.003464
C 1.314856 -1.290025 0.130241
H -0.349866 0.866006 1.506912
H 1.291535 2.145101 0.104620
H 0.734512 1.298776 -1.350290
H -0.389120 -2.569816 0.160951
H -0.852644 -0.139003 -2.194256
H -1.940286 -1.490329 -1.779926
H -2.509524 0.190824 -1.592433
H -3.123011 -0.147118 0.851175
H -2.673588 -1.863049 0.671958
H -1.953571 -0.886628 1.987471
H -1.030104 3.052887 0.569601
H -1.629786 2.292808 -0.926098
H -2.455260 1.985201 0.631185
H 2.044022 -2.103654 0.229158


