%chk=000028568.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000028568

0 1
 O    1.368800      -2.394700      2.5100000E-02
 O    3.184700      0.1566000      -1.210800    
 O    3.358100      0.1684000       1.055500    
 C   -3.062000     -0.3579000     -9.3000000E-03
 C   -1.576000     -0.2334000      2.6000000E-03
 C  -0.9819000       1.028500      1.0200000E-02
 C   0.4080000       1.145200      2.2900000E-02
 C   -3.694200      0.2553000      -1.273200    
 C   -3.714100      0.2489000       1.247600    
 C  -0.7800000      -1.378800      7.7000000E-03
 C    1.204100     -1.9999999E-04  2.7899999E-02
 C   0.6100000      -1.262400      2.0300001E-02
 C    1.016000       2.509900      3.1300001E-02
 C    2.658400      0.1146000      4.1999999E-02
 H   -3.329200      -1.423500     -1.4200000E-02
 H   -1.598200       1.924100      6.5000001E-03
 H   -1.240600      -2.363900      2.0999999E-03
 H   -3.549200       1.339900      -1.319300    
 H   -4.772200      6.2100001E-02  -1.295200    
 H   -3.256000     -0.1806000      -2.177900    
 H   -3.290200     -0.1918000       2.156800    
 H   -4.792300      5.5799998E-02   1.251600    
 H   -3.569600       1.333200       1.301600    
 H    1.638200       2.647800      0.9218000    
 H    1.626000       2.663800     -0.8649000    
 H   0.2538000       3.296700      4.4500001E-02
 H   0.7830000      -3.171000      1.8400000E-02
 H    4.162400      0.2343000      -1.193900    


%chk=000028568-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000028568

0 1
O 1.459749 -2.359549 -0.056085
O 3.352624 -0.562884 -1.030045
O 3.387301 0.978429 0.693360
C -3.133557 -0.378433 -0.019753
C -1.610729 -0.227826 -0.019401
C -0.998394 1.050589 0.035333
C 0.405067 1.211567 0.035373
C -3.768902 0.286342 -1.270636
C -3.762230 0.183482 1.283586
C -0.779216 -1.366184 -0.066645
C 1.240379 0.051761 -0.041231
C 0.629041 -1.231440 -0.074178
C 0.994079 2.610067 0.094374
C 2.723323 0.209392 -0.046465
H -3.365153 -1.462143 -0.062764
H -1.624849 1.948628 0.076835
H -1.228626 -2.368768 -0.091689
H -3.587539 1.376971 -1.275957
H -4.862858 0.125238 -1.278991
H -3.348847 -0.130536 -2.203494
H -3.336687 -0.306180 2.177799
H -4.855956 0.020802 1.285171
H -3.582093 1.270396 1.375764
H 1.584721 2.752501 1.015602
H 1.685375 2.800409 -0.747223
H 0.194662 3.368866 0.060525
H 0.917757 -3.187668 -0.068962
H 4.337359 -0.436929 -0.942503


