%chk=000013769.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000013769

0 1
 O   -3.666700      0.8997000      0.6478000    
 O   -5.469100     -0.1009000       1.554600    
 O    5.519700     -0.3535000       1.539500    
 C  -0.3714000     -0.6237000     -0.5424000    
 C   0.5412000      0.5399000     -3.2699998E-02
 C   -1.783400     -0.5319000      9.8999999E-02
 C   -2.464300      0.8223000     -0.1636000    
 C    2.009200      0.4615000     -0.6008000    
 C  -0.1503000       1.900900     -0.2727000    
 C   -1.548200       1.949800      0.3384000    
 C   0.2856000      -1.990000     -0.2666000    
 C   -2.721700      -1.669000     -0.3100000    
 C    2.542300     -0.9473000     -0.3322000    
 C    1.694900      -2.083200     -0.8400000    
 C   -2.861200       1.082100      -1.627000    
 C    2.069700      0.7443000      -2.119100    
 C    2.889000       1.515600      5.8800001E-02
 C   -4.186900      -1.403000      1.5200000E-02
 C   -4.485500     -0.1644000      0.8209000    
 C    3.665900      -1.203000      0.3566000    
 C    4.007400       1.268400      0.7478000    
 C    4.483800     -0.1145000      0.9285000    
 H  -0.4861000     -0.5311000      -1.629600    
 H   0.6178000      0.4218000       1.060800    
 H   -1.655300     -0.6286000       1.188800    
 H  -0.2137000       2.116300      -1.344300    
 H   0.4314000       2.712500      0.1759000    
 H   -1.465900       1.893600       1.432700    
 H   -2.006200       2.927100      0.1385000    
 H  -0.3105000      -2.796300     -0.7084000    
 H   0.3164000      -2.173400      0.8155000    
 H   -2.415800      -2.595400      0.1921000    
 H   -2.631100      -1.872200      -1.384800    
 H    1.660100      -2.062100      -1.935200    
 H    2.123200      -3.055700     -0.5678000    
 H   -3.606300      0.3685000      -1.988800    
 H   -3.329900       2.068800      -1.723400    
 H   -2.007200       1.046100      -2.308400    
 H    3.078700      0.5693000      -2.514400    
 H    1.386700      0.1110000      -2.693400    
 H    1.815300       1.785000      -2.351500    
 H    2.608400       2.559000     -6.4599998E-02
 H   -4.577600      -2.262100      0.5744000    
 H   -4.770700      -1.340000     -0.9103000    
 H    4.007500      -2.216700      0.5373000    
 H    4.595100       2.071800       1.176600    


%chk=000013769-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000013769

0 1
O -3.677790 0.934721 0.710443
O -5.507185 -0.084948 1.610767
O 5.592807 -0.326809 1.632254
C -0.367775 -0.629389 -0.556645
C 0.540416 0.530971 -0.033287
C -1.787242 -0.536283 0.085165
C -2.448085 0.842975 -0.173561
C 2.029779 0.448872 -0.604692
C -0.131469 1.908279 -0.271267
C -1.541774 1.968360 0.357382
C 0.276333 -2.009717 -0.279170
C -2.728729 -1.685962 -0.349260
C 2.563388 -0.958017 -0.324504
C 1.719114 -2.102235 -0.841740
C -2.894545 1.098832 -1.626591
C 2.066781 0.716800 -2.151403
C 2.888461 1.523837 0.038996
C -4.222715 -1.418719 0.009066
C -4.524676 -0.173206 0.846950
C 3.706542 -1.181726 0.395006
C 4.027022 1.283124 0.748120
C 4.523926 -0.095678 0.974471
H -0.485126 -0.521534 -1.657328
H 0.636300 0.393583 1.066760
H -1.656359 -0.598058 1.188081
H -0.196364 2.121057 -1.355788
H 0.476417 2.714985 0.175038
H -1.468802 1.859345 1.456231
H -2.015002 2.947879 0.160695
H -0.331824 -2.816289 -0.727437
H 0.301001 -2.186865 0.815602
H -2.407207 -2.621485 0.139625
H -2.630147 -1.852847 -1.439314
H 1.668999 -2.076040 -1.949640
H 2.174124 -3.069544 -0.563394
H -3.558730 0.306383 -2.010281
H -3.443229 2.055073 -1.674518
H -2.026928 1.167904 -2.305893
H 3.087542 0.549106 -2.536310
H 1.377591 0.053470 -2.701740
H 1.789519 1.761320 -2.375825
H 2.572570 2.561480 -0.132392
H -4.665768 -2.266581 0.557261
H -4.826628 -1.312484 -0.913551
H 4.062476 -2.202586 0.582133
H 4.627294 2.095945 1.173179


