%chk=000084039.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000084039

0 1
 O   0.2970000       2.043800      -1.605700    
 O    4.530400      0.8918000      0.2395000    
 O    3.022700       2.261500      -1.603800    
 O    3.606400      2.5699999E-02   3.343400    
 O   -5.478900       1.638800      0.4854000    
 O   -4.938700     -0.2860000      -1.435600    
 O   0.1636000      -4.538600     -0.9399000    
 N   3.1500001E-02  -2.217200     -0.8441000    
 C  -0.8911000      -2.120200      0.2709000    
 C  -0.1737000      -2.277800       1.630900    
 C   0.4760000      -1.032700       2.248800    
 C    1.150500     -0.1391000       1.241500    
 C   -1.754600     -0.8669000      9.8899998E-02
 C   0.3763000      0.5734000      0.3017000    
 C   -1.110200      0.4386000      0.3139000    
 C    2.546500     -2.4800001E-02   1.215000    
 C    1.016800       1.375600     -0.6559000    
 C    3.170200      0.7839000      0.2651000    
 C   -3.021500      -1.046400     -0.3182000    
 C    2.407500       1.481000     -0.6694000    
 C   -1.756500       1.577200      0.6297000    
 C    3.406700     -0.7729000       2.185900    
 C   -4.082100     -4.7400001E-02 -0.5862000    
 C   -3.165200       1.804600      0.8155000    
 C   0.4760000      -3.423600      -1.349300    
 C   -4.197500       1.155900      0.2703000    
 C    1.404300      -3.238500      -2.519700    
 C   5.1800001E-02   1.357200      -2.829400    
 C    5.237300     -4.3699998E-02 -0.5707000    
 C    3.246400       3.626500      -1.259700    
 C   -6.048000       1.040300       1.630800    
 H   -1.533500      -3.008700      0.1909000    
 H  -0.8975000      -2.661200       2.362800    
 H   0.5967000      -3.055100       1.538700    
 H  -0.3047000     -0.4393000       2.746500    
 H    1.114500      -1.332100       3.083400    
 H   0.3562000      -1.367900      -1.295500    
 H   -3.357300      -2.059300     -0.5394000    
 H   -1.176900       2.480900      0.8269000    
 H    2.995400      -1.744800       2.471600    
 H    4.393100      -1.011500       1.780400    
 H   -3.383000       2.685500       1.419200    
 H    2.203300      -2.537800      -2.259800    
 H   0.8432000      -2.851000      -3.374400    
 H    1.853600      -4.198200      -2.789600    
 H    2.748800      0.3911000       3.619300    
 H   0.9914000       1.052700      -3.301200    
 H  -0.4705000       2.040100      -3.505100    
 H  -0.5830000      0.4818000      -2.663400    
 H    6.267700     -0.1015000     -0.2096000    
 H    4.793100      -1.043800     -0.5298000    
 H    5.249500      0.3071000      -1.607200    
 H    3.895200       3.701400     -0.3814000    
 H    2.296900       4.136800      -1.069200    
 H    3.742400       4.115200      -2.102700    
 H   -6.122800     -4.7200002E-02   1.518000    
 H   -5.480100       1.285400       2.535200    
 H   -7.061100       1.434800       1.754400    


%chk=000084039-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000084039

0 1
O 0.278659 1.966393 -1.567702
O 4.679514 0.818517 0.286529
O 3.094025 2.176392 -1.678401
O 3.609768 0.079944 3.621436
O -5.456895 1.705806 0.752527
O -5.389936 -1.059758 0.031653
O -0.766794 -4.318066 -1.483418
N 0.114045 -2.295809 -0.724757
C -0.779704 -2.216657 0.450651
C -0.017094 -2.353468 1.805937
C 0.520098 -1.016203 2.386972
C 1.241380 -0.181143 1.337969
C -1.689493 -0.967032 0.416317
C 0.433849 0.458475 0.345025
C -1.066925 0.344392 0.382851
C 2.661278 -0.072803 1.312371
C 1.074283 1.247090 -0.659451
C 3.276497 0.684356 0.277637
C -3.056977 -1.250849 0.401606
C 2.489576 1.366767 -0.686890
C -1.771498 1.560185 0.406553
C 3.530172 -0.721047 2.376914
C -4.285252 -0.460122 0.319555
C -3.156588 1.846086 0.527625
C 0.039573 -3.349047 -1.627562
C -4.275780 1.005820 0.571261
C 1.001386 -3.262444 -2.810260
C 0.462586 1.651098 -3.004389
C 5.384340 0.348094 -0.931156
C 3.611497 3.464029 -1.145931
C -6.720719 1.057484 1.185029
H -1.414632 -3.113498 0.344424
H -0.702676 -2.805162 2.548379
H 0.812962 -3.068141 1.650149
H -0.335419 -0.434874 2.780007
H 1.167452 -1.248595 3.250204
H 0.782221 -1.540568 -0.883613
H -3.318475 -2.318074 0.357808
H -1.143561 2.457134 0.368851
H 3.176665 -1.746411 2.607633
H 4.572685 -0.768200 2.033124
H -3.411727 2.909918 0.618977
H 1.642538 -2.363361 -2.794239
H 0.416729 -3.269573 -3.746434
H 1.642771 -4.160471 -2.820709
H 2.689812 0.298864 3.920416
H 1.504992 1.838768 -3.311018
H -0.226460 2.325070 -3.534720
H 0.177324 0.599023 -3.197303
H 6.447482 0.564212 -0.748188
H 5.237600 -0.741914 -1.054499
H 5.024422 0.883835 -1.825985
H 4.366557 3.278114 -0.361194
H 2.777335 4.066300 -0.742561
H 4.067494 3.976976 -2.006199
H -7.093172 0.375445 0.409227
H -6.561841 0.494016 2.121086
H -7.397450 1.908089 1.358473


