%chk=000133388.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133388

0 1
 O    1.302100      -1.969000       1.712600    
 O   -3.816700      -1.424200     -0.9125000    
 O   -1.069900      0.5498000       1.530900    
 O   -1.805800       1.217900      -2.315200    
 O  -0.7303000       3.182100       1.610500    
 O    5.536000      0.2393000      -1.682000    
 O    3.511500     -0.4459000      -2.455500    
 O   -4.328500     -0.7262000       1.262400    
 O   -2.436900       3.913100      0.1849000    
 N   -1.267000     -0.3398000     -0.6354000    
 N    1.663500      -1.486900     -0.4723000    
 N   0.8225000       1.461900      -1.214700    
 C   -1.519700      -1.663900     -0.2550000    
 C  -0.5015000      -2.460900      0.2680000    
 C   0.8338000      -1.956600      0.4332000    
 C   -2.805400      -2.183900     -0.4041000    
 C    2.778100      -1.157900      0.2604000    
 C    2.560600      -1.451600       1.598400    
 C  -0.7687000      -3.777800      0.6420000    
 C   -3.072700      -3.501000     -3.0200001E-02
 C   -2.054400      -4.297800      0.4929000    
 C    4.010800     -0.6093000     -0.1214000    
 C  -0.7923000      0.6101000      0.3334000    
 C   -1.481600      7.2400004E-02  -1.994200    
 C    3.484200      -1.242400       2.615100    
 C    4.969200     -0.3835000      0.8774000    
 C   6.1099999E-02   1.733400     -0.1309000    
 C    4.708600     -0.6947000       2.217600    
 C   -1.328000     -0.9890000      -3.060500    
 C   5.0799999E-02   2.954600      0.5236000    
 C    4.290000     -0.2837000      -1.507700    
 C   -4.537800     -0.7095000      5.6699999E-02
 C   0.8747000       3.962300      3.4200002E-02
 C    1.610400       2.465600      -1.661600    
 C    1.672500       3.721100      -1.078800    
 C   -5.622800      9.1399997E-02 -0.5999000    
 C   -2.009200       3.681700       1.308000    
 C   -2.791000       3.898800       2.569600    
 H   1.2200000E-02  -4.416000       1.049000    
 H   -4.071500      -3.913500     -0.1442000    
 H   -2.262500      -5.323400      0.7832000    
 H    3.272700      -1.486300       3.648700    
 H    5.943900      3.9600000E-02  0.6461000    
 H    5.474200     -0.5067000       2.966700    
 H  -0.5663000      -1.723400      -2.787500    
 H   -1.006500     -0.5105000      -3.990700    
 H   -2.284400      -1.487100      -3.234000    
 H   0.9007000       4.936100      0.5151000    
 H    2.211300       2.227900      -2.532900    
 H    2.322300       4.491500      -1.477700    
 H   -5.181300      0.8023000      -1.302700    
 H   -6.173500      0.6498000      0.1623000    
 H   -6.316800     -0.5785000      -1.113400    
 H    5.711900      0.4562000      -2.622400    
 H   -2.279200       4.630500       3.199400    
 H   -3.783400       4.284600       2.319700    
 H   -2.908000       2.949500       3.097900    


%chk=000133388-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000133388

0 1
O 1.821258 -2.311081 1.861958
O -3.537810 -0.901209 -0.702287
O -1.260180 0.848972 1.630599
O -1.143542 1.189188 -2.439314
O -1.722423 3.758940 1.279848
O 5.509529 -0.175803 -2.363107
O 3.305638 -0.769748 -2.789175
O -5.409937 -0.876199 0.728194
O -3.350806 2.576102 0.076789
N -0.954900 -0.104638 -0.482001
N 1.720913 -1.502757 -0.313215
N 0.957262 2.089784 -0.743278
C -1.343376 -1.370363 0.105744
C -0.420846 -2.196377 0.805947
C 1.017504 -1.952353 0.718109
C -2.717544 -1.718289 0.110291
C 3.069366 -1.527526 0.104346
C 3.134483 -2.016769 1.442647
C -0.897973 -3.307226 1.549270
C -3.191743 -2.840835 0.822070
C -2.271342 -3.617854 1.558290
C 4.267609 -1.160406 -0.564686
C -0.870824 0.974276 0.432493
C -0.915218 0.071409 -1.927263
C 4.318878 -2.150789 2.173392
C 5.477902 -1.281095 0.167976
C -0.197263 2.241473 -0.028830
C 5.503734 -1.763584 1.501204
C -0.544194 -1.162153 -2.716254
C -0.645339 3.526077 0.387267
C 4.257317 -0.705596 -1.979122
C -4.858351 -0.494058 -0.317872
C 0.083810 4.669408 -0.001270
C 1.663781 3.191859 -1.099409
C 1.255678 4.505430 -0.765535
C -5.385933 0.452047 -1.360979
C -2.996009 3.143007 1.124219
C -3.778785 3.291267 2.400828
H -0.182474 -3.926117 2.097956
H -4.256160 -3.081313 0.820319
H -2.631129 -4.478619 2.130700
H 4.329354 -2.526261 3.199779
H 6.409636 -0.995401 -0.326497
H 6.463131 -1.841564 2.022088
H 0.521337 -1.383621 -2.514680
H -0.690149 -0.956429 -3.786477
H -1.136142 -2.045885 -2.422061
H -0.272434 5.655768 0.309472
H 2.581823 3.009626 -1.668251
H 1.845124 5.369864 -1.085805
H -4.844361 1.409433 -1.255549
H -6.463205 0.613087 -1.210049
H -5.187591 0.066624 -2.374315
H 5.453629 0.084205 -3.321628
H -3.609321 4.278022 2.859729
H -4.849352 3.126060 2.211544
H -3.416036 2.522590 3.108340


