%chk=000131068.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000131068

0 1
 O   -1.661200      0.5980000       1.820000    
 O   -4.567300      -1.616800     -0.2522000    
 N   4.4599999E-02   1.218900      0.3034000    
 N   2.2800000E-02  -1.610700      0.1760000    
 N   -3.542100      0.4352000     -0.4042000    
 N   -2.302700      -1.580200     -0.1920000    
 C   -1.244500      0.5361000      0.4554000    
 C   -2.294300       1.178800     -0.4547000    
 C   -1.199400     -0.9476000      0.1150000    
 C    1.235100      0.5136000      0.1283000    
 C    1.244300     -0.9007000      9.3199998E-02
 C   0.1088000       2.647800      0.6206000    
 C    2.473400       1.185800     -1.7899999E-02
 C    2.485500      -1.566800     -5.3500000E-02
 C   -3.528200     -0.9552000     -0.2728000    
 C   8.0899999E-02  -3.076000      0.1624000    
 C    3.681600      0.5064000     -0.1653000    
 C    3.688100     -0.8746000     -0.1776000    
 C   0.1468000       3.489600     -0.6436000    
 C   -4.778300       1.173200     -0.6169000    
 C    4.945900       1.287500     -0.3017000    
 C    4.960300      -1.642200     -0.3219000    
 H   -2.516100       2.201400     -0.1315000    
 H   -1.967100       1.198100      -1.501100    
 H  -0.7756000       2.948300       1.196700    
 H   0.9473000       2.886300       1.285900    
 H    2.524700       2.270900     -1.0400000E-02
 H    2.527200      -2.652800     -8.6599998E-02
 H  -0.9004000      0.3258000       2.361000    
 H   0.4217000      -3.443900     -0.8116000    
 H  -0.8994000      -3.526100      0.3544000    
 H   0.7367000      -3.453900      0.9550000    
 H   0.9836000       3.234500      -1.299400    
 H  -0.7674000       3.374700      -1.232900    
 H   0.2371000       4.549100     -0.3825000    
 H   -5.649700      0.5148000     -0.5832000    
 H   -4.733100       1.656000      -1.597300    
 H   -4.874400       1.933000      0.1639000    
 H    4.762600       2.367600     -0.2987000    
 H    5.622700       1.072700      0.5317000    
 H    5.446400       1.050600      -1.246400    
 H    4.791000      -2.724100     -0.2890000    
 H    5.437700      -1.419200      -1.281600    
 H    5.651300      -1.401100      0.4925000    


%chk=000131068-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000131068

0 1
O -1.597134 0.695920 1.799695
O -4.628219 -1.685492 -0.009434
N 0.051269 1.254720 0.085930
N 0.037659 -1.585578 -0.061359
N -3.618896 0.410491 -0.225325
N -2.298404 -1.596309 -0.238085
C -1.202535 0.564584 0.361322
C -2.395245 1.194340 -0.402559
C -1.183603 -0.923222 -0.021502
C 1.275602 0.545988 0.037641
C 1.275328 -0.883257 -0.009663
C 0.063988 2.726741 0.280589
C 2.531214 1.207489 0.013149
C 2.506992 -1.579268 -0.038563
C -3.579921 -0.986950 -0.140880
C 0.033653 -3.049270 -0.270548
C 3.760433 0.510850 -0.022695
C 3.751964 -0.913154 -0.039920
C 0.166593 3.526581 -1.035567
C -4.899289 1.121067 -0.139238
C 5.067208 1.283472 -0.045486
C 5.044444 -1.709051 -0.070465
H -2.578383 2.210814 -0.014578
H -2.111245 1.273752 -1.473340
H -0.851972 3.001384 0.829917
H 0.899561 2.991500 0.955286
H 2.566422 2.300099 0.011199
H 2.503240 -2.672140 -0.066733
H -0.956012 0.177401 2.352954
H 0.554359 -3.306856 -1.209821
H -1.018332 -3.362785 -0.333951
H 0.528390 -3.559834 0.575007
H 1.069986 3.251023 -1.607206
H -0.708847 3.340324 -1.681355
H 0.211337 4.610744 -0.821675
H -5.691239 0.366305 -0.015094
H -5.099904 1.705602 -1.058792
H -4.909730 1.805907 0.730732
H 4.891862 2.372727 -0.038940
H 5.700275 1.039843 0.829645
H 5.666332 1.044598 -0.945413
H 4.846619 -2.794506 -0.072874
H 5.648029 -1.476978 -0.969432
H 5.683052 -1.486812 0.806325


