%chk=000071147.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000071147

0 1
 O  -0.8469000      -1.499500      -1.218200    
 O    1.262500      -3.043100      -2.231300    
 O  -0.7466000      0.9471000      -2.202500    
 N   -1.661600       1.066600     -6.1200000E-02
 N    3.099700      -1.261400      0.4446000    
 N    2.362700       3.517400      -1.252300    
 C   -3.348100       2.314100       1.214600    
 C   -4.021300       1.031000       1.676000    
 C   -1.866300       2.063200      0.9958000    
 C   -2.428700     -0.1460000      5.5599999E-02
 C   -3.580000     -0.1694000      0.8750000    
 C   -2.039300      -1.339100     -0.5748000    
 C   -4.327300      -1.353200       1.003300    
 C  -0.6902000       1.347600      -1.038000    
 C    1.505600      -1.972600      -1.314200    
 C   0.2834000      -1.818500     -0.4117000    
 C   -2.795400      -2.506800     -0.4446000    
 C    2.791600      -2.284600     -0.5452000    
 C   -3.943500      -2.512500      0.3368000    
 C    4.295200      -1.610600       1.200000    
 C   0.5582000       2.039800     -0.6487000    
 C    4.614500     -0.4947000       2.189800    
 C    4.096400      -2.941600       1.919700    
 C    1.087800       1.881400      0.6217000    
 C    1.219600       2.856900      -1.543500    
 C    2.262500       2.544800      0.9587000    
 C    2.855600       3.343700     -5.5000000E-03
 H   -3.501000       3.104100       1.958000    
 H   -3.805600       2.655500      0.2770000    
 H   -3.772700      0.8478000       2.729000    
 H   -5.108700       1.153300       1.606300    
 H   -1.402700       3.018000      0.7260000    
 H   -1.407700       1.699800       1.922900    
 H   -5.212100      -1.375200       1.635200    
 H    1.629100      -1.063400      -1.915100    
 H   0.4373000      -1.038000      0.3384000    
 H   8.8299997E-02  -2.766200      0.1062000    
 H   -2.475800      -3.427000     -0.9276000    
 H    3.618700      -2.393200      -1.258400    
 H    2.641700      -3.270400     -9.2100002E-02
 H   -4.525300      -3.422600      0.4464000    
 H    5.152500      -1.701200      0.5206000    
 H    3.229200     -0.3630000     -1.9800000E-02
 H    4.786400      0.4548000       1.670700    
 H    5.521300     -0.7276000       2.758500    
 H    3.797800     -0.3467000       2.905400    
 H    4.889200      -3.094000       2.661600    
 H    3.141400      -2.976800       2.456700    
 H    4.151100      -3.798100       1.240600    
 H    2.029700      -3.099200      -2.826300    
 H   0.6526000       1.213000       1.356700    
 H   0.8500000       3.023200      -2.550400    
 H    2.707300       2.429000       1.940400    
 H    3.775200       3.879200      0.2062000    


%chk=000071147-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000071147

0 1
O -0.216688 -1.457691 -0.124961
O 1.865909 -3.010253 -2.718284
O -0.661744 0.614948 -1.885353
N -1.280504 1.040966 0.350023
N 2.666305 -1.885918 0.728083
N 2.064254 3.885429 -1.802673
C -3.140966 2.539775 0.966849
C -4.052285 1.342950 1.312122
C -1.664064 2.175379 1.234923
C -2.120196 -0.122045 0.455796
C -3.461371 -0.006149 0.908356
C -1.575201 -1.416652 0.182249
C -4.256248 -1.173791 1.018406
C -0.492974 1.253249 -0.802088
C 1.624461 -2.195164 -1.513579
C 0.314102 -2.644396 -0.827552
C -2.389631 -2.566446 0.273143
C 2.877250 -2.390005 -0.644342
C -3.734104 -2.438388 0.686429
C 3.886556 -1.723201 1.552878
C 0.639317 2.237228 -0.671474
C 3.520460 -0.944304 2.832482
C 4.496369 -3.100223 1.898694
C 1.458283 2.306717 0.484794
C 0.996866 3.036476 -1.789357
C 2.574286 3.169996 0.483364
C 2.834931 3.941116 -0.673692
H -3.425502 3.424887 1.565648
H -3.245424 2.812547 -0.100074
H -4.236071 1.326187 2.406006
H -5.043477 1.470804 0.837967
H -1.009033 3.033570 1.023472
H -1.525660 1.879999 2.292980
H -5.293898 -1.080606 1.359996
H 1.492504 -1.125344 -1.779385
H 0.494140 -3.458994 -0.101373
H -0.413207 -2.969186 -1.597191
H -1.973229 -3.554790 0.058527
H 3.735713 -1.897474 -1.162320
H 3.098812 -3.474634 -0.615436
H -4.363367 -3.331406 0.763895
H 4.667286 -1.138257 0.998318
H 2.068353 -1.048635 0.747886
H 3.115922 0.058241 2.587771
H 4.408583 -0.803803 3.473821
H 2.753285 -1.495939 3.405957
H 5.396449 -2.978380 2.529236
H 3.755199 -3.711068 2.445392
H 4.794186 -3.651483 0.988903
H 1.302984 -2.667454 -3.457363
H 1.228556 1.682144 1.355856
H 0.403408 2.980209 -2.708251
H 3.236040 3.240705 1.352247
H 3.691373 4.623656 -0.714723


