%chk=000015015.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000015015

0 1
 O    1.594900       1.016400       1.198400    
 O    1.867000       2.963300     -0.5831000    
 O    3.822000     -0.7909000      0.7809000    
 N   -3.526700     -0.7514000      0.4245000    
 C  -0.7365000      0.5736000      0.6677000    
 C   -1.689000      0.6478000     -0.5148000    
 C   -2.321500     -0.7946000     -0.4067000    
 C   0.3327000       1.671300      0.8267000    
 C   -1.640900      0.3262000       1.946200    
 C   0.2225000     -0.5637000      0.2862000    
 C   -1.469700      -1.847700      -1.146400    
 C   -3.208800      0.1281000       1.615000    
 C  -5.0000001E-02  -1.678600     -0.5509000    
 C   0.5112000       2.548100     -0.4450000    
 C   -1.007100       1.085000      -1.785100    
 C    1.503100     -0.2421000      0.6672000    
 C   1.7400000E-02   1.952200      -1.740900    
 C   -4.705500     -0.3124000     -0.3038000    
 C    1.006400      -2.537600     -0.8435000    
 C    2.556100      -1.090600      0.3951000    
 C    2.295400      -2.252600     -0.3499000    
 C    4.627000     -4.9899999E-02 -0.1378000    
 H   -2.447200       1.427400     -0.3575000    
 H   -2.896500     -0.7139000      -1.347400    
 H   9.4499998E-02   2.342200       1.660700    
 H   -1.564600       1.171400       2.639700    
 H   -1.290200     -0.5675000       2.476900    
 H   -1.422900      -1.718100      -2.234700    
 H   -1.834300      -2.854400     -0.9153000    
 H   -3.699000     -0.2975000       2.498000    
 H   -3.636300       1.129200       1.469600    
 H  -7.2300002E-02   3.466400     -0.3004000    
 H   -1.384900      0.7407000      -2.742000    
 H   0.4596000       2.296600      -2.671200    
 H   -4.598900      0.6824000     -0.7507000    
 H   -5.566000     -0.2764000      0.3745000    
 H   -4.976000      -1.025700      -1.091500    
 H   0.8510000      -3.414400      -1.465400    
 H    3.111000      -2.930800     -0.5920000    
 H    2.402800       2.167900     -0.7410000    
 H    4.657900     -0.5427000      -1.114900    
 H    5.643700     -2.3000001E-03  0.2618000    
 H    4.245100      0.9693000     -0.2405000    


%chk=000015015-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000015015

0 1
O 1.801146 1.135093 0.511074
O 1.959361 3.232721 -1.141681
O 3.903727 -1.085958 0.080194
N -3.098779 -0.673285 0.518908
C -0.630202 0.783731 0.289254
C -1.717773 0.952129 -0.814084
C -2.537563 -0.380930 -0.837761
C 0.479519 1.881094 0.336634
C -1.328830 0.600393 1.688203
C 0.188891 -0.443302 -0.105373
C -1.694023 -1.599973 -1.315882
C -2.844176 0.337246 1.558916
C -0.275010 -1.590095 -0.766205
C 0.582416 2.772214 -0.946795
C -1.080851 1.309226 -2.144279
C 1.550741 -0.215286 0.129100
C 0.005701 2.121307 -2.194147
C -4.472004 -1.194481 0.493411
C 0.685673 -2.603551 -1.030370
C 2.515997 -1.219452 -0.100186
C 2.040717 -2.432811 -0.668366
C 4.349510 -0.322891 1.263302
H -2.415604 1.765508 -0.523531
H -3.372675 -0.239817 -1.562738
H 0.418366 2.523136 1.229199
H -1.179954 1.506796 2.306843
H -0.857226 -0.246013 2.217630
H -1.634841 -1.601226 -2.425059
H -2.233786 -2.521551 -1.026563
H -3.225780 -0.058062 2.519583
H -3.390881 1.300806 1.379749
H 0.008222 3.699107 -0.741844
H -1.517781 0.899678 -3.064785
H 0.479809 2.408881 -3.140098
H -5.234751 -0.436227 0.180610
H -4.752398 -1.565529 1.496192
H -4.540390 -2.046220 -0.208047
H 0.380624 -3.526166 -1.538072
H 2.779127 -3.216819 -0.864916
H 2.550374 2.479402 -0.867018
H 3.959875 0.709534 1.250286
H 5.448190 -0.319484 1.202985
H 4.023791 -0.829175 2.192423


