%chk=000161583.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000161583

0 1
 O   -1.685800     -0.5481000       1.015000    
 O   -1.542900       2.347600      -1.095400    
 O   -3.724200       1.541000      0.3292000    
 O   -2.633500      -3.077800      0.2603000    
 O    1.201200       2.312400      0.7361000    
 N   0.3997000      0.2067000      0.2763000    
 N    2.723300      0.7065000      0.2031000    
 N    1.960100      -1.471200     -0.2778000    
 N    4.256600     -0.9481000     -0.3426000    
 C   -1.669700      0.9711000     -0.8035000    
 C   -3.102400      0.5739000     -0.5167000    
 C   -2.923500     -0.7067000      0.2873000    
 C  -0.9699000      0.5803000      0.4868000    
 C   -2.806600      -1.951700     -0.5818000    
 C    1.433000       1.144000      0.4230000    
 C   0.7500000      -1.078400     -7.5800002E-02
 C    2.963800     -0.5353000     -0.1289000    
 C    5.370600     -6.6299997E-02 -0.1945000    
 H   -1.289500      0.3981000      -1.658000    
 H   -3.720100      0.4683000      -1.412200    
 H   -1.014800       1.388500       1.226200    
 H   -3.713500     -0.8448000       1.034200    
 H   -1.960300      -1.904100      -1.271700    
 H   -3.722200      -2.095200      -1.164500    
 H  -0.5940000       2.541500      -1.181600    
 H   -3.251000       1.571600       1.177300    
 H  -7.0600003E-02  -1.793700     -0.1832000    
 H   -2.573100      -3.859400     -0.3149000    
 H    4.439300      -1.912700     -0.6023000    
 H    5.304300      0.7757000     -0.8910000    
 H    6.300800     -0.6018000     -0.4081000    
 H    5.436400      0.3202000      0.8276000    


%chk=000161583-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000161583

0 1
O -1.776349 -0.617430 1.136980
O -1.734492 2.567273 -0.526957
O -3.926900 1.419436 0.425557
O -2.224933 -3.102375 -0.064218
O 0.936315 2.277174 -0.115204
N 0.408231 0.052270 0.389702
N 2.669158 0.684522 -0.149916
N 2.053329 -1.668360 0.300393
N 4.250571 -1.044254 -0.167887
C -1.691684 1.122027 -0.562576
C -3.139358 0.569883 -0.452157
C -2.935335 -0.805749 0.211397
C -0.986165 0.510752 0.691102
C -2.655005 -1.916269 -0.812266
C 1.365118 1.085650 0.023545
C 0.799624 -1.264984 0.499811
C 2.961777 -0.633878 -0.006392
C 5.351393 -0.125152 -0.475487
H -1.199142 0.752688 -1.484943
H -3.617953 0.490823 -1.450084
H -0.921364 1.261560 1.500540
H -3.785024 -1.077753 0.856536
H -1.869568 -1.600746 -1.533950
H -3.593118 -2.107941 -1.376165
H -0.777676 2.854777 -0.396208
H -3.539868 2.336305 0.340300
H 0.017114 -1.985190 0.761432
H -2.189996 -3.882353 -0.672683
H 4.415925 -2.044157 -0.045475
H 5.146279 0.430274 -1.406948
H 6.280445 -0.706212 -0.589661
H 5.480151 0.619487 0.329781


