%chk=000157169.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000157169

0 1
 O    1.838200       1.628400      0.2764000    
 O   -5.712100      -1.453500      0.8833000    
 O    3.829500       2.517300      0.8860000    
 N    1.648600     -0.6232000     -0.4435000    
 C    3.817700      0.2641000      0.1955000    
 C    3.022900     -0.7848000     -0.2596000    
 C   -2.579000      0.1272000     -0.2057000    
 C    1.160300      0.5390000     -0.1711000    
 C    5.193700      9.3699999E-02  0.3777000    
 C    3.618400      -2.019800     -0.5353000    
 C    3.181300       1.560400      0.4833000    
 C   -1.163400     -8.2800001E-02 -0.1181000    
 C   -3.477600     -0.7745000      0.3896000    
 C  -0.2576000      0.8841000     -0.3067000    
 C   -3.098200       1.238700     -0.8911000    
 C   -4.854800     -0.5705000      0.3023000    
 C    5.777700      -1.141400      9.9799998E-02
 C    4.991200      -2.197700     -0.3562000    
 C   -4.475400       1.442400     -0.9787000    
 C   -5.353700      0.5379000     -0.3819000    
 C   -7.107500      -1.184800      0.7540000    
 H    5.821500      0.9062000      0.7325000    
 H    3.015800      -2.851800     -0.8915000    
 H  -0.8468000      -1.092400      0.1328000    
 H   -3.104500      -1.644100      0.9276000    
 H  -0.4972000       1.919200     -0.5163000    
 H   -2.460100       1.960700      -1.393400    
 H    6.845900      -1.280600      0.2389000    
 H    5.446200      -3.159900     -0.5724000    
 H   -4.863700       2.302700      -1.516200    
 H   -6.410700      0.7560000     -0.4897000    
 H   -7.427900      -1.215500     -0.2929000    
 H   -7.383700     -0.2457000       1.245500    
 H   -7.640700      -1.986800       1.274900    


%chk=000157169-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000157169

0 1
O 2.034080 1.768208 -0.361158
O -5.689139 -1.749070 0.272767
O 4.148231 2.682239 -0.502429
N 1.653665 -0.598091 0.003136
C 3.975466 0.272718 -0.135422
C 3.041184 -0.805412 0.030521
C -2.653293 0.330843 -0.105263
C 1.200968 0.626129 -0.182983
C 5.371380 0.022525 -0.099784
C 3.536737 -2.122862 0.229481
C 3.483669 1.644554 -0.343765
C -1.209876 0.070616 -0.077998
C -3.532364 -0.766715 0.084383
C -0.206665 0.993799 -0.230099
C -3.210970 1.630673 -0.312107
C -4.935350 -0.584616 0.071794
C 5.844561 -1.286328 0.098285
C 4.921966 -2.357311 0.262350
C -4.604711 1.801769 -0.323938
C -5.483454 0.705831 -0.133147
C -7.148801 -1.621481 0.277400
H 6.057936 0.865525 -0.229008
H 2.811732 -2.932350 0.353904
H -0.897643 -0.970868 0.082274
H -3.139121 -1.776418 0.245124
H -0.402168 2.058025 -0.393060
H -2.558038 2.495838 -0.462273
H 6.921173 -1.482781 0.126365
H 5.296029 -3.375427 0.415946
H -5.028110 2.799674 -0.482876
H -6.564945 0.869322 -0.146436
H -7.523849 -1.247375 -0.695129
H -7.491641 -0.952830 1.090902
H -7.524337 -2.640153 0.452042


