%chk=000034361.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000034361

0 1
 O    1.756600      -1.120900      0.5640000    
 O    2.638100       2.064500      -1.046900    
 O    5.216500      0.8715000     -0.5247000    
 O    4.482900     -0.9601000       1.405400    
 O   -5.376400      -1.312200     -0.9348000    
 N   0.4791000      0.8406000      0.4674000    
 C    2.819000      0.9497000     -0.1745000    
 C    4.007400      0.1350000     -0.6894000    
 C    1.547400      9.2399999E-02 -0.1594000    
 C    4.125900      -1.198900      4.2700000E-02
 C    2.792000      -1.935200      8.3999997E-03
 C  -0.8624000      0.5456000      0.3003000    
 C   -1.857100       1.311000      0.9393000    
 C   -1.271800     -0.5283000     -0.5138000    
 C   -3.209500       1.013800      0.7710000    
 C   -2.624300     -0.8255000     -0.6821000    
 C   -3.593100     -5.4400001E-02 -3.9700001E-02
 C   -5.003100     -0.3639000     -0.2159000    
 C   -6.067400      0.4754000      0.4828000    
 H    3.049200       1.345400      0.8228000    
 H    3.886400     -3.9500002E-02  -1.766100    
 H    1.290300     -0.1335000      -1.202700    
 H    4.918000      -1.815900     -0.3949000    
 H    2.517700      -2.227300      -1.011500    
 H    2.844900      -2.840700      0.6214000    
 H   0.7199000       1.568200       1.131600    
 H    1.861800       2.557400     -0.7304000    
 H    5.942000      0.3256000     -0.8730000    
 H    5.317800     -0.4614000       1.403500    
 H   -1.575200       2.147900       1.574900    
 H  -0.5602000      -1.168000      -1.027200    
 H   -3.930000       1.639100       1.288700    
 H   -2.898800      -1.664200      -1.316600    
 H   -6.014800       1.512700      0.1422000    
 H   -5.950200      0.4081000       1.567400    
 H   -7.057100      8.4899999E-02  0.2250000    


%chk=000034361-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000034361

0 1
O 1.863066 -1.232197 0.793902
O 2.688225 1.953075 -1.064841
O 5.263802 0.784914 -0.716434
O 4.837172 -0.899821 1.402054
O -5.506556 -0.967209 -1.310473
N 0.502963 0.694608 0.499565
C 2.859491 0.813181 -0.155970
C 4.023332 0.002328 -0.738414
C 1.586913 -0.060380 -0.074680
C 4.288572 -1.264224 0.096812
C 2.985359 -2.052982 0.301286
C -0.867662 0.439699 0.280153
C -1.823178 1.148622 1.063953
C -1.336814 -0.469595 -0.711667
C -3.199306 0.962865 0.857351
C -2.713841 -0.640925 -0.913759
C -3.674994 0.068091 -0.140542
C -5.128349 -0.163389 -0.403711
C -6.158585 0.587032 0.438763
H 3.121085 1.147798 0.871137
H 3.759694 -0.277299 -1.781347
H 1.314244 -0.397610 -1.097102
H 5.007292 -1.908395 -0.455771
H 2.703905 -2.543299 -0.656539
H 3.134022 -2.821533 1.075173
H 0.728852 1.132834 1.398038
H 1.859451 2.436963 -0.814436
H 5.064127 1.678475 -1.097520
H 5.536930 -0.214728 1.226121
H -1.475943 1.847475 1.835351
H -0.632558 -1.056613 -1.307871
H -3.905787 1.522865 1.479095
H -3.085405 -1.339071 -1.671580
H -6.050410 1.681375 0.318472
H -6.039887 0.356955 1.514031
H -7.167725 0.289014 0.116598


