%chk=000096841.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096841

0 1
 O    3.071900       1.060500      8.3999997E-03
 O   0.2628000      -2.640300      0.1152000    
 O   -2.920700     -0.2780000     -0.2182000    
 O   -2.044100      -2.289700     -2.9600000E-02
 N   0.7709000       1.373900     -0.1358000    
 N    1.713800     -0.8124000      6.9100000E-02
 N   -1.626600       1.694400     -0.2847000    
 N   -1.968300      -1.058800     -0.1122000    
 C  -0.5379000      0.8520000     -0.1685000    
 C  -0.6605000     -0.4858000     -8.1600003E-02
 C    1.932800      0.5805000     -1.7800000E-02
 C   0.4636000      -1.429700      4.4000000E-02
 C   0.9358000       2.828400     -0.2301000    
 C    2.886900      -1.672100      0.1952000    
 C   -2.280200       2.277100      0.8465000    
 H   0.4497000       3.199700      -1.137200    
 H    1.990700       3.111800     -0.2798000    
 H   0.5057000       3.299100      0.6580000    
 H   -1.560500       2.320500      -1.083300    
 H    3.444500      -1.375100       1.089300    
 H    3.530200      -1.515200     -0.6766000    
 H    2.627500      -2.730900      0.2667000    
 H   -2.386500       1.567500       1.674200    
 H   -3.282000       2.613700      0.5622000    
 H   -1.730500       3.148200       1.214600    


%chk=000096841-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000096841

0 1
O 3.187743 0.977864 -0.438188
O 0.271310 -2.578183 0.392792
O -2.791115 -0.390258 -0.855392
O -2.389423 -1.793457 0.905926
N 0.905621 1.460337 -0.183775
N 1.730020 -0.781668 0.032173
N -1.347092 2.033718 0.162835
N -2.022803 -0.868136 0.088752
C -0.415326 1.034236 0.032630
C -0.665340 -0.345900 0.175008
C 2.017127 0.557839 -0.220021
C 0.410827 -1.336065 0.238651
C 1.232075 2.896558 -0.312161
C 2.884989 -1.711330 0.033158
C -2.702671 1.915665 0.721469
H 0.754257 3.340452 -1.205863
H 2.322467 2.962944 -0.439691
H 0.941083 3.452719 0.597609
H -1.083208 2.958053 -0.177111
H 3.599726 -1.422838 0.820892
H 3.400612 -1.672597 -0.940036
H 2.489313 -2.719696 0.219271
H -2.708675 1.197293 1.558478
H -3.432426 1.568389 -0.030903
H -3.000094 2.903362 1.111497


