%chk=000096026.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096026

0 1
 O   0.1314000      -1.826100      9.9500000E-02
 O    2.591600      -1.057100      0.7745000    
 O   -2.113500     -0.4270000      -1.246000    
 N    2.423200      0.9470000     -0.3903000    
 N   -2.790400      0.6783000      0.6867000    
 N    3.700000       1.347800     -5.5399999E-02
 N   -4.131700      0.4627000      0.4475000    
 C   0.5269000     -0.5466000     -0.3711000    
 C  -0.4340000      0.4971000      0.1989000    
 C    1.957900     -0.2719000      7.2099999E-02
 C   -1.861300      0.1957000     -0.2164000    
 H   0.4920000     -0.5574000      -1.466900    
 H  -0.3736000      0.4942000       1.294600    
 H  -0.1943000       1.508000     -0.1471000    
 H   0.6893000      -2.486300     -0.3463000    
 H    1.876100       1.553100     -0.9931000    
 H   -2.528900       1.192100       1.522200    
 H    4.195500       1.518400     -0.9294000    
 H    3.614800       2.254900      0.4012000    
 H   -4.503500     -2.2000000E-02   1.263400    
 H   -4.580800       1.377400      0.4350000    


%chk=000096026-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000096026

0 1
O -0.149117 -1.355939 0.637403
O 2.395983 -0.732079 0.922706
O -2.647020 2.109133 -0.171497
N 2.444234 0.822875 -0.811676
N -2.610965 -0.138951 0.444987
N 3.846231 1.051162 -0.769683
N -4.022541 -0.313966 0.371118
C 0.263955 -0.186620 -0.138290
C -0.469961 1.091044 0.349437
C 1.796042 -0.051129 0.030306
C -2.000576 1.071004 0.171163
H 0.012995 -0.382881 -1.198772
H -0.234729 1.250138 1.419690
H -0.114934 1.979155 -0.202788
H 0.639877 -1.609339 1.203727
H 1.942220 1.328524 -1.544069
H -2.041646 -0.950471 0.723077
H 4.360187 0.169913 -0.906902
H 4.116761 1.502019 0.115142
H -4.347609 -0.186822 -0.598811
H -4.492686 0.365530 0.987332


