%chk=000077539.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000077539

0 1
 O   0.8528000      2.8300000E-02  0.8641000    
 O  -0.6380000      -1.916800     -0.4476000    
 O    1.630500      0.7819000      -1.193500    
 N    3.104700      2.4499999E-02  0.4299000    
 C  -0.4175000      0.2922000      0.4496000    
 C   -1.165400     -0.6838000     -0.2092000    
 C  -0.9694000       1.551000      0.6878000    
 C   -2.465100     -0.4008000     -0.6297000    
 C   -2.269000       1.833800      0.2672000    
 C   -3.016800      0.8579000     -0.3915000    
 C    1.857100      0.3236000     -7.7500001E-02
 C  -0.8372000      -2.911800      0.5548000    
 C    4.333200      0.2199000     -0.3044000    
 H  -0.3929000       2.316000       1.200800    
 H   -3.053100      -1.156000      -1.144100    
 H   -2.698600       2.813800      0.4527000    
 H   -4.028500       1.078300     -0.7192000    
 H    3.162500     -0.3546000       1.370000    
 H  -0.3839000      -2.601300       1.501500    
 H  -0.3541000      -3.834600      0.2220000    
 H   -1.905200      -3.106400      0.6950000    
 H    4.825200     -0.7500000     -0.4098000    
 H    4.974000      0.8890000      0.2750000    
 H    4.144200      0.6491000      -1.291100    


%chk=000077539-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000077539

0 1
O 0.798534 -0.274898 0.437781
O -1.121188 -2.144783 -0.512877
O 1.863019 1.531323 -0.711724
N 3.056162 -0.221680 0.306641
C -0.524694 0.176752 0.165062
C -1.466725 -0.802140 -0.256874
C -0.914353 1.520112 0.346845
C -2.798633 -0.405287 -0.514199
C -2.248750 1.901786 0.084824
C -3.189828 0.941650 -0.352493
C 1.925517 0.463348 -0.064514
C -0.636061 -2.926455 0.641324
C 4.399951 0.252260 -0.035168
H -0.173290 2.258832 0.661015
H -3.504091 -1.171671 -0.850428
H -2.545947 2.947311 0.216323
H -4.223354 1.237124 -0.562127
H 2.929938 -1.096182 0.816148
H 0.281205 -2.483814 1.066841
H -0.427213 -3.931013 0.242625
H -1.419776 -2.988115 1.421514
H 4.937082 -0.485850 -0.658484
H 4.995906 0.457765 0.873183
H 4.296087 1.186822 -0.608439


