%chk=000142811.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000142811

0 1
 O    2.485300      -1.100400     -2.4000001E-03
 O    2.479200       1.102800     -4.1000000E-03
 N   -2.140700      1.5000000E-03 -4.6999999E-03
 N    1.903600     -3.9999999E-04  5.7000001E-03
 C   0.4328000     -1.7000000E-03  5.5000000E-03
 C  -9.2799999E-02  -1.438500     -5.2999998E-03
 C  -9.3800001E-02  0.7105000       1.252000    
 C  -8.5199997E-02  0.7240000      -1.237900    
 C   -1.631500      -1.390100     -1.0400000E-02
 C   -1.632700      0.6902000       1.205400    
 C   -1.624200      0.7022000      -1.203900    
 H   0.2451000      -1.998200      0.8769000    
 H   0.2508000      -1.987500     -0.8919000    
 H   0.2550000       1.750000       1.299800    
 H   0.2583000      0.2146000       2.165600    
 H   0.2742000      0.2386000      -2.154400    
 H   0.2621000       1.764500      -1.271900    
 H   -2.020200      -1.921400     -0.8882000    
 H   -2.026200      -1.930600      0.8590000    
 H   -2.027400      0.1980000       2.103100    
 H   -2.021800       1.715600       1.236700    
 H   -2.013800       1.727700      -1.228100    
 H   -2.011500      0.2188000      -2.109500    


%chk=000142811-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000142811

0 1
O 2.613582 -1.096862 0.004493
O 2.519166 1.177723 0.009886
N -2.168820 0.005834 -0.004182
N 1.963408 0.014008 0.006155
C 0.416986 -0.024114 0.001816
C -0.097114 -1.477978 -0.007085
C -0.087432 0.714480 1.272374
C -0.081394 0.728073 -1.263147
C -1.674092 -1.402769 -0.010306
C -1.665036 0.700341 1.216545
C -1.659198 0.712862 -1.215326
H 0.281207 -2.017638 0.878220
H 0.285279 -2.008040 -0.896476
H 0.313450 1.742435 1.279342
H 0.285249 0.196364 2.175035
H 0.296076 0.220045 -2.169521
H 0.319260 1.756125 -1.256723
H -2.083754 -1.903961 -0.904752
H -2.087839 -1.913149 0.877035
H -2.079915 0.185095 2.100259
H -2.060152 1.731334 1.210679
H -2.054817 1.743591 -1.201107
H -2.069500 0.206402 -2.106216


