%chk=000072335.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072335

0 1
 O   -3.459700      -1.574900     -0.1021000    
 O   -1.112300       2.368100     -0.2292000    
 O    3.842600      0.9600000      0.1670000    
 O    3.656300      -1.819300      0.3457000    
 N   -1.105300      -1.809400      5.6899998E-02
 C   0.1891000      0.3053000     -9.1000004E-03
 C   0.1457000      -1.191300      9.0400003E-02
 C   -2.231900      0.3155000     -0.1566000    
 C  -0.9768000       1.002400     -0.1275000    
 C   -2.212900      -1.055000     -6.1799999E-02
 C    1.477000      0.9855000      2.2200000E-02
 C    1.300400      -1.869300      0.2064000    
 C   -3.585200      0.6849000     -0.2637000    
 C    2.628800      0.3078000      0.1379000    
 C    2.615900      -1.177700      0.2386000    
 C   -4.295800     -0.5010000     -0.2261000    
 C   -1.242000       2.960000       1.050100    
 C    4.366000       1.108300      -1.139100    
 H   -1.129100      -2.821100      0.1244000    
 H    1.498400       2.068700     -5.3399999E-02
 H    1.315400      -2.952000      0.2811000    
 H   -4.007100       1.675400     -0.3574000    
 H   -5.348500     -0.7389000     -0.2739000    
 H   -1.323100       4.042800      0.9147000    
 H  -0.3630000       2.766900       1.675000    
 H   -2.146800       2.620000       1.565400    
 H    5.335600       1.609400      -1.062700    
 H    3.713200       1.731100      -1.760800    
 H    4.525700      0.1363000      -1.618600    


%chk=000072335-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000072335

0 1
O -3.424596 -1.639962 0.076860
O -0.867949 2.443437 0.478095
O 3.815485 1.141315 -0.222811
O 3.780621 -1.786779 -0.658244
N -1.040577 -1.732433 -0.196151
C 0.207474 0.379281 0.018991
C 0.207215 -1.061235 -0.221762
C -2.252119 0.355494 0.282907
C -1.005920 1.077995 0.267407
C -2.178893 -1.032098 0.044068
C 1.478757 1.043028 -0.019962
C 1.385231 -1.760264 -0.465217
C -3.677800 0.617035 0.482024
C 2.665308 0.359991 -0.261012
C 2.688517 -1.120328 -0.480544
C -4.346858 -0.579163 0.355189
C -2.039862 3.277922 0.764639
C 5.098823 0.673000 -0.793939
H -1.071911 -2.741198 -0.356964
H 1.518356 2.122084 0.144325
H 1.379030 -2.843450 -0.632987
H -4.160811 1.565750 0.694785
H -5.386305 -0.883262 0.418294
H -1.633915 4.291011 0.896281
H -2.540803 2.955288 1.695367
H -2.749126 3.270842 -0.082980
H 5.749708 1.559898 -0.728000
H 4.972754 0.359901 -1.844633
H 5.500763 -0.174599 -0.220227


