%chk=000032094.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000032094

0 1
 O  -0.4000000      0.5005000     -0.5293000    
 O  -0.1294000      0.4137000       1.784800    
 O   -2.709300      -2.763900      0.3352000    
 O   -1.013800      -2.139300      -1.043900    
 N    5.861500     -0.1042000     -0.5084000    
 C    1.766300      0.2708000      0.3455000    
 C   -1.775700      0.6288000     -0.3196000    
 C   -2.561600     -0.4999000     -0.2433000    
 C    2.596100     -0.4440000       1.209000    
 C    2.296400      0.8612000     -0.8017000    
 C   -2.292600       1.900700     -0.1952000    
 C    4.486500      2.1700000E-02 -0.2218000    
 C   0.3485000      0.4013000      0.6416000    
 C   -3.932300     -0.3504000     -3.2099999E-02
 C    3.956100     -0.5685000      0.9255000    
 C    3.656500      0.7368000      -1.085400    
 C   -3.663300       2.050100      1.6200000E-02
 C   -4.483100      0.9246000      9.7599998E-02
 C   -2.006800      -1.840000     -0.3747000    
 H    2.198500     -0.9127000       2.105500    
 H    1.677200       1.435200      -1.486000    
 H   -1.655200       2.777000     -0.2593000    
 H   -4.599200      -1.207000      2.3499999E-02
 H    4.592400      -1.128700       1.605900    
 H    4.058400       1.203800      -1.981000    
 H   -4.092200       3.042800      0.1163000    
 H   -5.550800       1.041500      0.2592000    
 H    6.246400      0.3230000      -1.340300    
 H    6.463600     -0.6229000      0.1171000    
 H   -2.328300      -3.663100      0.2415000    


%chk=000032094-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000032094

0 1
O -0.397883 0.783026 -0.247140
O -0.096499 -0.225234 1.856709
O -2.932147 -2.785292 -0.191935
O -0.772320 -2.024018 -0.525502
N 5.946026 -0.031707 -0.589089
C 1.822640 0.134261 0.391040
C -1.804212 0.780433 -0.123792
C -2.589340 -0.410427 -0.139550
C 2.773812 -0.339325 1.336932
C 2.277523 0.547867 -0.890920
C -2.421216 2.046844 -0.051596
C 4.595301 0.022213 -0.267223
C 0.405362 0.162438 0.781374
C -4.003741 -0.284181 -0.054234
C 4.136814 -0.395680 1.020418
C 3.639226 0.494591 -1.218401
C -3.825521 2.149001 0.017023
C -4.620626 0.978034 0.024140
C -1.975631 -1.754690 -0.297307
H 2.415654 -0.664119 2.319616
H 1.547210 0.901404 -1.623330
H -1.782112 2.934643 -0.041902
H -4.602083 -1.198593 -0.058772
H 4.858546 -0.763673 1.759573
H 3.977330 0.812389 -2.212104
H -4.295293 3.136879 0.074288
H -5.711048 1.051128 0.086947
H 6.275923 0.258131 -1.505472
H 6.628898 -0.374732 0.080700
H -2.459791 -3.652707 -0.308092


