%chk=000160605.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000160605

0 1
 O   -2.129100       1.287500       1.325700    
 O    4.643400       1.470600     -0.3311000    
 O   -3.897300      0.3902000      -1.660700    
 O   -5.965500      0.2198000     -0.7436000    
 N   -2.654300     -0.7436000      0.3379000    
 N    3.719600     -0.6948000     -0.2027000    
 C  -0.3438000     -1.4000000E-03  0.5197000    
 C    2.365200     -0.4631000      3.8500000E-02
 C   0.5335000       1.074400      0.3814000    
 C   0.1337000      -1.308100      0.4175000    
 C    1.887900      0.8435000      0.1407000    
 C    1.488100      -1.538900      0.1770000    
 C   -1.756000      0.2391000      0.7699000    
 C   -4.087500     -0.6397000      0.4926000    
 C    4.742600      0.2485000     -0.3691000    
 C   -4.757500      2.6799999E-02 -0.6813000    
 C    6.077000     -0.4108000     -0.6127000    
 H   0.1796000       2.099800      0.4532000    
 H  -0.5081000      -2.174200      0.5494000    
 H    2.504900       1.725800      4.3499999E-02
 H    1.847900      -2.562300      0.1063000    
 H   -2.317200      -1.546200     -0.1829000    
 H    3.988400      -1.674700     -0.2640000    
 H   -4.311100     -6.3299999E-02   1.395000    
 H   -4.477700      -1.656800      0.5869000    
 H    6.350300      -1.021700      0.2522000    
 H    6.845000      0.3522000     -0.7664000    
 H    6.021900      -1.042400      -1.503900    
 H   -4.357300      0.8207000      -2.412500    


%chk=000160605-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000160605

0 1
O -2.043352 1.284259 1.764308
O 4.968420 1.063062 0.749077
O -4.402520 -1.315875 -1.564816
O -6.323202 -0.543367 -0.503960
N -2.719020 -0.129693 0.066060
N 3.799615 -0.633191 -0.381798
C -0.306348 0.155786 0.483921
C 2.448083 -0.329691 -0.061717
C 0.705294 0.984741 1.031144
C 0.084384 -0.937822 -0.333504
C 2.068717 0.761640 0.767923
C 1.442689 -1.178648 -0.602572
C -1.732820 0.480041 0.825586
C -4.124877 0.132371 0.363185
C 4.965858 0.036955 0.010351
C -5.079838 -0.582856 -0.572404
C 6.258077 -0.570643 -0.531814
H 0.392471 1.812225 1.676249
H -0.656932 -1.633671 -0.743669
H 2.841098 1.407657 1.187522
H 1.728371 -2.033606 -1.229032
H -2.508599 -0.705050 -0.749733
H 3.933332 -1.450651 -0.981227
H -4.346182 1.217768 0.316162
H -4.372799 -0.163431 1.401302
H 6.917706 -0.822053 0.316197
H 6.782517 0.187605 -1.138607
H 6.108562 -1.475564 -1.146437
H -5.062106 -1.761398 -2.161198


