%chk=000071932.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000071932

0 1
 O   0.3788000      -1.578600       1.375600    
 O  -0.8545000       1.595400      0.7472000    
 N    1.897900      -1.671600     -9.7400002E-02
 N    1.710100      -1.976400       1.152900    
 N   -1.392400     -0.5960000      0.1428000    
 N   -2.891400       1.241800      0.3719000    
 C    3.192800      -1.929300     -0.7505000    
 C    4.333100      -1.133500     -7.4900001E-02
 C    4.101900      0.3399000     -6.7900002E-02
 C    3.495100      -3.426900     -0.7983000    
 C   0.8499000      -1.113700     -0.7492000    
 C    4.558200       1.122500      -1.128600    
 C    3.428800      0.9353000      0.9991000    
 C  -0.1243000      -1.058100      0.2107000    
 C    4.341700       2.500500      -1.122400    
 C    3.212400       2.313400       1.005200    
 C    3.668800       3.095800     -5.5500001E-02
 C   -1.628800      0.6705000      0.4205000    
 C   -4.144600      0.6725000      5.1600002E-02
 C   -5.139000       1.460700     -0.5247000    
 C   -4.382400     -0.6754000      0.3134000    
 C   -6.376200      0.8987000     -0.8400000    
 C   -5.619600      -1.237300     -2.3000001E-03
 C   -6.616400     -0.4501000     -0.5790000    
 H    3.109500      -1.583500      -1.790700    
 H    5.280700      -1.351800     -0.5851000    
 H    4.474700      -1.484200      0.9561000    
 H    4.414700      -3.620900      -1.359500    
 H    3.616400      -3.840700      0.2083000    
 H    2.676400      -3.968700      -1.283400    
 H   0.8430000     -0.8046000      -1.782200    
 H    5.081600      0.6704000      -1.966800    
 H    3.078700      0.3451000       1.840800    
 H    4.696500       3.109800      -1.948500    
 H    2.690800       2.777400       1.837200    
 H    3.500400       4.168700     -5.0500002E-02
 H   -2.930600       2.253000      0.4761000    
 H   -4.963900       2.512800     -0.7339000    
 H   -3.648200      -1.311900      0.7957000    
 H   -7.152500       1.511500      -1.288800    
 H   -5.810400      -2.285500      0.2090000    
 H   -7.580300     -0.8872000     -0.8227000    


%chk=000071932-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000071932

0 1
O 0.634043 -1.057917 2.064635
O -1.612459 0.456312 3.022375
N 1.919324 -1.582386 0.351595
N 1.920370 -1.613419 1.716886
N -1.325701 -0.233753 0.754166
N -3.415515 0.519188 1.585035
C 3.156754 -2.057762 -0.351545
C 4.348168 -1.109492 -0.016872
C 4.110641 0.330455 -0.447381
C 3.440659 -3.525793 0.020124
C 0.790921 -1.075611 -0.219864
C 4.387309 0.738833 -1.778242
C 3.573324 1.279320 0.460275
C -0.113774 -0.712304 0.820826
C 4.130457 2.064211 -2.195034
C 3.314956 2.605464 0.045828
C 3.590814 3.001163 -1.283202
C -2.063438 0.239303 1.851336
C -4.240500 0.413642 0.434877
C -5.606481 0.788661 0.593879
C -3.794056 -0.032712 -0.838718
C -6.502681 0.719098 -0.490576
C -4.703709 -0.096722 -1.915673
C -6.059043 0.274349 -1.758080
H 2.920692 -1.975742 -1.427926
H 5.231091 -1.528462 -0.535155
H 4.539807 -1.172309 1.069313
H 4.308182 -3.888588 -0.557938
H 3.668804 -3.620003 1.094733
H 2.575449 -4.170767 -0.210424
H 0.665194 -0.966944 -1.290244
H 4.820244 0.021209 -2.487747
H 3.360607 0.980474 1.493844
H 4.355860 2.367831 -3.223547
H 2.897002 3.325623 0.757569
H 3.391331 4.029457 -1.604140
H -3.879225 0.868584 2.428487
H -5.963154 1.134867 1.573086
H -2.747135 -0.315699 -0.957098
H -7.548360 1.012423 -0.343907
H -4.344619 -0.442806 -2.892236
H -6.754751 0.218525 -2.602021


