%chk=000101206.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000101206

0 1
 O   -2.314200       1.971900     -0.4437000    
 O    2.330800      -1.996500     -0.3944000    
 N   -3.177300     -0.2002000     -0.4873000    
 N    3.188700      0.1754000     -0.5017000    
 N  -1.0000000E-03 -6.0000001E-03 -6.4900003E-02
 C   -3.079900      -1.613200     -0.1284000    
 C   -4.352600      0.1744000      -1.261200    
 C    3.041600       1.587900     -0.1575000    
 C    4.381000     -0.1671000      -1.264200    
 C   -2.240600      0.7806000     -0.1449000    
 C    2.239300     -0.7916000     -0.1207000    
 C   -1.070100      0.3802000      0.6519000    
 C    1.082500     -0.3762000      0.6536000    
 C   -2.339300      -2.404700      -1.186500    
 C   -5.504900      0.5729000     -0.3624000    
 C    2.280800       2.343500      -1.227500    
 C    5.540300     -0.5166000     -0.3541000    
 C   -1.136200      0.4235000       2.025800    
 C    1.133100     -0.3735000       2.038300    
 C  -1.8000000E-03  3.5200000E-02   2.729900    
 H   -2.560300      -1.720100      0.8278000    
 H   -4.087900      -2.018100      1.5200000E-02
 H   -4.098500       1.022000      -1.907800    
 H   -4.640200     -0.6556000      -1.915600    
 H    4.036800       2.026700     -2.2299999E-02
 H    2.525500       1.699100      0.7997000    
 H    4.642700      0.6608000      -1.931700    
 H    4.153000      -1.034900      -1.893100    
 H   -2.855600      -2.355500      -2.150800    
 H   -1.323500      -2.029300      -1.338400    
 H   -2.270700      -3.457100     -0.8938000    
 H   -5.804000     -0.2533000      0.2907000    
 H   -5.233000       1.419500      0.2769000    
 H   -6.372900      0.8637000     -0.9620000    
 H    2.177200       3.396100     -0.9460000    
 H    1.278700       1.936000      -1.384600    
 H    2.805200       2.302200      -2.187800    
 H    6.419700     -0.7907000     -0.9450000    
 H    5.290100      -1.360900      0.2970000    
 H    5.810900      0.3281000      0.2874000    
 H   -2.028800      0.7446000       2.551000    
 H    2.024400     -0.6779000       2.576600    
 H  -2.0999999E-03  5.1399998E-02   3.815600    


%chk=000101206-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000101206

0 1
O -2.869958 1.981937 0.956359
O 2.861187 -1.953416 0.999402
N -2.837267 0.101284 -0.421430
N 2.832466 -0.102550 -0.418232
N -0.003286 0.011536 0.671411
C -2.434788 -1.295107 -0.719247
C -4.005162 0.638589 -1.166003
C 2.431071 1.287142 -0.747131
C 3.999692 -0.657427 -1.150811
C -2.336010 0.872380 0.610861
C 2.329217 -0.850710 0.629820
C -1.117102 0.389477 1.373426
C 1.110994 -0.349322 1.381576
C -1.606679 -1.442345 -2.010855
C -5.346861 0.322427 -0.469783
C 1.601437 1.406134 -2.040735
C 5.341655 -0.328913 -0.460899
C -1.143567 0.458742 2.788402
C 1.138382 -0.384719 2.797773
C -0.002391 0.045536 3.509522
H -1.859622 -1.691212 0.132521
H -3.362709 -1.897914 -0.793040
H -3.880409 1.731745 -1.243313
H -3.982179 0.211318 -2.185131
H 3.359517 1.887084 -0.835871
H 1.857538 1.703176 0.096235
H 3.977726 -0.251402 -2.178614
H 3.873088 -1.751741 -1.205381
H -2.134687 -1.021684 -2.886041
H -0.640044 -0.927130 -1.893435
H -1.412237 -2.511666 -2.213801
H -5.494721 -0.766400 -0.347209
H -5.375942 0.799240 0.524072
H -6.189363 0.715093 -1.068035
H 1.407376 2.470829 -2.267065
H 0.634701 0.894206 -1.910626
H 2.128190 0.965888 -2.907008
H 6.183771 -0.734568 -1.050965
H 5.370098 -0.785516 0.542423
H 5.490689 0.762010 -0.360344
H -2.043276 0.828582 3.287314
H 2.038436 -0.742431 3.304855
H -0.002072 0.058521 4.604132


