%chk=000217669.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000217669

0 1
O -2.445476 -2.530455 0.000156
O 5.052609 1.143610 -0.000417
O 4.898033 -1.084562 -0.000063
N -0.261102 -1.705513 -0.000023
C -1.358409 0.954530 0.000053
C 0.087321 0.748711 0.000084
C -2.212305 -0.175040 0.000044
C 0.586371 -0.581914 -0.000027
C -1.566322 -1.488889 0.000066
C 1.012982 1.820222 0.000205
C -1.947750 2.241952 -0.000021
C 1.985747 -0.824487 -0.000105
C -3.615078 -0.018290 -0.000030
C 2.859888 0.251976 0.000001
C 2.374453 1.582514 0.000174
C -3.326009 2.384780 -0.000111
C -4.167119 1.251894 -0.000101
C 4.315892 -0.024061 -0.000048
C -1.883040 -3.878411 0.000068
H 0.639734 2.846133 0.000337
H -1.306009 3.123838 -0.000015
H 2.352402 -1.857669 -0.000234
H -4.245419 -0.911144 -0.000024
H 3.091063 2.408054 0.000270
H -3.772533 3.380101 -0.000179
H -5.248177 1.384471 -0.000163
H -1.279428 -4.028785 0.901009
H -1.279373 -4.028679 -0.900853
H -2.789929 -4.492396 0.000003
H 6.032483 0.966911 -0.000556


%chk=000217669-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000217669

0 1
O -2.454228 -2.551163 0.000032
O 5.138663 1.104475 -0.000505
O 4.845548 -1.201187 -0.000192
N -0.277511 -1.681447 0.000049
C -1.373959 0.993747 0.000037
C 0.077810 0.791063 0.000090
C -2.227313 -0.162795 0.000011
C 0.570861 -0.562902 0.000076
C -1.584843 -1.475517 0.000034
C 1.026837 1.857569 0.000156
C -1.990688 2.281546 -0.000007
C 1.970193 -0.808079 0.000091
C -3.643416 -0.021645 -0.000053
C 2.883475 0.261832 0.000147
C 2.403351 1.607308 0.000174
C -3.387443 2.410610 -0.000070
C -4.221582 1.256112 -0.000093
C 4.339972 -0.055363 0.000201
C -1.837457 -3.893978 0.000006
H 0.679978 2.895742 0.000197
H -1.371709 3.183930 0.000001
H 2.324565 -1.842520 0.000083
H -4.259706 -0.924724 -0.000069
H 3.124923 2.427734 0.000226
H -3.841904 3.407583 -0.000109
H -5.311005 1.369703 -0.000145
H -1.210787 -4.028735 0.897924
H -1.210662 -4.028650 -0.897835
H -2.692057 -4.585996 -0.000083
H 6.095598 0.835146 -0.000873


