%chk=000105556.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000105556

0 1
 O  -2.3499999E-02   1.928600       1.941000    
 O   -1.348100       2.590000      -2.592900    
 O  -0.3050000       3.254100     -0.6856000    
 O   -5.195600      -1.999100      0.5088000    
 O   -3.645400      -2.440800       2.111300    
 N    3.363000     -4.9199998E-02  0.3717000    
 C    2.468200      0.7327000       1.052000    
 C    2.704600     -0.8345000     -0.5475000    
 C    1.210100      0.4534000      0.5703000    
 C    1.344100     -0.5368000     -0.4428000    
 C    4.795500     -5.1800001E-02  0.5871000    
 C   1.8000000E-03   1.075000       1.036800    
 C    3.204100      -1.775900      -1.454400    
 C    2.899800       1.678000       2.105000    
 C   0.4359000      -1.210700      -1.283300    
 C   -1.325400      0.7098000      0.4557000    
 C    5.216800      -1.062100       1.640300    
 C    2.284400      -2.431700      -2.277700    
 C   0.9212000      -2.155000      -2.195100    
 C   -1.812600       1.397100     -0.6324000    
 C   -2.014600     -0.3235000       1.051600    
 C   -3.256400     -0.6873000      0.5308000    
 C   -3.054600       1.033300      -1.153000    
 C   -3.776300     -8.8000000E-03 -0.5715000    
 C   -1.082900       2.489700      -1.262600    
 C   -4.008800      -1.774500       1.136500    
 H    5.284900     -0.2765000     -0.3668000    
 H    5.119700      0.9590000      0.8536000    
 H    4.262100      -2.003700      -1.525300    
 H    2.965400       2.692300       1.698100    
 H    2.192500       1.689800       2.940000    
 H    3.865400       1.429100       2.551400    
 H  -0.6320000      -1.044600      -1.271200    
 H    4.746500     -0.8547000       2.606900    
 H    6.302200      -1.035600       1.777100    
 H    4.936600      -2.079300       1.346700    
 H    2.639200      -3.169900      -2.992400    
 H   0.2257000      -2.678500      -2.846000    
 H   -1.597300     -0.8433000       1.909800    
 H   -3.493000       1.550600      -2.002600    
 H   -4.740000     -0.2577000      -1.006900    
 H  -0.8522000       3.326800      -3.009400    
 H   -5.695300      -2.733600      0.9250000    


%chk=000105556-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000105556

0 1
O -0.104846 1.894868 2.026103
O -1.792533 2.923819 -2.576145
O 0.013092 2.841394 -1.123642
O -5.393571 -1.988325 0.696034
O -3.734918 -2.351097 2.280723
N 3.446863 -0.010278 0.418134
C 2.500635 0.752585 1.099473
C 2.801606 -0.815654 -0.544664
C 1.211998 0.460602 0.577858
C 1.393839 -0.539429 -0.477824
C 4.895799 -0.040062 0.686060
C -0.023277 1.089268 1.037530
C 3.364860 -1.738516 -1.449812
C 2.897681 1.722756 2.172863
C 0.535281 -1.233748 -1.370889
C -1.347908 0.698878 0.386444
C 5.308754 -1.205943 1.611527
C 2.486776 -2.409296 -2.325748
C 1.087516 -2.157233 -2.282325
C -1.893671 1.344989 -0.762476
C -2.114464 -0.295778 1.032499
C -3.392359 -0.662311 0.545367
C -3.181428 0.981941 -1.241372
C -3.929742 -0.018652 -0.598992
C -1.115406 2.410318 -1.455815
C -4.139155 -1.728760 1.270442
H 5.421472 -0.112574 -0.283631
H 5.182884 0.924628 1.137065
H 4.441817 -1.935274 -1.479380
H 3.522239 2.541272 1.764089
H 1.987339 2.164794 2.602829
H 3.474711 1.231652 2.979725
H -0.544673 -1.067623 -1.361839
H 4.816154 -1.122093 2.595999
H 6.402303 -1.196147 1.769681
H 5.030440 -2.179825 1.173129
H 2.886155 -3.133441 -3.044165
H 0.425055 -2.693441 -2.970727
H -1.728257 -0.799245 1.924521
H -3.576969 1.498301 -2.119412
H -4.919296 -0.305150 -0.963533
H -1.227336 3.630334 -2.989042
H -5.844759 -2.702304 1.221439


