%chk=000133469.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133469

0 1
 O   0.4816000      -3.462600       1.431500    
 O    1.694600      -4.135400     -0.3645000    
 O   -2.459200      -1.246200      -1.365300    
 O   -2.352300       2.092200      0.8271000    
 N  -0.8782000      -1.742100      0.2631000    
 N    3.495100       1.264000      0.5062000    
 N   -3.808400      0.3298000      0.4258000    
 N    5.034000       2.873900       1.147600    
 N    4.621500       2.667800      -1.084500    
 N   -3.896400       3.698300     -0.7868000    
 C    1.099300      -1.201000      -1.117100    
 C   0.1361000      -2.277500     -0.6091000    
 C    1.876800     -0.4792000     -9.9999998E-03
 C    2.781000      0.6041000     -0.5882000    
 C   0.8533000      -3.393900      0.1264000    
 C   -2.103200      -1.266000     -0.1890000    
 C   -2.959300     -0.7343000      0.9420000    
 C   -3.425300       1.657200      0.4148000    
 C    4.324300       2.205200      0.1781000    
 C   -4.515500       2.545900     -0.1479000    
 H   0.5314000     -0.4596000      -1.693700    
 H    1.815600      -1.660200      -1.810400    
 H  -0.3714000      -2.740300      -1.464100    
 H    1.181700     -2.2800000E-02  0.7051000    
 H    2.484800      -1.195900      0.5550000    
 H  -0.6730000      -1.694400       1.257300    
 H    3.492100      0.1449000      -1.285700    
 H    2.169700       1.332000      -1.135400    
 H   -2.344000     -0.3438000       1.758100    
 H   -3.602500      -1.537100       1.312700    
 H   -4.718500      6.5800004E-02  6.0199998E-02
 H   0.9590000      -4.173300       1.910400    
 H   -5.169200       2.861900      0.6710000    
 H   -5.113400       2.003400     -0.8867000    
 H    4.923200       2.644800       2.129400    
 H    5.688000       3.612100      0.9119000    
 H    4.186700       2.286000      -1.916900    
 H    5.292700       3.415800      -1.222300    
 H   -4.623700       4.307800      -1.159000    
 H   -3.397800       4.250000     -8.9199997E-02


%chk=000133469-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000133469

0 1
O 0.525359 -3.224675 1.707204
O 1.437384 -4.276841 -0.155144
O -1.879753 -0.512635 -1.460537
O -4.480101 1.964147 1.887831
N -0.716279 -1.363794 0.363533
N 4.219109 0.787305 0.229052
N -3.551115 0.956639 0.019332
N 5.684204 2.480453 0.940170
N 5.154134 2.391082 -1.344907
N -6.037739 3.634443 0.362946
C 1.330430 -1.352613 -1.126219
C 0.181283 -2.182163 -0.467309
C 2.281573 -0.684200 -0.115108
C 3.330780 0.214475 -0.800524
C 0.773442 -3.339795 0.327853
C -1.692059 -0.583271 -0.202233
C -2.561741 0.209771 0.787522
C -4.460547 1.786129 0.627593
C 4.972671 1.819346 -0.074115
C -5.474695 2.465455 -0.311465
H 0.841442 -0.592916 -1.764515
H 1.891619 -2.035202 -1.793018
H -0.417239 -2.616560 -1.291296
H 1.713195 -0.062528 0.602573
H 2.826038 -1.442591 0.480173
H -0.608549 -1.425156 1.378913
H 3.905873 -0.407123 -1.527375
H 2.799250 0.996711 -1.398677
H -1.935000 0.897119 1.390317
H -3.055197 -0.474146 1.506857
H -3.492176 0.839900 -1.000074
H 0.959685 -3.975729 2.193463
H -6.232423 1.688010 -0.578103
H -4.960394 2.742109 -1.255996
H 5.521751 2.116560 1.877928
H 6.606612 2.862661 0.735537
H 4.758618 1.930303 -2.159135
H 5.432062 3.365903 -1.435327
H -6.976115 3.907969 0.070423
H -5.904192 3.592747 1.379757


