%chk=000087418.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000087418

0 1
 O   0.1160000     -0.7155000       1.965200    
 N    4.535700      -1.032800     -0.3908000    
 C  -0.2802000     -0.3555000      0.6246000    
 C   0.7497000      -1.106400     -0.2423000    
 C  -0.1454000       1.169100      0.4507000    
 C   -1.707400     -0.8729000      0.3633000    
 C    2.164100     -0.6833000      0.1197000    
 C    3.179600      -1.453000     -0.7232000    
 C  -0.4985000       1.829500     -0.7477000    
 C   -2.387500     -0.6393000     -0.8531000    
 C   0.3807000       1.961200       1.497300    
 C   -2.375700      -1.643400       1.342700    
 C   -1.005000       1.151900      -1.946900    
 C   -1.817700      8.9900002E-02  -1.992300    
 C  -0.3165000       3.223000     -0.8634000    
 C   -3.678300      -1.171100      -1.051300    
 C   0.5420000       3.342900       1.372200    
 C   -3.660200      -2.151900       1.136600    
 C   0.1925000       3.975300      0.1904000    
 C   -4.313200      -1.915100     -6.1700001E-02
 C    5.512600      -1.742600      -1.218500    
 C    4.812700      -1.260000       1.028600    
 H   0.6536000      -2.189300     -7.8900002E-02
 H   0.5929000     -0.9518000      -1.314200    
 H    2.314200      0.3884000     -5.2400000E-02
 H    2.326300     -0.8785000       1.182800    
 H    3.050600      -2.533000     -0.5719000    
 H    2.983600      -1.248100      -1.783300    
 H   0.6805000       1.513200       2.441700    
 H   -1.913000      -1.863500       2.301400    
 H   0.2354000      -1.679500       2.014700    
 H  -0.6995000       1.589000      -2.896200    
 H   -2.119900     -0.2671000      -2.975600    
 H  -0.5768000       3.739700      -1.785800    
 H   -4.207000      -1.004500      -1.988600    
 H   0.9465000       3.918400       2.199700    
 H   -4.143600      -2.735000       1.915000    
 H   0.3202000       5.048100      8.4200002E-02
 H   -5.309700      -2.311200     -0.2307000    
 H    5.325500      -1.554400      -2.281700    
 H    5.488400      -2.825300      -1.049900    
 H    6.526900      -1.383100      -1.012300    
 H    4.304300     -0.5306000       1.666600    
 H    5.879800      -1.112800       1.236600    
 H    4.551400      -2.274400       1.351700    


%chk=000087418-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000087418

0 1
O -0.047923 -0.631805 2.139778
N 4.566493 -1.134350 -0.523965
C -0.351013 -0.332013 0.720512
C 0.707533 -1.093481 -0.145630
C -0.233225 1.195239 0.578008
C -1.778492 -0.825953 0.381296
C 2.163994 -0.642198 0.098978
C 3.160350 -1.600011 -0.585965
C -0.412146 1.838138 -0.690554
C -2.316968 -0.717815 -0.943416
C 0.145936 1.972739 1.698146
C -2.544561 -1.477567 1.378107
C -0.911536 1.186089 -1.908396
C -1.725225 0.084220 -2.021269
C -0.123169 3.233234 -0.791890
C -3.551263 -1.373156 -1.234005
C 0.385879 3.358553 1.583815
C -3.783895 -2.084627 1.080922
C 0.266930 3.992410 0.324907
C -4.280028 -2.054494 -0.242986
C 5.440435 -1.916684 -1.421638
C 5.104207 -1.084442 0.850368
H 0.598118 -2.174885 0.092803
H 0.460890 -0.988248 -1.215457
H 2.323965 0.375215 -0.301952
H 2.350199 -0.594864 1.188264
H 3.048600 -2.628020 -0.141279
H 2.889164 -1.687898 -1.657190
H 0.275468 1.465740 2.656268
H -2.160083 -1.497847 2.401810
H 0.112343 -1.606877 2.210950
H -0.683159 1.721342 -2.840982
H -2.076785 -0.165889 -3.032164
H -0.239133 3.720791 -1.767543
H -3.949938 -1.308666 -2.253799
H 0.685599 3.934379 2.466517
H -4.350454 -2.586423 1.873258
H 0.472470 5.063269 0.219065
H -5.229305 -2.540956 -0.492562
H 5.057793 -1.859749 -2.456600
H 5.515753 -2.999487 -1.140369
H 6.460685 -1.492409 -1.411326
H 4.520372 -0.381216 1.467091
H 6.147049 -0.720957 0.822943
H 5.098677 -2.083672 1.360129


