%chk=000047376.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000047376

0 1
 N   0.8939000       1.074800      -1.515200    
 C   0.6271000      0.7393000     -0.1127000    
 C    1.862700     -6.0000003E-04  0.4738000    
 C   0.3961000       2.030400      0.7207000    
 C    2.268800      -1.287200     -0.2628000    
 C  -0.7587000       2.919500      0.2632000    
 C  -0.5639000     -0.1350000     -2.7600000E-02
 C    3.522400      -1.897800      0.3471000    
 C   -1.533800     -0.8406000      4.2300001E-02
 C   -2.718600      -1.701900      0.1289000    
 C   -3.995900     -0.9010000     -5.7599999E-02
 H    1.669600     -0.2520000       1.526300    
 H    2.723600      0.6827000      0.4758000    
 H   0.2132000       1.757500       1.769200    
 H    1.310600       2.638800      0.7177000    
 H    1.459900      -2.024400     -0.2178000    
 H    2.463400      -1.079200      -1.320600    
 H    1.691400       1.707300      -1.573100    
 H   0.1044000       1.576600      -1.918700    
 H  -0.8594000       3.772300      0.9429000    
 H   -1.711100       2.381200      0.2656000    
 H  -0.5868000       3.320200     -0.7399000    
 H    4.367100      -1.204300      0.2850000    
 H    3.362300      -2.152500       1.399600    
 H    3.795400      -2.813700     -0.1863000    
 H   -2.742500      -2.203300       1.102700    
 H   -2.665000      -2.484600     -0.6359000    
 H   -4.092000     -0.1251000      0.7098000    
 H   -4.869700      -1.556800      1.0100000E-02
 H   -4.014700     -0.4084000      -1.036000    


%chk=000047376-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000047376

0 1
N 0.929863 1.109413 -1.516457
C 0.662073 0.771566 -0.088474
C 1.922148 0.032294 0.476080
C 0.400980 2.048038 0.800277
C 2.251721 -1.305049 -0.214977
C -0.773616 2.925888 0.327233
C -0.532470 -0.109579 -0.028525
C 3.564290 -1.926393 0.308974
C -1.538352 -0.821179 0.056164
C -2.739592 -1.674533 0.141920
C -4.058695 -0.906854 -0.141271
H 1.774889 -0.132435 1.562329
H 2.785872 0.724551 0.372460
H 0.222540 1.721304 1.843638
H 1.338098 2.643459 0.804467
H 1.413322 -2.010278 -0.054586
H 2.311548 -1.131763 -1.305187
H 1.703335 1.775974 -1.628203
H 0.093851 1.389217 -2.038942
H -0.909800 3.792570 0.999352
H -1.716265 2.348805 0.317402
H -0.600946 3.318984 -0.692377
H 4.426090 -1.255764 0.125983
H 3.513343 -2.114687 1.398879
H 3.778353 -2.890302 -0.188894
H -2.790518 -2.131803 1.150184
H -2.642389 -2.515060 -0.573615
H -4.194743 -0.082289 0.580172
H -4.925691 -1.587398 -0.060539
H -4.049439 -0.474497 -1.156965


