%chk=000117378.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000117378

0 1
 N   -3.319000      -1.043500      0.2379000    
 N   6.8000004E-02  6.1400000E-02 -0.7466000    
 C   -2.320800     -0.2896000     -0.5071000    
 C   -2.571700       1.213200     -0.3463000    
 C   -3.979900       1.569200     -0.8224000    
 C  -0.9300000     -0.6641000     -5.5000000E-03
 C   -5.011500      0.6625000     -0.1983000    
 C   -4.639600     -0.6094000      0.2811000    
 C    1.419100     -0.2622000     -0.2886000    
 C   -6.350600       1.073600     -0.1355000    
 C   -5.623100      -1.422500      0.8633000    
 C    2.466300      0.5415000      -1.060400    
 C    3.865600      0.2007000     -0.6132000    
 C   -7.316000      0.2444000      0.4313000    
 C   -6.951800      -1.000900      0.9348000    
 C    4.443400      0.9185000      0.4230000    
 C    4.551100     -0.8255000      -1.245800    
 C    5.737700      0.6026000      0.8365000    
 C    6.438500     -0.4273000      0.2088000    
 C    5.845100      -1.141200     -0.8324000    
 C    6.353500       1.381800       1.951800    
 C    7.825400     -0.7833000      0.6338000    
 H   -2.410300     -0.5591000      -1.568500    
 H   -1.851300       1.808400     -0.9185000    
 H   -2.462800       1.500800      0.7085000    
 H   -4.042500       1.470900      -1.912900    
 H   -4.188900       2.614200     -0.5652000    
 H  -0.7827000      -1.746000     -0.1190000    
 H  -0.8532000     -0.4416000       1.066900    
 H   -3.120200      -2.003400      0.4964000    
 H  -1.3200000E-02 -0.1414000      -1.742500    
 H    1.510500     -4.0500000E-02  0.7822000    
 H    1.608700      -1.335500     -0.4178000    
 H   -6.645100       2.045400     -0.5236000    
 H   -5.359800      -2.399800       1.262300    
 H    2.290800       1.617800     -0.9311000    
 H    2.373100      0.3533000      -2.138400    
 H   -8.350500      0.5706000      0.4827000    
 H   -7.701800      -1.646400       1.382600    
 H    3.890500       1.718600      0.9085000    
 H    4.096700      -1.388400      -2.056000    
 H    6.376800      -1.946800      -1.332000    
 H    6.601400      0.7240000       2.791100    
 H    7.258900       1.894200       1.610500    
 H    5.672600       2.150200       2.334600    
 H    8.499900      6.8999998E-02  0.5022000    
 H    7.838400      -1.100000       1.681700    
 H    8.231500      -1.610700      4.1400000E-02


%chk=000117378-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000117378

0 1
N -3.432247 -1.047801 -0.029915
N 0.094280 -0.105144 -0.913766
C -2.372869 -0.198303 -0.594578
C -2.600017 1.261951 -0.146795
C -4.014835 1.737544 -0.546640
C -0.995722 -0.746779 -0.156103
C -5.087511 0.770309 -0.055385
C -4.744213 -0.600568 0.175446
C 1.456412 -0.421108 -0.434391
C -6.414333 1.188065 0.183262
C -5.747144 -1.505784 0.626669
C 2.524791 0.320386 -1.276899
C 3.931647 0.072583 -0.754345
C -7.413440 0.290255 0.626062
C -7.066807 -1.064116 0.846101
C 4.498654 0.923483 0.227560
C 4.694620 -1.036746 -1.192093
C 5.783285 0.695166 0.776599
C 6.541578 -0.430317 0.329241
C 5.978321 -1.278800 -0.654929
C 6.343775 1.640958 1.824615
C 7.924113 -0.712308 0.890556
H -2.410512 -0.221354 -1.712721
H -1.817760 1.894539 -0.601099
H -2.484001 1.314922 0.953471
H -4.067152 1.831292 -1.651810
H -4.205901 2.748871 -0.140918
H -0.998969 -1.865374 -0.262023
H -0.850970 -0.532539 0.920188
H -3.249175 -2.048730 0.047764
H 0.001437 -0.278392 -1.925603
H 1.534934 -0.093162 0.620397
H 1.682504 -1.517014 -0.445221
H -6.669560 2.242980 0.016008
H -5.483567 -2.556449 0.806548
H 2.279940 1.398596 -1.259860
H 2.445416 -0.016190 -2.330842
H -8.436744 0.639097 0.799518
H -7.823619 -1.777687 1.192440
H 3.922987 1.792677 0.573260
H 4.287749 -1.708956 -1.958120
H 6.557865 -2.140884 -1.007750
H 6.565715 1.113799 2.772888
H 7.292827 2.103872 1.491090
H 5.632900 2.454048 2.049532
H 8.620799 0.127909 0.703553
H 7.896601 -0.862247 1.987364
H 8.361118 -1.618849 0.437972


