%chk=000103944.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000103944

0 1
 O    2.922800       1.444400     -0.6200000    
 N   -1.678600      0.4555000      5.8200002E-02
 N    2.986400     -0.8503000     -8.2999997E-02
 C   -1.333300       1.825600     -0.3014000    
 C   -3.085400      0.1328000      0.2578000    
 C  -0.6918000     -0.5202000      0.1940000    
 C  -0.8671000       2.595600      0.9316000    
 C   -3.667100     -0.5028000      -1.002400    
 C   0.6592000     -0.2029000     -1.2300000E-02
 C   -1.033000      -1.836200      0.5403000    
 C  -0.5209000       4.035900      0.5870000    
 C   -5.142100     -0.8301000     -0.8274000    
 C    1.646200      -1.179000      0.1243000    
 C  -4.6000000E-02  -2.812300      0.6772000    
 C    1.293600      -2.483800      0.4690000    
 C    3.527900      0.3940000     -0.4314000    
 C    5.029100      0.3337000     -0.5615000    
 H  -0.6087000       1.872400      -1.122900    
 H   -2.221800       2.329500     -0.7061000    
 H   -3.246000     -0.4892000       1.146100    
 H   -3.644200       1.053900      0.4725000    
 H   -1.659700       2.591500       1.690200    
 H   5.2999998E-03   2.125000       1.396700    
 H   -3.552300      0.1844000      -1.849800    
 H   -3.132200      -1.418900      -1.274000    
 H   0.9210000      0.8055000     -0.2789000    
 H   -2.054400      -2.157000      0.7156000    
 H   0.2945000       4.078100     -0.1423000    
 H   -1.386200       4.558800      0.1675000    
 H  -0.2018000       4.574300       1.485000    
 H   -5.290300      -1.543800     -1.0800000E-02
 H   -5.721300      7.2099999E-02 -0.6062000    
 H   -5.543100      -1.274200      -1.744000    
 H  -0.3197000      -3.828500      0.9456000    
 H    2.052100      -3.254700      0.5792000    
 H    3.645000      -1.617400      3.5900000E-02
 H    5.472100      5.4600000E-02  0.3986000    
 H    5.415000       1.312300     -0.8602000    
 H    5.306700     -0.4032000      -1.320500    


%chk=000103944-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000103944

0 1
O 3.058724 1.455760 -0.397635
N -1.678202 0.402079 0.025250
N 3.094750 -0.873705 -0.067624
C -1.357916 1.803553 -0.311166
C -3.094332 0.082508 0.277750
C -0.678775 -0.576094 0.114384
C -0.951104 2.670749 0.908143
C -3.859356 -0.433702 -0.968494
C 0.698861 -0.215172 -0.020528
C -0.998368 -1.954458 0.340327
C -0.598156 4.114221 0.491204
C -5.338083 -0.742663 -0.651199
C 1.707808 -1.198186 0.063327
C 0.027057 -2.915487 0.430657
C 1.384225 -2.562930 0.293961
C 3.696026 0.363912 -0.283722
C 5.221864 0.321480 -0.380908
H -0.553856 1.832623 -1.070945
H -2.250688 2.252282 -0.789776
H -3.172316 -0.658534 1.097272
H -3.592232 1.000245 0.647812
H -1.783238 2.675239 1.640166
H -0.085620 2.203530 1.413170
H -3.794502 0.329385 -1.768967
H -3.354647 -1.338151 -1.357942
H 1.010503 0.816549 -0.177137
H -2.037531 -2.281409 0.429919
H 0.269303 4.124177 -0.194762
H -1.446213 4.604248 -0.025018
H -0.337211 4.730704 1.370032
H -5.425651 -1.523882 0.127875
H -5.865576 0.157850 -0.282555
H -5.873416 -1.101882 -1.548328
H -0.241517 -3.964175 0.602829
H 2.171374 -3.323519 0.363114
H 3.727958 -1.672265 0.009091
H 5.647338 0.998062 0.380055
H 5.528075 0.707608 -1.368659
H 5.654539 -0.685150 -0.243772


