%chk=000108000.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000108000

0 1
 O   0.6676000       1.120900     -0.3932000    
 N    4.556400      0.6661000      -1.104100    
 N   -2.981500      -1.556700     -3.9900001E-02
 N    4.676600      0.7379000       1.125000    
 C    1.273200      -1.157100     -0.5181000    
 C    1.726700      -1.627100      0.8863000    
 C    2.442300     -0.7247000      -1.435000    
 C    2.594500     -0.5973000       1.644600    
 C    3.482000     -3.2000002E-02 -0.6389000    
 C    3.579700      2.1700000E-02  0.7313000    
 C   0.2716000     -4.5899998E-02 -0.3758000    
 C   -1.155000     -0.3688000     -0.2201000    
 C   -2.213800      0.5377000     -7.6099999E-02
 C   -3.369400     -0.2380000      3.7400000E-02
 C   -1.624200      -1.641100     -0.1977000    
 C    5.245400       1.110200     -4.1000000E-03
 C   -2.331400       1.941000     -2.7899999E-02
 C   -4.642100      0.3217000      0.1974000    
 C   -3.866400      -2.699200      3.4499999E-02
 C   -3.598000       2.514900      0.1319000    
 C   -4.734200       1.715700      0.2426000    
 H   0.7961000      -1.993600      -1.040300    
 H    2.313500      -2.547100      0.7594000    
 H   0.8655000      -1.892100       1.510900    
 H    2.093300     -9.0899996E-02  -2.258300    
 H    2.893300      -1.620000      -1.881500    
 H    3.102400      -1.089000       2.481400    
 H    1.954000      0.1865000       2.065300    
 H    4.803200      0.8262000      -2.071900    
 H   -1.144800      -2.607900     -0.2690000    
 H    6.148000       1.697400     -9.6299998E-02
 H   -1.461600       2.585500     -0.1117000    
 H   -5.530500     -0.2948000      0.2842000    
 H   -4.585000      -2.632700     -0.7864000    
 H   -3.286100      -3.621000     -5.5900000E-02
 H   -4.377400      -2.677200       1.000400    
 H   -3.695000       3.596700      0.1699000    
 H   -5.708200       2.182500      0.3660000    


%chk=000108000-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000108000

0 1
O 0.608962 1.167903 -0.975044
N 4.710020 0.716129 -0.902926
N -2.995264 -1.597810 0.080148
N 4.527645 0.764081 1.354134
C 1.342146 -1.167957 -0.784760
C 1.679428 -1.698905 0.654525
C 2.622992 -0.704900 -1.542351
C 2.346333 -0.630288 1.560323
C 3.560798 -0.022605 -0.588023
C 3.468416 0.020049 0.802408
C 0.286048 -0.038791 -0.727034
C -1.098607 -0.389686 -0.378742
C -2.199710 0.545500 -0.162111
C -3.368177 -0.236874 0.126776
C -1.641572 -1.679606 -0.219053
C 5.257568 1.171973 0.297501
C -2.303838 1.959393 -0.183141
C -4.627243 0.340175 0.396688
C -3.904608 -2.722956 0.310565
C -3.557964 2.544732 0.086334
C -4.704945 1.748246 0.372444
H 0.895762 -2.012147 -1.349414
H 2.369459 -2.558347 0.541234
H 0.758197 -2.073462 1.136842
H 2.324793 -0.017304 -2.357056
H 3.106934 -1.588141 -2.008323
H 2.722947 -1.099713 2.488076
H 1.599437 0.129099 1.867699
H 5.062748 0.909319 -1.839208
H -1.158350 -2.651113 -0.310692
H 6.159907 1.777059 0.346197
H -1.421027 2.562606 -0.408334
H -5.510524 -0.268661 0.617058
H -4.729829 -2.716396 -0.424472
H -3.351741 -3.669935 0.208277
H -4.335810 -2.676127 1.327014
H -3.657210 3.635752 0.075567
H -5.663419 2.238108 0.577170


