%chk=000093721.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093721

0 1
 O    5.053800       2.223400      0.9707000    
 N   -1.120100     -0.7540000     -0.3370000    
 C    1.445400      -1.171900       1.023600    
 C   0.8386000      -2.192800      1.2400000E-02
 C   1.1700000E-02  -1.407200      -1.029400    
 C   0.2544000     -0.4429000       1.706400    
 C   0.9333000     -0.4735000      -1.843400    
 C    2.294200     -0.1166000      0.2968000    
 C  -0.7227000      0.1909000      0.7074000    
 C    2.018700      0.2166000      -1.048500    
 C    2.235800      -1.930900       2.112300    
 C    1.868600      -3.124700     -0.6463000    
 C   -2.094000     -0.1604000      -1.247600    
 C    3.316800      0.5859000      0.9604000    
 C    2.786100       1.198300      -1.698400    
 C    4.066700       1.563900      0.3042000    
 C   -3.347300      0.2644000     -0.5293000    
 C    3.804600       1.867300      -1.025700    
 C   -4.397900     -0.6331000     -0.3991000    
 C   -3.434400       1.547600     -7.7999998E-03
 C   -5.559100     -0.2393000      0.2661000    
 C   -4.595400       1.941300      0.6577000    
 C   -5.657700       1.047800      0.7946000    
 H   0.1485000      -2.855600      0.5573000    
 H  -0.4245000      -2.134600      -1.727700    
 H   0.6162000      0.3348000       2.391800    
 H  -0.3008000      -1.163100       2.324000    
 H   0.3494000      0.2753000      -2.389000    
 H    1.434100      -1.078000      -2.612300    
 H   -1.573800      0.4917000       1.324500    
 H  -0.2928000       1.106100      0.2829000    
 H    3.183700      -2.323400       1.727800    
 H    2.469300      -1.290100       2.970000    
 H    1.655100      -2.775000       2.502400    
 H    1.390500      -3.739900      -1.416300    
 H    2.695200      -2.583300      -1.114800    
 H    2.298300      -3.811400      9.0200000E-02
 H   -2.372100     -0.8828000      -2.026700    
 H   -1.682200      0.7057000      -1.781000    
 H    3.539200      0.3873000       2.005300    
 H    2.587300       1.447000      -2.738400    
 H    4.381400       2.624700      -1.549200    
 H   -4.330900      -1.638700     -0.8048000    
 H   -2.621600       2.259900     -0.1190000    
 H    5.468100       2.864200      0.3675000    
 H   -6.386100     -0.9350000      0.3732000    
 H   -4.673600       2.944600       1.066300    
 H   -6.562000       1.354500       1.312200    


%chk=000093721-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000093721

0 1
O 5.373218 1.817086 1.188897
N -1.098043 -0.533298 -0.313918
C 1.462915 -1.235841 0.986582
C 0.780413 -2.144199 -0.090997
C -0.020605 -1.242602 -1.063583
C 0.316246 -0.465446 1.729918
C 0.955626 -0.316818 -1.852789
C 2.385466 -0.206747 0.301028
C -0.594589 0.332241 0.781553
C 2.103002 0.253782 -1.021316
C 2.212143 -2.105163 2.027722
C 1.761197 -3.070984 -0.842245
C -2.082105 0.150651 -1.179171
C 3.485537 0.345355 0.999386
C 2.935954 1.245211 -1.593892
C 4.300975 1.332817 0.410873
C -3.418876 0.410121 -0.483611
C 4.031785 1.795008 -0.898193
C -3.954767 -0.531205 0.430701
C -4.164514 1.578031 -0.777591
C -5.213171 -0.311823 1.032966
C -5.427061 1.799020 -0.180307
C -5.956422 0.853359 0.727605
H 0.036234 -2.772551 0.440761
H -0.537231 -1.893828 -1.797394
H 0.759718 0.223455 2.474663
H -0.295075 -1.208657 2.279377
H 0.385500 0.508787 -2.323374
H 1.382291 -0.899052 -2.695647
H -1.466079 0.716655 1.342636
H -0.046309 1.221426 0.384887
H 3.139539 -2.539778 1.615667
H 2.483012 -1.520412 2.926024
H 1.560400 -2.934054 2.362701
H 1.239412 -3.614370 -1.653063
H 2.598714 -2.507185 -1.290998
H 2.192991 -3.826882 -0.163124
H -2.255469 -0.504973 -2.057645
H -1.702649 1.124002 -1.583842
H 3.734325 0.017672 2.012277
H 2.720956 1.596407 -2.611132
H 4.659928 2.564780 -1.365184
H -3.360411 -1.421449 0.665361
H -3.754051 2.320602 -1.474202
H 5.886017 2.499833 0.689577
H -5.615559 -1.046871 1.739896
H -5.991653 2.708421 -0.416622
H -6.932872 1.024465 1.195082


