%chk=000071632.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000071632

0 1
 O   -1.147000     -0.2166000      -2.060800    
 O    3.677900       1.785200      0.1492000    
 O    4.421800     -0.8531000      0.6068000    
 N   -3.297400      0.2108000     -0.2327000    
 C   -1.944800     -0.1089000      0.2410000    
 C  -0.9038000      0.3876000     -0.7874000    
 C   0.5256000      5.7999998E-02 -0.4135000    
 C   -1.762900      0.5331000       1.617800    
 C   -4.294500     -0.3006000      0.6913000    
 C    1.448100       1.083600     -0.3045000    
 C   0.8778000      -1.261400     -0.1897000    
 C   -5.699800      1.1600000E-02  0.2197000    
 C    2.765400      0.7800000      3.9500002E-02
 C    2.194800      -1.565000      0.1542000    
 C    3.138700     -0.5444000      0.2690000    
 H   -1.865300      -1.198800      0.3412000    
 H   -1.015500       1.470000     -0.9287000    
 H   -3.442800     -0.1932000      -1.157400    
 H  -0.7139000      0.5077000       1.931500    
 H   -2.070900       1.585200       1.622400    
 H   -2.306100      1.0000000E-03   2.405200    
 H   -4.195000      -1.386300      0.8085000    
 H   -4.216900      0.1566000       1.681700    
 H    1.155500       2.114800     -0.4830000    
 H   0.1605000      -2.070500     -0.2856000    
 H   -1.583300      -1.073800      -1.920800    
 H   -5.856800       1.091800      0.1280000    
 H   -5.901900     -0.4467000     -0.7543000    
 H   -6.435600     -0.3764000      0.9317000    
 H    2.480000      -2.598800      0.3294000    
 H    3.241300       2.632600     -4.4199999E-02
 H    4.936100     -2.7799999E-02  0.6408000    


%chk=000071632-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000071632

0 1
O -1.376446 -0.011169 -1.928762
O 3.882358 1.702071 -0.210360
O 4.554960 -0.851166 0.345924
N -3.357993 0.267888 -0.005320
C -2.014320 -0.119301 0.476507
C -0.990994 0.434362 -0.552295
C 0.462541 0.094020 -0.267649
C -1.737941 0.447544 1.885793
C -4.502238 -0.388572 0.659052
C 1.455042 1.103574 -0.358639
C 0.868750 -1.234529 0.029777
C -5.817679 -0.029708 -0.054796
C 2.807472 0.785193 -0.151517
C 2.229516 -1.554203 0.233093
C 3.207121 -0.545709 0.144551
H -1.903069 -1.236917 0.520335
H -1.132552 1.529211 -0.598756
H -3.394969 0.147598 -1.029517
H -0.728038 0.171189 2.236082
H -1.826824 1.549131 1.870809
H -2.467814 0.058869 2.617484
H -4.389734 -1.504048 0.693077
H -4.556953 -0.046848 1.710735
H 1.159035 2.133464 -0.597845
H 0.121154 -2.030733 0.119082
H -0.950336 -0.890921 -2.096963
H -5.963499 1.064879 -0.060138
H -5.808415 -0.378326 -1.105447
H -6.680988 -0.499335 0.450121
H 2.549786 -2.574192 0.464882
H 3.581974 2.614318 -0.436509
H 5.090392 -0.020333 0.243511


