%chk=000013935.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000013935

0 1
 O   0.1784000      -1.504500     -0.6811000    
 O   0.5904000       2.896700      0.7635000    
 O   -3.558900       1.183100     -0.1396000    
 N   0.4785000      0.7345000     -0.1101000    
 N   -1.463600       2.035000      0.2528000    
 C    1.894800      0.5491000      9.4800003E-02
 C    2.153000     -0.5273000       1.152300    
 C    2.587900      0.2090000      -1.226900    
 C    3.646200     -0.7782000       1.346000    
 C    4.080400     -4.4500001E-02  -1.030500    
 C    4.335600      -1.115000      2.6900001E-02
 C   -1.661600     -3.9999999E-04  -1.052700    
 C  -0.2630000     -0.3589000     -0.5845000    
 C   -2.551200      -1.239500      -1.140600    
 C  -7.3899999E-02   1.958600      0.3150000    
 C   -2.834400      -1.884600      0.2247000    
 C   -2.338600       1.092700     -0.2600000    
 C   -1.554300      -2.286800      0.9584000    
 C   -3.645700     -0.9189000       1.091500    
 H    2.346900       1.478400      0.4625000    
 H    1.699600      -1.492700      0.9188000    
 H    1.714200     -0.2144000       2.108300    
 H    2.452600       1.034100      -1.937600    
 H    2.158200     -0.6761000      -1.707400    
 H    3.794800      -1.596100       2.060200    
 H    4.111800      0.1138000       1.783100    
 H    4.572200      0.8889000     -0.7299000    
 H    4.531700     -0.3496000      -1.981300    
 H    5.413800      -1.221700      0.1909000    
 H    3.970000      -2.082500     -0.3386000    
 H   -1.538800      0.3987000      -2.069600    
 H   -3.503800     -0.9819000      -1.622100    
 H   -2.080700      -1.987200      -1.792500    
 H   -3.436300      -2.786100      5.4000001E-02
 H   -1.885100       2.856600      0.6771000    
 H  -0.9831000      -1.459200       1.383000    
 H  -0.9584000      -3.006700      0.3920000    
 H   -1.860100      -2.856600       1.848700    
 H   -3.064000     -0.1552000       1.612200    
 H   -4.038400      -1.514700       1.930400    
 H   -4.557800     -0.5704000      0.5993000    


%chk=000013935-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000013935

0 1
O 0.263726 -1.373737 -1.451129
O 0.456292 2.592062 1.052949
O -3.557850 1.574764 -1.006128
N 0.410908 0.585879 -0.187404
N -1.527780 1.996247 0.024551
C 1.880044 0.375458 0.106354
C 2.126058 -0.889760 0.963475
C 2.736550 0.390352 -1.183117
C 3.631052 -0.995004 1.315056
C 4.237053 0.272831 -0.815454
C 4.509559 -0.986980 0.041636
C -1.783176 -0.094896 -1.274905
C -0.301825 -0.353524 -0.973367
C -2.691624 -1.340881 -0.969561
C -0.173594 1.765605 0.341994
C -2.890443 -1.804144 0.501869
C -2.382917 1.202595 -0.753875
C -1.598505 -2.328880 1.173315
C -3.592955 -0.759863 1.403911
H 2.157577 1.257378 0.712546
H 1.809312 -1.788025 0.404183
H 1.522186 -0.835328 1.889910
H 2.551973 1.329286 -1.740124
H 2.445897 -0.453179 -1.833254
H 3.809205 -1.917859 1.899334
H 3.921376 -0.143010 1.964192
H 4.555017 1.174244 -0.251602
H 4.841493 0.246027 -1.742165
H 5.580446 -1.034260 0.318117
H 4.289936 -1.892718 -0.559593
H -1.825952 -0.004831 -2.381287
H -3.681489 -1.102319 -1.402224
H -2.262234 -2.178350 -1.550317
H -3.581786 -2.669902 0.412235
H -1.909196 2.873822 0.393973
H -0.893333 -1.507478 1.399648
H -1.071691 -3.056490 0.530293
H -1.840837 -2.822316 2.132812
H -2.926327 0.091594 1.637729
H -3.878728 -1.220572 2.367673
H -4.504115 -0.354337 0.929149


