%chk=000104406.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000104406

0 1
 O  -0.2768000      -2.170300      0.9284000    
 O   -1.919900      0.2320000      0.4073000    
 O   -1.846100      -1.136400      -1.471200    
 N    1.001200     -0.5497000     -0.1967000    
 C    3.165000       1.353000     -7.8999996E-03
 C    3.042200      0.1844000      0.9689000    
 C    1.795100       1.756400     -0.5523000    
 C    2.289900     -0.9847000      0.3396000    
 C    1.062100      0.5600000      -1.154500    
 C  -0.1591000      -1.214200      0.1733000    
 C   -1.419500     -0.7069000     -0.4165000    
 C   -3.150300      0.8236000     -2.0199999E-02
 C   -3.583900       1.852800       1.001700    
 H    3.632900       2.208100      0.4921000    
 H    3.820100       1.067500     -0.8400000    
 H    4.038000     -0.1412000       1.288800    
 H    2.506600      0.5213000       1.865300    
 H    1.194200       2.176500      0.2641000    
 H    1.910800       2.541500      -1.307500    
 H    2.864800      -1.407400     -0.4929000    
 H    2.150300      -1.779300       1.079900    
 H   6.7699999E-02  0.8704000      -1.483000    
 H    1.595900      0.1927000      -2.039100    
 H   -3.004500       1.306000     -0.9932000    
 H   -3.917100      4.6200000E-02 -0.1120000    
 H   -4.523800       2.326600      0.7052000    
 H   -3.716500       1.388100       1.984400    
 H   -2.818300       2.627200       1.117200    


%chk=000104406-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000104406

0 1
O -0.193056 -2.072717 1.051950
O -1.970103 0.373594 0.369306
O -1.927774 -1.053459 -1.481876
N 1.067891 -0.563372 -0.230195
C 3.273007 1.326957 -0.006063
C 3.123881 0.141601 0.978015
C 1.892117 1.761129 -0.554315
C 2.361043 -1.030932 0.320956
C 1.150841 0.560157 -1.187648
C -0.108968 -1.133269 0.202310
C -1.402832 -0.605192 -0.437489
C -3.343851 0.840157 -0.021843
C -3.772221 1.860196 1.026507
H 3.772705 2.179351 0.490647
H 3.923627 1.021911 -0.852084
H 4.116838 -0.215076 1.311124
H 2.570933 0.469624 1.879302
H 1.274172 2.170822 0.268278
H 2.006851 2.557331 -1.314423
H 2.963355 -1.458958 -0.507054
H 2.141408 -1.834021 1.043473
H 0.135702 0.848181 -1.507770
H 1.698192 0.216978 -2.090100
H -3.287126 1.268397 -1.039106
H -4.004901 -0.044139 -0.053686
H -4.786543 2.231971 0.792678
H -3.791156 1.405220 2.031119
H -3.083032 2.721759 1.047186


