%chk=000100010.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000100010

0 1
 O    2.817200     -0.4300000      -1.335200    
 O    4.689200      -1.735800      0.2103000    
 O   0.2597000       1.239800      -1.119700    
 O   -2.543200      -2.782300      0.1727000    
 O  -0.5833000      -1.794100      3.0800000E-02
 N    1.685100       1.297500      0.7145000    
 N   -1.952200      0.6802000      0.4595000    
 N   -3.671800     -0.3019000     -0.5133000    
 N   -1.845300      -1.733100      7.2499998E-02
 C    3.640000      0.3215000     -0.4421000    
 C    2.898900       1.582900     -2.9000000E-03
 C  -0.6472000      0.8565000       1.089200    
 C   0.4517000       1.147800      8.9800000E-02
 C    4.031800     -0.5812000      0.7233000    
 C   -2.478400     -0.4867000      5.7999999E-03
 C   -2.845500       1.675200      0.2250000    
 C   -3.906500       1.043700     -0.3803000    
 H    4.536600      0.6052000      -1.005200    
 H    3.532100       2.188500      0.6538000    
 H    2.643400       2.183700     -0.8830000    
 H  -0.7356000       1.713800       1.768100    
 H  -0.4154000     -1.8100001E-02   1.703000    
 H    1.742800       1.198700       1.724000    
 H    3.150400     -0.9310000       1.270400    
 H    4.706800     -6.5200001E-02   1.412800    
 H   -2.666800       2.707700      0.4911000    
 H    3.319000      -1.219600      -1.600400    
 H   -4.827100       1.489600     -0.7274000    
 H    4.928500      -2.289500      0.9730000    


%chk=000100010-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000100010

0 1
O 1.788283 0.088834 -1.209170
O 3.010974 -2.213987 -0.515886
O 0.455769 3.199033 0.219104
O 0.144749 -2.477722 0.047571
O 0.165298 -1.071887 1.850344
N 1.546277 1.386071 1.236924
N -1.532675 0.731088 0.444878
N -1.932274 -0.942798 -1.074075
N -0.273316 -1.421211 0.662727
C 3.014648 0.251635 -0.425633
C 2.806149 1.485086 0.485737
C -0.893804 1.583048 1.478142
C 0.445530 2.148738 0.923223
C 3.316443 -1.064986 0.352494
C -1.228593 -0.578249 0.023843
C -2.460607 1.205537 -0.468941
C -2.704985 0.158816 -1.384070
H 3.870005 0.468741 -1.101053
H 3.666881 1.588901 1.173960
H 2.741900 2.395497 -0.132702
H -1.565142 2.433657 1.669418
H -0.758138 0.995051 2.395883
H 1.368129 0.520125 1.759859
H 2.728654 -1.129573 1.289081
H 4.391431 -1.115887 0.600901
H -2.843095 2.221310 -0.414419
H 1.870123 -0.797209 -1.659086
H -3.385253 0.153160 -2.231691
H 2.161541 -2.637018 -0.217263


