%chk=000080908.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080908

0 1
 O   -3.811700      3.4200002E-02  0.3343000    
 O   -2.388900     -0.1478000      -1.471400    
 N  -0.2120000      3.5000000E-02  0.1554000    
 C   0.8523000      0.1418000       1.144300    
 C    2.216100      6.0600001E-02  0.5117000    
 C   -1.521200      0.1054000      0.7895000    
 C    2.827800      -1.176300      0.3627000    
 C    2.842700       1.223800      8.6800002E-02
 C   -2.586700     -2.0000000E-02 -0.2708000    
 C    4.091600      -1.251500     -0.2230000    
 C    4.106400       1.148600     -0.4990000    
 C    4.730800     -8.9100003E-02 -0.6538000    
 C   -4.938000     -7.0699997E-02 -0.5426000    
 C   -6.209100      6.0000001E-03  0.2760000    
 H   0.7598000     -0.6582000       1.890600    
 H   0.7695000       1.086000       1.699000    
 H  -0.1244000      0.7970000     -0.5177000    
 H   -1.647600     -0.7210000       1.497200    
 H   -1.653600       1.064900       1.301200    
 H    2.338200      -2.088000      0.6932000    
 H    2.364600       2.192500      0.2012000    
 H    4.577700      -2.215200     -0.3442000    
 H    4.604000       2.053600     -0.8350000    
 H    5.714600     -0.1476000      -1.110200    
 H   -4.914300      0.7508000      -1.267300    
 H   -4.898100      -1.027200      -1.075400    
 H   -7.092100     -7.1099997E-02 -0.3645000    
 H   -6.238800     -0.7988000       1.017800    
 H   -6.254800      0.9499000      0.8292000    


%chk=000080908-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000080908

0 1
O -3.862308 -0.064882 0.395455
O -2.451693 0.100814 -1.455945
N -0.225875 0.193977 0.243052
C 0.897960 0.753782 1.010390
C 2.248890 0.339994 0.435148
C -1.550843 0.424604 0.817673
C 2.430187 -0.945473 -0.135610
C 3.352650 1.227211 0.490104
C -2.629308 0.130699 -0.215996
C 3.692864 -1.336448 -0.634162
C 4.618486 0.835592 -0.002741
C 4.792760 -0.449145 -0.567312
C -5.024405 -0.295892 -0.522733
C -6.250817 -0.490750 0.361556
H 0.812647 0.372489 2.050603
H 0.861598 1.870223 1.090854
H -0.196214 0.400330 -0.763782
H -1.720779 -0.212091 1.706627
H -1.720746 1.481254 1.156520
H 1.569026 -1.620108 -0.187556
H 3.221550 2.229629 0.917577
H 3.819570 -2.332170 -1.074807
H 5.462935 1.532665 0.046328
H 5.771935 -0.752743 -0.954804
H -5.115278 0.579626 -1.191010
H -4.800915 -1.181913 -1.143514
H -7.141773 -0.664154 -0.269106
H -6.122445 -1.360660 1.027889
H -6.434858 0.401139 0.984500


